A0A3Q0KVG7_SCHMA Loading...

Cyclic nucleotide-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KVG7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,327 aa.

						>A0A3Q0KVG7_SCHMA|A0A3Q0KVG7
MSKAKQHWRRRANPSFYMITSEEVGDNHGHSSNIGHDRSLGDLINLSEQSDSGGDKNICKQSSEPHLSKSDELIKSESRSSIDQSKPSKYIPHSHTTTTITNQNERIESERITYPKHSLSSNQINYSSNKHKNVSNNNNTPTDSPLINDSQELFTYISNNEHCNVNKPVQDNSGCINSDSNQEVQPPHTGWNNSRNFLTHTPNRVHFTFSKSIDADDDNHTSLRGLFNRTFRPNLRRAISEVKDVYNPDNTEGSLTERNSQQQQQNHSHRSQNKLHRHLQQQLHNIKLISHPASRSHQQSALHLNYHTATNQPYLQPYRINEFTNTFEQVYNTPQKFDSSILEIPVDMYDESMSDDAFSRKNWPSCDFSRIDSEHSIHSGRLHEMTTSDTFKERDLLLNKNITNNNETNIVVHSVPKKSNRLNAVRRMNTTAVEQHHPFSNNDRFNFRKQTKHQPSSSKTENYPCTNKKYTHGTLSQDNINTSACKLLDSSSIELGSDSMQSRPVPATTLYRSSSSGTRNPEFINDIGVDQTFINTGIGVPNSPITLADKSTVTSSINSSTMIILQNNATSTTPTTTAITALANGSVNESTVDPLKQSTSSYLKEQFQAFFQPSDNKLAMKLFGSKNALLKEKRRQVQQGKWVIHPCSNFRFYWDLLMLMLLIANLIILPVAISFFNDDLSIHWIIFNSISDVVFIADIAVKFRTGIVTNDYADEIILNPKEIARHYLKSWFILDFISSIPMDYLYLIFNKKDHYNQFFSAGRTLRILRLAKLLSMLRLLRLTRLVRYVSQWEEFLNIASKFMGIFNLVLLMLLLGHWNACLQYLIPMLMDFPPDSWVKRCKLENADWFQQYTWALFKAMSHMLSIGYGRFPPTSIGEAWITIVSMMSGATCYALFVGHAAALIQSFDTSKRLYREKFKQVEEYMAYRKLPRALRQRIANYYEHRYQGKMFDEAQILNEFSECLREQVINYNCRALVAAVPFFTYADQDFVSEVVTKLKFEVFQPGDLIIKEGTIGNKMYFIQEGIVDIITKDGEVATSLSDGSYFGEITLLTNTRRTASVKAVVYSNLYSLDRESFLSVLENYPLMRRTMESVAAERLNKIGQNPSIVSNREDLKEDLSLVKEIVSSAVTPEDSSSGPDTENEENQAHLNLKQLLKFRKRKPSNRNKLFDNTVTKLSQTNEEDETLHDIERKSSFVEITSVDKLKLPKFMRQKRSSSNVFTNLTQNLPNLSKSKMISDNSGEREINKCRKSDLQPSENDTNPCHNSNTNVTNLQSSNLNPNCTIITITNYNTDDTTNNNNKTINSNTDTNQRLSSSDISDVDSCKH
					

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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	37.1	Very low	39.4	Very low	200 Å²	200	151.5 Å²	151.5	99%	0.985	68%	0.678	S	S	*	*				0	-44.5	0	-74.6	162.9	78.3	0	0	115	K3 A4 K5	M1-K3 PolarHBondContact O-N 2.9Å; M1-A4 WeakPolarHBondContact O-CA 3.18Å; M1-A4 WeakPolarHBondContact O-CB 3.34Å; M1-A4 PolarHBondContact O-N 3.15Å; M1-K5 PolarHBondContact O-N 3.08Å
2	S	36.2	Very low	39	Very low	90 Å²	90	145.2 Å²	145.2	63%	0.629	67%	0.673	S	S	*	*	H	α-helix	trans	-52.3	-50.5	-173.9	-173.1	0	0	0	0	115	A4 K5 Q6	S2-A4 PolarHBondContact O-N 2.69Å; S2-K5 CarbonylContact O-C 3.59Å; S2-K5 WeakPolarHBondContact O-CA 3.25Å; S2-K5 WeakPolarHBondContact O-CB 3.13Å; S2-K5 PolarHBondContact O-N 3.27Å; S2-Q6 PolarHBondContact O-N 3.46Å
3	K	39.1	Very low	38.4	Very low	176 Å²	176	141 Å²	141	77%	0.765	66%	0.659	S	S	*	*	H	α-helix	trans	-59.5	-30.1	176	-70.3	-175	176.3	-179.3	0	113.6	M1 Q6 H7	M1-K3 PolarHBondContact O-N 2.9Å; K3-Q6 PolarHBondContact O-N 2.84Å; K3-H7 PolarHBondContact O-N 3.29Å
4	A	43.9	Very low	37.8	Very low	60 Å²	60	139.9 Å²	139.9	50%	0.496	67%	0.67	S	S	.	*	H	α-helix	trans	-73.5	-37.7	173.3	0	0	0	0	0	112.3	M1 S2 Q6 H7 W8	M1-A4 WeakPolarHBondContact O-CA 3.18Å; M1-A4 WeakPolarHBondContact O-CB 3.34Å; M1-A4 PolarHBondContact O-N 3.15Å; S2-A4 PolarHBondContact O-N 2.69Å; A4-Q6 VanDerWaalsContact C-N 3.31Å; A4-Q6 PolarHBondContact O-N 3.01Å; A4-H7 PolarHBondContact O-N 3.09Å; A4-W8 PolarHBondContact O-N 2.99Å
5	K	42.2	Very low	37.2	Very low	152 Å²	152	138.1 Å²	138.1	66%	0.661	68%	0.678	S	S	*	*	H	α-helix	trans	-62.3	-36.4	168.9	-84.2	-175.2	172.9	177.7	0	111.5	M1 S2 R9	M1-K5 PolarHBondContact O-N 3.08Å; S2-K5 CarbonylContact O-C 3.59Å; S2-K5 WeakPolarHBondContact O-CA 3.25Å; S2-K5 WeakPolarHBondContact O-CB 3.13Å; S2-K5 PolarHBondContact O-N 3.27Å; K5-R9 WeakPolarHBondContact O-CB 3.43Å; K5-R9 WeakPolarHBondContact O-CG 3.36Å; K5-R9 PolarHBondContact O-N 3.32Å
6	Q	44.9	Very low	36.7	Very low	111 Å²	111	139.6 Å²	139.6	52%	0.519	68%	0.68	S	S	.	*	H	α-helix	trans	-66.8	-42	171.1	-80.4	-178.8	-33.3	0	0	112.7	S2 K3 A4 W8 R9 R10	S2-Q6 PolarHBondContact O-N 3.46Å; K3-Q6 PolarHBondContact O-N 2.84Å; A4-Q6 VanDerWaalsContact C-N 3.31Å; A4-Q6 PolarHBondContact O-N 3.01Å; Q6-W8 VanDerWaalsContact C-N 3.33Å; Q6-W8 PolarHBondContact O-N 2.83Å; Q6-R9 PolarHBondContact O-N 3.18Å; Q6-R10 WeakPolarHBondContact O-CB 3.01Å; Q6-R10 WeakPolarHBondContact O-CG 3.47Å; Q6-R10 PolarHBondContact O-N 3.48Å
7	H	40.5	Very low	36.2	Very low	102 Å²	102	141.8 Å²	141.8	47%	0.472	68%	0.681	S	S	.	*	H	α-helix	trans	-63.9	-37.6	178.2	-161.1	-21.9	0	0	0	112.2	K3 A4 R11	K3-H7 PolarHBondContact O-N 3.29Å; A4-H7 PolarHBondContact O-N 3.09Å; H7-R11 PolarHBondContact O-N 2.88Å
8	W	35.4	Very low	35.6	Very low	200 Å²	200	142.9 Å²	142.9	76%	0.758	69%	0.687	S	S	*	*	H	α-helix	trans	-71.3	-45.1	171.8	-93.2	84.6	0	0	0	112.8	A4 Q6 R10 R11 A12	A4-W8 PolarHBondContact O-N 2.99Å; Q6-W8 VanDerWaalsContact C-N 3.33Å; Q6-W8 PolarHBondContact O-N 2.83Å; W8-R10 PolarHBondContact O-N 3.21Å; W8-R10 VanDerWaalsContact O-N 3.13Å; W8-R11 PolarHBondContact O-N 2.75Å; W8-A12 WeakPolarHBondContact O-CB 3.28Å; W8-A12 PolarHBondContact O-N 3.38Å; W8-A12 VanDerWaalsContact O-N 3.14Å
9	R	37.6	Very low	35.2	Very low	154 Å²	154	142.2 Å²	142.2	58%	0.581	69%	0.686	S	S	*	*	H	α-helix	trans	-56	-29.1	172.7	-79.7	-160.4	-167.7	-167.4	10.3	112.3	K5 Q6 E923	K5-R9 WeakPolarHBondContact O-CB 3.43Å; K5-R9 WeakPolarHBondContact O-CG 3.36Å; K5-R9 PolarHBondContact O-N 3.32Å; Q6-R9 PolarHBondContact O-N 3.18Å; R9-E923 IonicContact CZ-OE1 3.84Å; R9-E923 IonicContact CZ-OE2 3.96Å; R9-E923 IonicContact NH1-OE1 2.7Å; R9-E923 PolarHBondContact NH1-OE1 3.44Å; R9-E923 IonicContact NH1-OE2 2.84Å; R9-E923 PolarHBondContact NH1-OE2 3.01Å; R9-E923 IonicContact NH2-OE1 3.5Å; R9-E923 PolarHBondContact NH2-OE1 3.27Å
10	R	38	Very low	34.7	Very low	219 Å²	219	140.9 Å²	140.9	83%	0.826	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-12.9	177.3	-77.1	-174.5	174.7	-172.6	-1.9	115.8	Q6 W8	Q6-R10 WeakPolarHBondContact O-CB 3.01Å; Q6-R10 WeakPolarHBondContact O-CG 3.47Å; Q6-R10 PolarHBondContact O-N 3.48Å; W8-R10 PolarHBondContact O-N 3.21Å; W8-R10 VanDerWaalsContact O-N 3.13Å
11	R	38.1	Very low	34.3	Very low	203 Å²	203	137.6 Å²	137.6	77%	0.766	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-12.8	176.2	-82.7	-175.2	170.1	164.7	-3.3	114.3	H7 W8 N13	H7-R11 PolarHBondContact O-N 2.88Å; W8-R11 PolarHBondContact O-N 2.75Å; R11-N13 VanDerWaalsContact C-N 3.32Å; R11-N13 PolarHBondContact O-N 3.15Å
12	A	35.6	Very low	33.8	Very low	75 Å²	75	136.3 Å²	136.3	62%	0.62	67%	0.67	S	S	*	*	S	Bend	trans	-88.4	30	-176.9	0	0	0	0	0	114.9	W8	W8-A12 WeakPolarHBondContact O-CB 3.28Å; W8-A12 PolarHBondContact O-N 3.38Å; W8-A12 VanDerWaalsContact O-N 3.14Å
13	N	31.3	Very low	33.4	Very low	91 Å²	91	140.7 Å²	140.7	49%	0.487	68%	0.681	S	S	.	*			trans	-143.2	99	-175.5	-173.7	4.2	0	0	0	114.4	R11 S15	R11-N13 VanDerWaalsContact C-N 3.32Å; R11-N13 PolarHBondContact O-N 3.15Å; N13-S15 PolarHBondContact OD1-N 3.32Å; N13-S15 VanDerWaalsContact OD1-N 3.07Å
14	P	29.7	Very low	32.9	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	68%	0.682	S	S	*	*			trans	-115.1	54.3	163.1	39.2	-28.9	0	0	0	112.2
15	S	28.5	Very low	32.2	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	69%	0.694	S	S	*	*			trans	-140.9	56.2	162.4	-73.4	0	0	0	0	110	N13	N13-S15 PolarHBondContact OD1-N 3.32Å; N13-S15 VanDerWaalsContact OD1-N 3.07Å
16	F	29.1	Very low	31.5	Very low	162 Å²	162	138.4 Å²	138.4	71%	0.711	70%	0.698	S	S	*	*			trans	-76.2	135.5	175.4	-127.5	-106.3	0	0	0	110.5
17	Y	28	Very low	30.8	Very low	178 Å²	178	140.1 Å²	140.1	70%	0.698	71%	0.71	S	S	*	*			trans	8.2	114.6	157.3	-64.3	-104.1	0	0	0	117.8	I19	Y17-I19 HydrophobicContact CD1-CD1 3.9Å; Y17-I19 HydrophobicContact CD1-CG1 4.09Å; Y17-I19 HydrophobicContact CE1-CD1 4.28Å
18	M	26	Very low	30.3	Very low	162 Å²	162	143.7 Å²	143.7	80%	0.798	73%	0.727	S	S	*	*				-106.9	109.5	124.5	-86.4	-159	-53.1	0	0	107.7	T20	M18-T20 HydrophobicContact CB-CG2 4.28Å; M18-T20 HydrophobicContact SD-CG2 4.04Å
19	I	26.8	Very low	30	Very low	128 Å²	128	137.8 Å²	137.8	66%	0.656	73%	0.728	S	S	*	*			trans	-77	119.9	145.6	-69.6	160.7	0	0	0	104.5	Y17	Y17-I19 HydrophobicContact CD1-CD1 3.9Å; Y17-I19 HydrophobicContact CD1-CG1 4.09Å; Y17-I19 HydrophobicContact CE1-CD1 4.28Å
20	T	26.2	Very low	29.7	Very low	116 Å²	116	139.6 Å²	139.6	71%	0.712	74%	0.743	S	S	*	*			trans	-133.1	66	163.5	53.8	0	0	0	0	106.8	M18	M18-T20 HydrophobicContact CB-CG2 4.28Å; M18-T20 HydrophobicContact SD-CG2 4.04Å
21	S	25.8	Very low	29.3	Very low	73 Å²	73	133.6 Å²	133.6	51%	0.51	74%	0.735	S	S	.	*			trans	-135.3	131.9	171.7	-76.1	0	0	0	0	105.5
22	E	26.2	Very low	28.8	Very low	172 Å²	172	128.2 Å²	128.2	80%	0.804	73%	0.728	S	S	*	*			trans	57.5	151.4	-177	-61.3	75.3	-105.9	0	0	115.5
23	E	29	Very low	28.4	Very low	182 Å²	182	130.9 Å²	130.9	85%	0.85	73%	0.732	S	S	*	*			cis	-112.6	129.9	3.1	-67	163.7	161.1	0	0	111	G25	E23-G25 PolarHBondContact O-N 3.24Å
24	V	28.3	Very low	28.3	Very low	130 Å²	130	133.9 Å²	133.9	79%	0.788	75%	0.746	S	S	*	*			trans	-92.9	84.8	154.6	176.9	0	0	0	0	105.9	D26	V24-D26 PolarHBondContact O-N 3.49Å
25	G	28.8	Very low	28.3	Very low	74 Å²	74	130.6 Å²	130.6	76%	0.763	74%	0.735	S	S	*	*			trans	-76.3	56.5	179	0	0	0	0	0	112.9	E23 N27	E23-G25 PolarHBondContact O-N 3.24Å; G25-N27 PolarHBondContact O-N 3.12Å
26	D	28.4	Very low	28.3	Very low	137 Å²	137	133.7 Å²	133.7	73%	0.733	74%	0.737	S	S	*	*			trans	-73	100.5	167.5	-87.5	-41.1	0	0	0	109.1	V24	V24-D26 PolarHBondContact O-N 3.49Å
27	N	29.3	Very low	28.2	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	73%	0.728	S	S	*	*			trans	-154.5	123.7	149.7	-110.8	-39.2	0	0	0	114.4	G25	G25-N27 PolarHBondContact O-N 3.12Å
28	H	29.8	Very low	28.2	Very low	177 Å²	177	132.4 Å²	132.4	82%	0.819	73%	0.733	S	S	*	*			trans	0.2	109.2	162.8	-65.8	-73.6	0	0	0	119.9
29	G	29.4	Very low	28.2	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	73%	0.73	S	S	*	*			trans	-129.1	108.7	155	0	0	0	0	0	111.1
30	H	30.7	Very low	28.1	Very low	191 Å²	191	131.4 Å²	131.4	88%	0.884	74%	0.74	S	S	*	*			trans	-58.9	153.6	163.1	-79	-16.6	0	0	0	110.1
31	S	29.9	Very low	28.2	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	74%	0.736	S	S	*	*			cis	-158.4	168.9	10.9	148.7	0	0	0	0	110.5
32	S	27.2	Very low	28.3	Very low	89 Å²	89	131.8 Å²	131.8	62%	0.622	75%	0.746	S	S	*	*			trans	-28.2	166.1	139.4	78.9	0	0	0	0	115.5
33	N	27.1	Very low	28.4	Very low	131 Å²	131	129.6 Å²	129.6	70%	0.701	74%	0.74	S	S	*	*			cis	-168.9	168.8	23.6	-140.6	-20.8	0	0	0	110.1
34	I	30.8	Very low	28.5	Very low	155 Å²	155	127.6 Å²	127.6	80%	0.795	73%	0.733	S	S	*	*			trans	66.7	148.6	159.8	-58.2	155.2	0	0	0	114.7
35	G	28.4	Very low	28.6	Very low	56 Å²	56	126.7 Å²	126.7	58%	0.577	72%	0.724	S	S	*	*			cis	137.9	112.7	-9.8	0	0	0	0	0	113.6
36	H	29.4	Very low	28.6	Very low	178 Å²	178	129.9 Å²	129.9	82%	0.824	72%	0.723	S	S	*	*			trans	65	140.6	159.9	-88.4	-78.6	0	0	0	122.4
37	D	27.1	Very low	28.7	Very low	100 Å²	100	127.3 Å²	127.3	54%	0.535	72%	0.716	S	S	.	*			trans	61.1	123.3	142.8	-79.1	43.2	0	0	0	123.8
38	R	26.7	Very low	28.7	Very low	213 Å²	213	127.4 Å²	127.4	80%	0.804	71%	0.711	S	S	*	*			trans	67.8	92.5	130.7	-64.8	-179.8	-161.8	-138.9	-0.3	119.4
39	S	27.8	Very low	28.7	Very low	103 Å²	103	126 Å²	126	72%	0.72	71%	0.705	S	S	*	*				66.1	142.1	109.7	73	0	0	0	0	121.4
40	L	24.9	Very low	28.7	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	70%	0.703	S	S	*	*			trans	79.6	105.6	145	-135	173.9	0	0	0	115.9
41	G	27.3	Very low	28.7	Very low	62 Å²	62	125.1 Å²	125.1	64%	0.639	70%	0.697	S	S	*	*			trans	86.1	157.1	163.2	0	0	0	0	0	114.9
42	D	28.1	Very low	28.7	Very low	135 Å²	135	125.6 Å²	125.6	72%	0.722	70%	0.701	S	S	*	*			cis	-163.5	171	-14.8	-130.5	-23.7	0	0	0	109.5
43	L	27.6	Very low	29	Very low	127 Å²	127	125.4 Å²	125.4	67%	0.665	71%	0.713	S	S	*	*			trans	44.5	136.5	145.6	-63.3	165.3	0	0	0	118.6
44	I	31.4	Very low	29.1	Very low	139 Å²	139	122.8 Å²	122.8	71%	0.713	72%	0.717	S	S	*	*				162.8	147.1	65.4	-128.4	152.4	0	0	0	103.6
45	N	29.7	Very low	29.2	Very low	112 Å²	112	121.4 Å²	121.4	60%	0.599	71%	0.711	S	S	*	*			cis	-164.5	159.7	-5.1	-133.5	3.6	0	0	0	110.3
46	L	28.9	Very low	29.5	Very low	141 Å²	141	126.3 Å²	126.3	74%	0.738	72%	0.716	S	S	*	*			trans	62.5	151.9	146	-66.5	167.3	0	0	0	119.1
47	S	31.2	Very low	29.6	Very low	83 Å²	83	124.7 Å²	124.7	58%	0.58	71%	0.714	S	S	*	*			cis	-151	139.3	7.9	33.4	0	0	0	0	112.1
48	E	29.8	Very low	29.8	Very low	148 Å²	148	127 Å²	127	69%	0.692	72%	0.724	S	S	*	*			trans	62.2	149.3	130	-58.2	175	132.3	0	0	120
49	Q	29.6	Very low	29.8	Very low	147 Å²	147	121.7 Å²	121.7	69%	0.687	72%	0.719	S	S	*	*			cis	-166.8	160.2	-7.1	-114.5	162.6	19.1	0	0	109.2
50	S	29.2	Very low	29.9	Very low	105 Å²	105	125.1 Å²	125.1	73%	0.734	72%	0.721	S	S	*	*			trans	63.8	151	154.9	71.8	0	0	0	0	118.6
51	D	29.9	Very low	30.1	Very low	145 Å²	145	125.3 Å²	125.3	78%	0.775	72%	0.717	S	S	*	*			cis	-156.5	172	-12.6	-127.1	-43.2	0	0	0	112.4
52	S	31.3	Very low	30.2	Very low	104 Å²	104	127.1 Å²	127.1	73%	0.727	72%	0.72	S	S	*	*			trans	20.3	118.5	160.1	65	0	0	0	0	119.6
53	G	32	Very low	30.3	Very low	85 Å²	85	126 Å²	126	88%	0.876	72%	0.723	S	S	*	*				93.6	150.2	80.1	0	0	0	0	0	112.4
54	G	30	Very low	30.4	Very low	76 Å²	76	126.7 Å²	126.7	78%	0.784	72%	0.723	S	S	*	*			cis	149	95.8	-9	0	0	0	0	0	112.9
55	D	32.3	Very low	30.5	Very low	126 Å²	126	126 Å²	126	67%	0.674	73%	0.728	S	S	*	*			trans	-173.4	153.5	158.9	-128.3	-26.9	0	0	0	114.2
56	K	34.6	Very low	30.7	Very low	159 Å²	159	127.4 Å²	127.4	69%	0.691	73%	0.73	S	S	*	*			trans	34.3	123.4	159.4	-60.3	136.1	-169.9	157	0	117.8
57	N	33	Very low	30.8	Very low	144 Å²	144	127.8 Å²	127.8	77%	0.77	73%	0.732	S	S	*	*			cis	-176	164.6	17.3	-109.1	-20.6	0	0	0	107.2
58	I	30.3	Very low	30.8	Very low	147 Å²	147	127.8 Å²	127.8	75%	0.754	73%	0.732	S	S	*	*			cis	-149.7	-170.9	4.7	-145.8	167.7	0	0	0	110
59	C	27	Very low	30.9	Very low	102 Å²	102	128.5 Å²	128.5	69%	0.689	73%	0.733	S	S	*	*			trans	-61.9	159.3	175.4	-58.2	0	0	0	0	114.6
60	K	30.7	Very low	31.1	Very low	175 Å²	175	125.2 Å²	125.2	76%	0.761	73%	0.726	S	S	*	*			cis	-159.8	136.2	23.2	-143.8	157.7	-173	-179.6	0	113
61	Q	28.9	Very low	31.2	Very low	169 Å²	169	125.9 Å²	125.9	79%	0.79	72%	0.722	S	S	*	*			trans	23.9	141.1	141	-72.7	159.8	-34.3	0	0	120.9
62	S	29	Very low	31.3	Very low	101 Å²	101	127 Å²	127	71%	0.706	72%	0.722	S	S	*	*			cis	-164.8	172.3	9.3	55.3	0	0	0	0	115
63	S	30.1	Very low	31.2	Very low	112 Å²	112	128.4 Å²	128.4	78%	0.783	72%	0.721	S	S	*	*			trans	71.4	98.3	150.5	47.1	0	0	0	0	119.5
64	E	29.9	Very low	31.2	Very low	140 Å²	140	131 Å²	131	65%	0.654	71%	0.713	S	S	*	*			trans	-82.4	179.5	168	-143	-173.7	-93.5	0	0	111.5	H66	E64-H66 IonicContact OE1-CD2 3.92Å; E64-H66 IonicContact OE1-NE2 3.63Å; E64-H66 IonicContact OE2-CD2 2.67Å; E64-H66 PolarHBondContact OE2-CD2 2.69Å; E64-H66 IonicContact OE2-CG 3.18Å; E64-H66 PolarHBondContact OE2-N 2.98Å
65	P	33.4	Very low	31.2	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	72%	0.716	S	S	*	*				-141.6	155.3	73.4	33.6	-14.1	0	0	0	117.7
66	H	33.7	Very low	31.1	Very low	140 Å²	140	136.3 Å²	136.3	65%	0.648	72%	0.724	S	S	*	*			trans	-71.1	178.6	172.5	-91.2	-49.3	0	0	0	114.6	E64	E64-H66 IonicContact OE1-CD2 3.92Å; E64-H66 IonicContact OE1-NE2 3.63Å; E64-H66 IonicContact OE2-CD2 2.67Å; E64-H66 PolarHBondContact OE2-CD2 2.69Å; E64-H66 IonicContact OE2-CG 3.18Å; E64-H66 PolarHBondContact OE2-N 2.98Å
67	L	30.1	Very low	30.9	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	73%	0.733	S	S	*	*				-165	144.4	50.7	-155.8	67.7	0	0	0	109.9
68	S	32.5	Very low	30.8	Very low	83 Å²	83	137 Å²	137	58%	0.58	74%	0.739	S	S	*	*			cis	77	145.1	45.2	134.1	0	0	0	0	114.2
69	K	32	Very low	30.8	Very low	163 Å²	163	141.9 Å²	141.9	71%	0.709	75%	0.748	S	S	*	*			cis	-154.4	-178.7	2.3	-113.9	-156.3	157.1	-150.7	0	108.1	D71	K69-D71 IonicContact NZ-OD2 3.85Å; K69-D71 PolarHBondContact NZ-OD2 2.69Å
70	S	32.5	Very low	31	Very low	78 Å²	78	142.7 Å²	142.7	55%	0.545	76%	0.755	S	S	.	*			cis	77	147.4	22.1	103.9	0	0	0	0	117.2
71	D	32.8	Very low	30.9	Very low	118 Å²	118	139.6 Å²	139.6	63%	0.631	76%	0.755	S	S	*	*			cis	-120	-123.1	9.4	-68.6	-76.9	0	0	0	112.3	K69	K69-D71 IonicContact NZ-OD2 3.85Å; K69-D71 PolarHBondContact NZ-OD2 2.69Å
72	E	30.7	Very low	30.9	Very low	168 Å²	168	139 Å²	139	79%	0.785	76%	0.756	S	S	*	*			cis	-169	174.2	-5.4	-129.3	-156.2	-167	0	0	107.8
73	L	30.3	Very low	30.9	Very low	135 Å²	135	140 Å²	140	71%	0.707	75%	0.754	S	S	*	*			cis	-165.5	-162.7	-16.7	-140.5	-164.7	0	0	0	110
74	I	30.8	Very low	30.8	Very low	139 Å²	139	142.8 Å²	142.8	71%	0.713	75%	0.754	S	S	*	*			trans	107.1	114.2	151.7	-53	-165.2	0	0	0	122
75	K	29.9	Very low	30.9	Very low	195 Å²	195	142.1 Å²	142.1	85%	0.848	77%	0.765	S	S	*	*			trans	22.8	153.9	139.4	-61.6	178	-176.7	174	0	123.6
76	S	31.5	Very low	30.8	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	75%	0.751	S	S	*	*			cis	-167.6	-177.6	-8.1	47.2	0	0	0	0	113.1
77	E	29.9	Very low	30.7	Very low	188 Å²	188	140.5 Å²	140.5	88%	0.879	75%	0.754	S	S	*	*			trans	-95.9	165.2	-163.7	-51.1	170.3	97.1	0	0	118.8
78	S	31.1	Very low	30.7	Very low	129 Å²	129	136 Å²	136	90%	0.902	74%	0.735	S	S	*	*			trans	176.3	178.6	133.2	45.5	0	0	0	0	113.9
79	R	29	Very low	30.6	Very low	249 Å²	249	142.1 Å²	142.1	94%	0.94	75%	0.752	S	S	*	*			trans	-123.5	149.5	-170.3	-69	176.4	171.7	176.4	-3	114.6
80	S	31.5	Very low	30.4	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	74%	0.735	S	S	*	*			trans	-158.7	-173	150.8	65.8	0	0	0	0	111.7
81	S	29.1	Very low	30.1	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	74%	0.741	S	S	*	*			trans	-149.3	169.7	-169.3	-56.2	0	0	0	0	113.4
82	I	29.1	Very low	30.2	Very low	157 Å²	157	139.6 Å²	139.6	81%	0.805	74%	0.737	S	S	*	*			trans	107.7	139.4	162.9	-59.7	168.3	0	0	0	117.2
83	D	28.9	Very low	30.2	Very low	123 Å²	123	136.4 Å²	136.4	66%	0.658	72%	0.721	S	S	*	*			trans	71.2	116.7	163	-81.4	-41.3	0	0	0	126
84	Q	28.2	Very low	30.1	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	72%	0.715	S	S	*	*			trans	38.4	135.2	130.1	-66.7	179.2	74.6	0	0	124.2
85	S	31.2	Very low	30.2	Very low	126 Å²	126	131 Å²	131	88%	0.881	70%	0.699	S	S	*	*			trans	93.9	158.6	151.2	82.1	0	0	0	0	119.7
86	K	31.4	Very low	30.2	Very low	120 Å²	120	128.3 Å²	128.3	52%	0.522	70%	0.699	S	S	.	*			trans	-71.5	172	-167.9	-70.6	-162.9	172.9	-173.8	0	113.6	E161	K86-E161 WeakPolarHBondContact CD-OE2 3.17Å; K86-E161 WeakPolarHBondContact CE-OE2 2.83Å; K86-E161 VanDerWaalsContact CG-OE2 3.25Å; K86-E161 WeakPolarHBondContact CG-OE2 3.45Å; K86-E161 IonicContact NZ-OE2 2.78Å
87	P	32.8	Very low	30.1	Very low	112 Å²	112	128.2 Å²	128.2	73%	0.727	69%	0.693	S	S	*	*			cis	-136.5	-158.2	13.6	42.1	-22	0	0	0	115.3
88	S	29.8	Very low	30.1	Very low	55 Å²	55	123.1 Å²	123.1	39%	0.385	68%	0.675	S	S	.	*			trans	-73.9	146.9	-171.7	57.6	0	0	0	0	116.8
89	K	29.2	Very low	29.9	Very low	213 Å²	213	121.4 Å²	121.4	93%	0.926	66%	0.659	S	S	*	*			trans	-156.2	-174.8	134.7	-122	170.9	-174.2	174.5	0	112.1
90	Y	27.7	Very low	30.1	Very low	91 Å²	91	114.6 Å²	114.6	36%	0.357	64%	0.64	S	S	.	*			trans	-127	151.8	-149.9	-163.1	-124.5	0	0	0	113.4	I157 N159	Y90-I157 HydrophobicContact CD1-CG2 4.39Å; Y90-I157 HydrophobicContact CE1-CB 4.41Å; Y90-I157 HydrophobicContact CE1-CG2 3.48Å; Y90-I157 VanDerWaalsContact CE1-CG2 3.48Å; Y90-N159 HydrophobicContact CD2-CB 3.94Å; Y90-N159 HydrophobicContact CE2-CB 4.06Å
91	I	28.1	Very low	30	Very low	133 Å²	133	112.6 Å²	112.6	68%	0.682	62%	0.623	S	S	*	*			trans	57.3	169.8	167.5	49.1	174.4	0	0	0	118
92	P	33.3	Very low	30.1	Very low	82 Å²	82	114.2 Å²	114.2	53%	0.532	62%	0.624	S	S	.	*			cis	-129.6	-173.5	-12.2	18.8	6.7	0	0	0	114.3
93	H	30.7	Very low	30.1	Very low	100 Å²	100	114.6 Å²	114.6	46%	0.463	62%	0.622	S	S	.	*			trans	69.4	105.9	165.4	-56.4	-66	0	0	0	116.4	H95	H93-H95 AromaticContact CE1-NE2 3.94Å; H93-H95 AromaticContact CG-CD2 3.9Å; H93-H95 AromaticContact CG-NE2 3.98Å; H93-H95 AromaticContact ND1-CD2 3.46Å; H93-H95 PolarHBondContact ND1-CD2 3Å; H93-H95 AromaticContact ND1-NE2 3.08Å; H93-H95 PolarHBondContact ND1-NE2 3.19Å
94	S	30	Very low	30.1	Very low	83 Å²	83	115.8 Å²	115.8	58%	0.58	63%	0.628	S	S	*	*				53.1	154.9	70.7	61.4	0	0	0	0	113.5
95	H	32.7	Very low	30.1	Very low	78 Å²	78	117.1 Å²	117.1	36%	0.361	63%	0.634	S	S	.	*				167.4	143	83.2	-107.8	-63.8	0	0	0	110.3	H93 T97 T98 T99	H93-H95 AromaticContact CE1-NE2 3.94Å; H93-H95 AromaticContact CG-CD2 3.9Å; H93-H95 AromaticContact CG-NE2 3.98Å; H93-H95 AromaticContact ND1-CD2 3.46Å; H93-H95 PolarHBondContact ND1-CD2 3Å; H93-H95 AromaticContact ND1-NE2 3.08Å; H93-H95 PolarHBondContact ND1-NE2 3.19Å; H95-T97 CarbonylContact C-O 2.94Å; H95-T97 WeakPolarHBondContact CA-O 3.43Å; H95-T97 WeakPolarHBondContact CB-O 3.11Å; H95-T97 VanDerWaalsContact CG-O 3.29Å; H95-T97 PolarHBondContact ND1-O 3.11Å; H95-T98 WeakPolarHBondContact O-CA 3.33Å; H95-T98 WeakPolarHBondContact O-CB 3.44Å; H95-T98 PolarHBondContact O-OG1 3.22Å; H95-T99 VanDerWaalsContact CD2-C 3.49Å; H95-T99 PolarHBondContact CD2-O 3Å; H95-T99 VanDerWaalsContact CD2-O 3.27Å
96	T	28.6	Very low	30	Very low	139 Å²	139	121.6 Å²	121.6	85%	0.853	63%	0.632	S	S	*	*	S	Bend	trans	-152	103.4	151.5	-53.3	0	0	0	0	110	T98	T96-T98 WeakPolarHBondContact CA-OG1 3.45Å; T96-T98 PolarHBondContact OG1-OG1 2.85Å
97	T	30.1	Very low	29.8	Very low	117 Å²	117	122.7 Å²	122.7	72%	0.718	64%	0.642	S	S	*	*	S	Bend	cis	-27.3	122.9	-7.6	-61.3	0	0	0	0	112.9	H95	H95-T97 CarbonylContact C-O 2.94Å; H95-T97 WeakPolarHBondContact CA-O 3.43Å; H95-T97 WeakPolarHBondContact CB-O 3.11Å; H95-T97 VanDerWaalsContact CG-O 3.29Å; H95-T97 PolarHBondContact ND1-O 3.11Å
98	T	29.2	Very low	29.6	Very low	80 Å²	80	125.7 Å²	125.7	49%	0.491	65%	0.646	S	S	.	*			trans	-102.2	82.2	-162.9	-55.1	0	0	0	0	112.8	H95 T96 I100	H95-T98 WeakPolarHBondContact O-CA 3.33Å; H95-T98 WeakPolarHBondContact O-CB 3.44Å; H95-T98 PolarHBondContact O-OG1 3.22Å; T96-T98 WeakPolarHBondContact CA-OG1 3.45Å; T96-T98 PolarHBondContact OG1-OG1 2.85Å; T98-I100 HydrophobicContact CG2-CD1 4.41Å
99	T	27.5	Very low	29.4	Very low	93 Å²	93	127.6 Å²	127.6	57%	0.571	66%	0.66	S	S	*	*			trans	-152.3	74.9	177.8	16	0	0	0	0	113.3	H95	H95-T99 VanDerWaalsContact CD2-C 3.49Å; H95-T99 PolarHBondContact CD2-O 3Å; H95-T99 VanDerWaalsContact CD2-O 3.27Å
100	I	32.3	Very low	29.3	Very low	106 Å²	106	125.6 Å²	125.6	54%	0.544	65%	0.654	S	S	.	*				24	100.3	103.6	-56.2	166	0	0	0	115.2	T98	T98-I100 HydrophobicContact CG2-CD1 4.41Å
101	T	30.1	Very low	29.2	Very low	79 Å²	79	131.2 Å²	131.2	49%	0.485	67%	0.674	S	S	.	*			trans	59	148	146.5	65.2	0	0	0	0	122.7
102	N	30.5	Very low	29.1	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	69%	0.685	S	S	*	*			trans	69.2	126.7	157.4	-66.1	-18.6	0	0	0	116.2
103	Q	29.5	Very low	28.8	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	69%	0.687	S	S	*	*			cis	-151.1	151.4	23.3	-103.2	149.4	14.5	0	0	113.5
104	N	28.7	Very low	28.4	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	70%	0.702	S	S	*	*			trans	41.9	88.7	146.5	-59.6	-9.6	0	0	0	122.2
105	E	29.2	Very low	28.2	Very low	197 Å²	197	141.1 Å²	141.1	92%	0.921	72%	0.716	S	S	*	*			trans	-170.8	91.2	133.6	-109.4	167.6	-159.7	0	0	107.1
106	R	29	Very low	27.9	Very low	220 Å²	220	140.3 Å²	140.3	83%	0.83	71%	0.712	S	S	*	*				72.3	74.1	68.8	-156.4	-176.5	-163.6	180	5.9	115
107	I	27.2	Very low	27.9	Very low	144 Å²	144	141.2 Å²	141.2	74%	0.738	71%	0.706	S	S	*	*			trans	55.1	99.8	142.9	-48.8	162	0	0	0	116.1
108	E	27.8	Very low	27.7	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	69%	0.685	S	S	*	*			trans	-136.7	135.4	137.1	-159.3	80	-96.8	0	0	107.1	E110	E108-E110 HydrophobicContact CG-CG 4.07Å
109	S	25.8	Very low	27.6	Very low	95 Å²	95	141 Å²	141	66%	0.664	70%	0.699	S	S	*	*			trans	-123.3	71.2	-179.2	69.9	0	0	0	0	110.3	R111	S109-R111 PolarHBondContact O-N 3.27Å
110	E	27.2	Very low	27.5	Very low	170 Å²	170	139.7 Å²	139.7	79%	0.794	69%	0.694	S	S	*	*			trans	-63.2	103.6	-177.4	-75	-116.6	106	0	0	111.7	E108 I112	E108-E110 HydrophobicContact CG-CG 4.07Å; E110-I112 PolarHBondContact O-N 2.97Å
111	R	24.8	Very low	27.2	Very low	209 Å²	209	138.8 Å²	138.8	79%	0.789	70%	0.697	S	S	*	*			trans	-71.3	120.9	156.4	-50.2	171	-156.7	-168.9	4.2	105.3	S109 T113	S109-R111 PolarHBondContact O-N 3.27Å; R111-T113 WeakPolarHBondContact CB-OG1 3.26Å; R111-T113 PolarHBondContact O-N 3.42Å; R111-T113 PolarHBondContact O-OG1 2.66Å; R111-T113 VanDerWaalsContact O-OG1 3.12Å
112	I	27	Very low	27.1	Very low	176 Å²	176	141.2 Å²	141.2	90%	0.903	71%	0.707	S	S	*	*			trans	-67.6	84.5	161.1	-60	-177.4	0	0	0	107.1	E110	E110-I112 PolarHBondContact O-N 2.97Å
113	T	26.3	Very low	26.9	Very low	94 Å²	94	141.9 Å²	141.9	58%	0.577	71%	0.706	S	S	*	*			trans	-79.5	147	177.1	-54.8	0	0	0	0	107.2	R111	R111-T113 WeakPolarHBondContact CB-OG1 3.26Å; R111-T113 PolarHBondContact O-N 3.42Å; R111-T113 PolarHBondContact O-OG1 2.66Å; R111-T113 VanDerWaalsContact O-OG1 3.12Å
114	Y	23.4	Very low	26.7	Very low	202 Å²	202	140.2 Å²	140.2	79%	0.792	70%	0.701	S	S	*	*			trans	-51	137.1	172.7	-59.5	-92.8	0	0	0	110.5	K116	Y114-K116 PolarHBondContact O-N 2.89Å
115	P	25.3	Very low	26.5	Very low	134 Å²	134	139 Å²	139	87%	0.87	70%	0.695	S	S	*	*	S	Bend	trans	-65.8	89.3	160.4	28	-32.3	0	0	0	108.3
116	K	25.8	Very low	26.3	Very low	62 Å²	62	140.1 Å²	140.1	27%	0.27	69%	0.692	S	S	.	*			trans	-140.9	91.2	164	-91.9	-159.9	175.9	-168.8	0	106.9	Y114 N1017 D1073 E1075	Y114-K116 PolarHBondContact O-N 2.89Å; K116-N1017 PolarHBondContact NZ-O 3.02Å; K116-D1073 HydrophobicContact CD-CB 4.36Å; K116-D1073 VanDerWaalsContact NZ-CB 3.27Å; K116-E1075 WeakPolarHBondContact CA-OE1 3.27Å; K116-E1075 WeakPolarHBondContact CB-OE1 3.39Å
117	H	28.8	Very low	26.1	Very low	158 Å²	158	134.3 Å²	134.3	73%	0.731	69%	0.685	S	S	*	*			trans	-152.1	107.5	153.7	-117.8	-75.1	0	0	0	111	L119 E1075	H117-L119 PolarHBondContact O-N 3.25Å; H117-E1075 WeakPolarHBondContact CA-OE1 3.41Å; H117-E1075 PolarHBondContact N-OE1 3.37Å; H117-E1075 PolarHBondContact N-OE2 3.35Å
118	S	26.1	Very low	26	Very low	38 Å²	38	131.8 Å²	131.8	27%	0.266	68%	0.68	S	S	.	*			trans	-66.1	125.7	161.7	51.4	0	0	0	0	109.7	E1075	S118-E1075 PolarHBondContact N-OE1 3.39Å; S118-E1075 PolarHBondContact N-OE2 2.65Å
119	L	27.1	Very low	25.8	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	68%	0.683	S	S	*	*			trans	-127.7	77.9	153.2	-88.2	165.5	0	0	0	108.1	H117 S121	H117-L119 PolarHBondContact O-N 3.25Å; L119-S121 PolarHBondContact O-N 3.5Å
120	S	25.4	Very low	25.7	Very low	67 Å²	67	135.9 Å²	135.9	47%	0.469	69%	0.691	S	S	.	*			trans	-72	101.1	153.2	50.4	0	0	0	0	107	E1082	S120-E1082 PolarHBondContact OG-OE1 3.04Å; S120-E1082 VanDerWaalsContact OG-OE1 3.06Å
121	S	26	Very low	25.7	Very low	86 Å²	86	134.9 Å²	134.9	60%	0.601	69%	0.686	S	S	*	*			trans	-161.8	120.8	164.4	-85.4	0	0	0	0	111.9	L119	L119-S121 PolarHBondContact O-N 3.5Å
122	N	27.8	Very low	25.9	Very low	130 Å²	130	133.4 Å²	133.4	70%	0.695	69%	0.686	S	S	*	*			trans	70.7	110.2	139.5	-61.2	-15.1	0	0	0	120
123	Q	26.7	Very low	26.1	Very low	157 Å²	157	131.4 Å²	131.4	73%	0.734	68%	0.677	S	S	*	*				68.5	109.4	115.5	-67.2	-175.8	-9.8	0	0	118
124	I	25.7	Very low	26.3	Very low	129 Å²	129	132.7 Å²	132.7	66%	0.662	68%	0.684	S	S	*	*				96.8	153.6	99.6	-75.2	168.5	0	0	0	110.9
125	N	24	Very low	26.7	Very low	124 Å²	124	127 Å²	127	66%	0.663	67%	0.673	S	S	*	*			trans	-40.8	145.7	169.3	-41.9	-50.9	0	0	0	112.2
126	Y	24.8	Very low	27	Very low	219 Å²	219	127.4 Å²	127.4	86%	0.859	67%	0.668	S	S	*	*				-150.7	129.8	87.6	-79.1	-80.9	0	0	0	107
127	S	25.2	Very low	27.5	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	69%	0.688	S	S	*	*			cis	85.1	138.9	39.4	-173.2	0	0	0	0	113.8
128	S	26	Very low	27.6	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	68%	0.684	S	S	*	*			trans	59.3	127.4	170.3	-162	0	0	0	0	118.1	K130	S128-K130 PolarHBondContact OG-N 2.93Å
129	N	23.4	Very low	28	Very low	165 Å²	165	133.7 Å²	133.7	88%	0.882	71%	0.707	S	S	*	*				-141.7	72.2	123.3	-133.4	-35	0	0	0	111.6
130	K	23.6	Very low	28	Very low	190 Å²	190	132.8 Å²	132.8	83%	0.826	71%	0.708	S	S	*	*	S	Bend	trans	-112.9	69.6	162.5	-153.7	179.8	-171.2	-177.9	0	110.9	S128	S128-K130 PolarHBondContact OG-N 2.93Å
131	H	26.7	Very low	28.3	Very low	149 Å²	149	134.5 Å²	134.5	69%	0.69	72%	0.718	S	S	*	*			trans	61.5	135.9	153.9	-81.4	-65.9	0	0	0	120.8
132	K	29.4	Very low	28.4	Very low	179 Å²	179	136 Å²	136	78%	0.778	72%	0.724	S	S	*	*			trans	74.8	134.8	152.3	-66.1	166.8	-175.3	-177.3	0	114.4
133	N	30.6	Very low	28.6	Very low	134 Å²	134	137.1 Å²	137.1	72%	0.717	73%	0.73	S	S	*	*			cis	-148.6	139.7	16.1	-108.8	-4.4	0	0	0	109.9
134	V	30.3	Very low	28.5	Very low	121 Å²	121	135 Å²	135	73%	0.733	73%	0.732	S	S	*	*				68.3	129.4	104.7	173	0	0	0	0	114.3
135	S	31.3	Very low	28.9	Very low	81 Å²	81	134.1 Å²	134.1	57%	0.566	74%	0.735	S	S	*	*			cis	-178.6	160.3	-8.5	56.9	0	0	0	0	111.8
136	N	33.2	Very low	29.1	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	74%	0.741	S	S	*	*			trans	66.9	158.3	151.4	-63.6	7	0	0	0	116.9
137	N	34.9	Very low	29.4	Very low	129 Å²	129	131.4 Å²	131.4	69%	0.69	73%	0.733	S	S	*	*			cis	-168.1	163	-7.1	-111.7	32.6	0	0	0	107.5
138	N	31.8	Very low	29.4	Very low	120 Å²	120	133.4 Å²	133.4	64%	0.642	74%	0.736	S	S	*	*			cis	-166.9	-176.2	-16.9	-139.1	61.3	0	0	0	110.2
139	N	33.3	Very low	29.6	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	74%	0.741	S	S	*	*			trans	76.1	107.9	157.5	-63.7	-1.4	0	0	0	121.3
140	T	28.7	Very low	29.9	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	73%	0.727	S	S	*	*			trans	-79.8	-168.7	148.6	50.7	0	0	0	0	109.6
141	P	31.8	Very low	30.2	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	73%	0.728	S	S	*	*			cis	-146.5	-178.4	12.5	42.6	-20	0	0	0	119.3
142	T	28.4	Very low	30.3	Very low	118 Å²	118	132.6 Å²	132.6	72%	0.724	73%	0.734	S	S	*	*			trans	43.4	122.1	149.7	50.1	0	0	0	0	121.8
143	D	30.6	Very low	30.2	Very low	153 Å²	153	130.6 Å²	130.6	82%	0.818	73%	0.731	S	S	*	*				-164.9	167.2	98.5	-102.5	-18.7	0	0	0	113.8
144	S	25.4	Very low	30.1	Very low	111 Å²	111	132.2 Å²	132.2	78%	0.776	73%	0.732	S	S	*	*			trans	-161.1	174.7	-176.5	-65.2	0	0	0	0	109.4
145	P	34.2	Very low	29.9	Very low	111 Å²	111	131.2 Å²	131.2	72%	0.721	73%	0.726	S	S	*	*			cis	-128.7	-176.9	-7.9	39.7	-23.5	0	0	0	113.5
146	L	28.2	Very low	29.6	Very low	151 Å²	151	137.1 Å²	137.1	79%	0.791	74%	0.737	S	S	*	*				168.4	153.9	127.2	-94.5	164.1	0	0	0	115.8
147	I	30.1	Very low	29.3	Very low	135 Å²	135	135.5 Å²	135.5	69%	0.692	73%	0.727	S	S	*	*			trans	76.5	115.2	154.8	-68.6	156.1	0	0	0	119.8
148	N	26.1	Very low	28.9	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	72%	0.719	S	S	*	*			trans	53.7	142.4	149.1	-57.7	3.1	0	0	0	119.7
149	D	30.8	Very low	28.7	Very low	141 Å²	141	132 Å²	132	75%	0.754	72%	0.715	S	S	*	*			cis	-157.4	153.2	49	-129.6	-39.1	0	0	0	117.5
150	S	29.5	Very low	28.4	Very low	83 Å²	83	130.3 Å²	130.3	58%	0.58	71%	0.705	S	S	*	*			trans	37.3	124.3	144.5	-67	0	0	0	0	125.9
151	Q	28.1	Very low	28.4	Very low	180 Å²	180	127.8 Å²	127.8	84%	0.841	68%	0.684	S	S	*	*			trans	69.8	145.7	136.8	-59.6	168.1	6.3	0	0	119.3
152	E	30	Very low	28.2	Very low	174 Å²	174	129.8 Å²	129.8	81%	0.813	69%	0.685	S	S	*	*			cis	-110.3	-104.8	9.8	-69.9	-176.1	74.8	0	0	115.4
153	L	27.4	Very low	28.1	Very low	138 Å²	138	130.8 Å²	130.8	72%	0.723	70%	0.695	S	S	*	*			trans	-159.3	166.1	-148.7	-85.1	104.2	0	0	0	111.2
154	F	28.5	Very low	27.9	Very low	168 Å²	168	129.5 Å²	129.5	74%	0.737	69%	0.688	S	S	*	*			cis	-162.8	154.3	-21.2	-121.2	-143.7	0	0	0	105.3
155	T	25.1	Very low	28.1	Very low	99 Å²	99	130.8 Å²	130.8	61%	0.607	69%	0.691	S	S	*	*			cis	75.8	143.4	16.6	82.8	0	0	0	0	114.9
156	Y	25.7	Very low	27.9	Very low	205 Å²	205	130.9 Å²	130.9	80%	0.804	69%	0.685	S	S	*	*			cis	-153.5	-167.3	-6.4	-149.3	-116.8	0	0	0	112.6
157	I	27.1	Very low	27.9	Very low	109 Å²	109	132.2 Å²	132.2	56%	0.559	69%	0.685	S	S	*	*			trans	-87.4	118.6	176.2	-61	167.8	0	0	0	111.9	Y90	Y90-I157 HydrophobicContact CD1-CG2 4.39Å; Y90-I157 HydrophobicContact CE1-CB 4.41Å; Y90-I157 HydrophobicContact CE1-CG2 3.48Å; Y90-I157 VanDerWaalsContact CE1-CG2 3.48Å
158	S	26.5	Very low	27.8	Very low	73 Å²	73	131.6 Å²	131.6	51%	0.51	69%	0.689	S	S	.	*			trans	64.4	157.5	141	-152	0	0	0	0	123.7
159	N	27.2	Very low	28	Very low	104 Å²	104	130.8 Å²	130.8	56%	0.556	69%	0.689	S	S	*	*			trans	60.7	131.5	165.5	-76.2	4.3	0	0	0	121.8	Y90	Y90-N159 HydrophobicContact CD2-CB 3.94Å; Y90-N159 HydrophobicContact CE2-CB 4.06Å
160	N	27.6	Very low	27.8	Very low	104 Å²	104	132 Å²	132	56%	0.556	69%	0.69	S	S	*	*			trans	64	138.1	164.3	-67.2	34.3	0	0	0	115.7
161	E	27.8	Very low	27.8	Very low	81 Å²	81	135.4 Å²	135.4	38%	0.379	70%	0.702	S	S	.	*			cis	-162.3	154	12.4	-136.5	164.7	-111.3	0	0	113.6	K86	K86-E161 WeakPolarHBondContact CD-OE2 3.17Å; K86-E161 WeakPolarHBondContact CE-OE2 2.83Å; K86-E161 VanDerWaalsContact CG-OE2 3.25Å; K86-E161 WeakPolarHBondContact CG-OE2 3.45Å; K86-E161 IonicContact NZ-OE2 2.78Å
162	H	27.5	Very low	27.7	Very low	147 Å²	147	133.4 Å²	133.4	68%	0.681	70%	0.697	S	S	*	*			trans	28	112.6	159.9	-68.6	-8.8	0	0	0	119.5
163	C	26.7	Very low	27.8	Very low	139 Å²	139	131.2 Å²	131.2	94%	0.939	70%	0.701	S	S	*	*				-127.5	139.9	122	-142.3	0	0	0	0	108.7
164	N	25.8	Very low	27.9	Very low	126 Å²	126	128 Å²	128	67%	0.674	70%	0.702	S	S	*	*			trans	-121.3	114.2	-161.4	179.1	13.7	0	0	0	111.5
165	V	31.3	Very low	28	Very low	138 Å²	138	125.4 Å²	125.4	84%	0.836	70%	0.703	S	S	*	*			trans	-132.7	94.2	172.4	-175.2	0	0	0	0	110.2
166	N	29.3	Very low	28.1	Very low	113 Å²	113	127.6 Å²	127.6	60%	0.604	71%	0.709	S	S	*	*			trans	-10.7	143.4	141.8	-59.7	-64.6	0	0	0	115.3
167	K	28.5	Very low	28.3	Very low	179 Å²	179	124.5 Å²	124.5	78%	0.778	71%	0.707	S	S	*	*			cis	-161.9	156.1	7.8	-113.8	168	-179.8	-179.3	0	107.1
168	P	26.5	Very low	28.4	Very low	122 Å²	122	123.4 Å²	123.4	79%	0.792	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-73.7	142.5	167.4	32.1	-33.3	0	0	0	110.7
169	V	30.4	Very low	28.6	Very low	124 Å²	124	126.4 Å²	126.4	75%	0.752	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-101.7	120.3	164.2	177.5	0	0	0	0	107.9
170	Q	26.5	Very low	28.7	Very low	165 Å²	165	126 Å²	126	77%	0.771	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-91.3	140.6	158.7	-61.6	173.9	-90.7	0	0	107.3
171	D	31.1	Very low	28.6	Very low	156 Å²	156	128.4 Å²	128.4	83%	0.834	74%	0.737	S	S	*	*			trans	-120.4	138.6	159.6	-91.7	-52.7	0	0	0	109.8
172	N	25.9	Very low	28.7	Very low	138 Å²	138	134.2 Å²	134.2	74%	0.738	76%	0.764	S	S	*	*			trans	-114.8	136.2	-175.2	-71.5	-58.4	0	0	0	111.2
173	S	31.7	Very low	28.5	Very low	128 Å²	128	135.7 Å²	135.7	90%	0.895	77%	0.771	S	S	*	*			trans	-178.1	136.8	149.2	23.3	0	0	0	0	105.8
174	G	30.2	Very low	28.6	Very low	71 Å²	71	136.1 Å²	136.1	73%	0.732	77%	0.769	S	S	*	*			cis	113.6	141.1	46	0	0	0	0	0	106.4
175	C	29.1	Very low	28.7	Very low	113 Å²	113	138.4 Å²	138.4	76%	0.764	78%	0.776	S	S	*	*			cis	-152.6	134.1	6.2	-83.5	0	0	0	0	106.9
176	I	28.3	Very low	28.8	Very low	144 Å²	144	137.2 Å²	137.2	74%	0.738	77%	0.771	S	S	*	*				78.5	134.9	87.6	-67.1	169.7	0	0	0	114.9
177	N	30	Very low	29	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	78%	0.779	S	S	*	*			trans	71.5	131	172	-68.2	-0.1	0	0	0	117.4
178	S	27.7	Very low	29.1	Very low	85 Å²	85	137.2 Å²	137.2	59%	0.594	78%	0.78	S	S	*	*			cis	93.5	150.9	43.9	88.5	0	0	0	0	112.3
179	D	30.9	Very low	29.4	Very low	137 Å²	137	138.5 Å²	138.5	73%	0.733	79%	0.786	S	S	*	*			cis	-155.5	175.8	24	-111	-54.5	0	0	0	114.4
180	S	29.7	Very low	29.4	Very low	94 Å²	94	136 Å²	136	66%	0.657	79%	0.785	S	S	*	*			trans	47.8	119	152	60.5	0	0	0	0	121.4
181	N	26.3	Very low	29.5	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	79%	0.793	S	S	*	*				65.9	113.7	73.7	-64.3	-25.7	0	0	0	116.6
182	Q	29	Very low	29.4	Very low	203 Å²	203	138.8 Å²	138.8	95%	0.949	79%	0.786	S	S	*	*				-178.3	170.8	103.3	-105.1	179.6	-7.8	0	0	114.1
183	E	23	Very low	29.7	Very low	179 Å²	179	139.1 Å²	139.1	84%	0.836	79%	0.788	S	S	*	*			trans	-134.9	132.6	-164.1	172.9	-176.8	-162.2	0	0	110.9
184	V	29.7	Very low	29.7	Very low	147 Å²	147	137.6 Å²	137.6	89%	0.891	78%	0.778	S	S	*	*			trans	-143.5	150.6	174.2	-173.7	0	0	0	0	111
185	Q	27.6	Very low	29.7	Very low	175 Å²	175	145 Å²	145	82%	0.818	78%	0.784	S	S	*	*			trans	-98.8	165.9	-159.6	-61.4	170.3	-14	0	0	115.8
186	P	33.8	Very low	29.8	Very low	112 Å²	112	146 Å²	146	73%	0.727	78%	0.782	S	S	*	*			trans	-112.7	158.3	175	40.4	-32.3	0	0	0	115.6
187	P	33.6	Very low	29.9	Very low	119 Å²	119	147.3 Å²	147.3	77%	0.773	78%	0.782	S	S	*	*			trans	-107.2	142.2	154.6	35.7	-27.2	0	0	0	111.3
188	H	29.5	Very low	29.9	Very low	173 Å²	173	146.6 Å²	146.6	80%	0.801	78%	0.778	S	S	*	*			cis	97.6	143.9	43.1	-95.9	-88.8	0	0	0	115.6
189	T	33.4	Very low	29.9	Very low	150 Å²	150	147.5 Å²	147.5	92%	0.92	78%	0.78	S	S	*	*			trans	71.6	152.2	-173.8	77.2	0	0	0	0	114.8
190	G	30.2	Very low	29.9	Very low	70 Å²	70	148.8 Å²	148.8	72%	0.722	78%	0.781	S	S	*	*			cis	159.7	148	-3.5	0	0	0	0	0	108.1
191	W	28.9	Very low	29.9	Very low	248 Å²	248	148.9 Å²	148.9	94%	0.939	78%	0.778	S	S	*	*			cis	-144.7	159.4	3.7	-101.1	4.3	0	0	0	107.5
192	N	28.3	Very low	30.3	Very low	132 Å²	132	148 Å²	148	71%	0.706	78%	0.78	S	S	*	*			cis	97.9	144.7	48.5	-149.6	11.3	0	0	0	113.8
193	N	33.2	Very low	30.4	Very low	145 Å²	145	145 Å²	145	78%	0.775	77%	0.771	S	S	*	*			trans	73.3	138.6	-170.6	-61.9	-29.8	0	0	0	117.4
194	S	32.1	Very low	30.5	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	76%	0.762	S	S	*	*			cis	-166.1	146.7	-13.5	53.8	0	0	0	0	112.8
195	R	29.1	Very low	30.5	Very low	225 Å²	225	142.8 Å²	142.8	85%	0.849	75%	0.75	S	S	*	*			trans	44.5	110.7	148.6	-68.7	174.3	179.5	154.4	-0.4	116.6
196	N	32.1	Very low	30.4	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	74%	0.738	S	S	*	*			cis	-166.9	-175.2	38.9	-86.6	-24.6	0	0	0	109.3
197	F	30	Very low	30.2	Very low	172 Å²	172	143.9 Å²	143.9	75%	0.754	74%	0.743	S	S	*	*			cis	-153.9	-166.5	9.4	-150.7	-142.1	0	0	0	113.9
198	L	30	Very low	29.9	Very low	125 Å²	125	144 Å²	144	65%	0.654	74%	0.741	S	S	*	*			trans	-74	166.3	174.8	-68	161.2	0	0	0	113.5
199	T	27	Very low	29.8	Very low	105 Å²	105	146.1 Å²	146.1	64%	0.644	75%	0.749	S	S	*	*			cis	178.4	175.3	-45.2	31.2	0	0	0	0	108.7
200	H	31.7	Very low	29.6	Very low	163 Å²	163	144 Å²	144	76%	0.755	74%	0.74	S	S	*	*			trans	83.1	97.2	157.1	-78.4	-70.2	0	0	0	122.3
201	T	29.5	Very low	29.4	Very low	96 Å²	96	150.5 Å²	150.5	59%	0.589	75%	0.748	S	S	*	*				38	117.2	120.8	54.9	0	0	0	0	120.9	N203	T201-N203 PolarHBondContact O-N 3.12Å
202	P	34.4	Very low	29.3	Very low	136 Å²	136	144 Å²	144	88%	0.883	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-78	118	160.8	32.1	-30.9	0	0	0	110.8
203	N	31.2	Very low	29.5	Very low	140 Å²	140	145 Å²	145	75%	0.749	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-90.7	159.6	177.2	-105.6	-24.9	0	0	0	112.9	T201 V205	T201-N203 PolarHBondContact O-N 3.12Å; N203-V205 PolarHBondContact O-N 2.98Å
204	R	24.3	Very low	29.2	Very low	175 Å²	175	146.2 Å²	146.2	66%	0.66	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-56.8	117.6	175.2	179.3	-179.4	175.9	-176	-1.2	111	H206 E252	R204-H206 PolarHBondContact NE-NE2 3.42Å; R204-H206 PolarHBondContact NH2-NE2 2.88Å; R204-E252 IonicContact CZ-OE1 2.73Å; R204-E252 IonicContact NH1-OE1 3.36Å; R204-E252 PolarHBondContact NH1-OE1 3.21Å; R204-E252 IonicContact NH2-OE1 2.69Å; R204-E252 PolarHBondContact NH2-OE1 3.38Å; R204-E252 IonicContact NH2-OE2 2.69Å
205	V	30.5	Very low	29.3	Very low	105 Å²	105	145.8 Å²	145.8	64%	0.636	75%	0.754	S	S	*	*			trans	-108.7	110.9	174.7	-176.6	0	0	0	0	110.4	N203 F207	N203-V205 PolarHBondContact O-N 2.98Å; V205-F207 HydrophobicContact CG1-CD2 3.84Å; V205-F207 HydrophobicContact CG1-CE2 3.61Å; V205-F207 HydrophobicContact CG1-CZ 4.19Å
206	H	25.8	Very low	29.5	Very low	122 Å²	122	142.8 Å²	142.8	57%	0.565	75%	0.754	S	S	*	*			trans	-79.3	132.4	161.3	-83.2	-141.2	0	0	0	108.9	R204	R204-H206 PolarHBondContact NE-NE2 3.42Å; R204-H206 PolarHBondContact NH2-NE2 2.88Å
207	F	29	Very low	29.6	Very low	189 Å²	189	144.4 Å²	144.4	83%	0.829	76%	0.763	S	S	*	*			trans	-101.2	88.9	167.7	-90.1	-77.6	0	0	0	110.4	V205 F209	V205-F207 HydrophobicContact CG1-CD2 3.84Å; V205-F207 HydrophobicContact CG1-CE2 3.61Å; V205-F207 HydrophobicContact CG1-CZ 4.19Å; F207-F209 PolarHBondContact O-N 3.41Å
208	T	28.7	Very low	29.8	Very low	120 Å²	120	143.2 Å²	143.2	74%	0.736	77%	0.765	S	S	*	*			trans	-73.9	116.8	167.2	43.5	0	0	0	0	110.1	S210	T208-S210 PolarHBondContact O-N 3.22Å
209	F	26	Very low	30	Very low	218 Å²	218	144.5 Å²	144.5	96%	0.956	77%	0.772	S	S	*	*			trans	-86.3	105.3	176.3	-128.9	-86.1	0	0	0	109.8	F207	F207-F209 PolarHBondContact O-N 3.41Å
210	S	28.8	Very low	30.6	Very low	105 Å²	105	146.9 Å²	146.9	73%	0.734	78%	0.775	S	S	*	*			trans	-124.1	157.1	175.1	65.7	0	0	0	0	111.8	T208	T208-S210 PolarHBondContact O-N 3.22Å
211	K	26.2	Very low	31	Very low	207 Å²	207	145.2 Å²	145.2	90%	0.9	78%	0.777	S	S	*	*			trans	-68	139.4	-172.4	-64.4	175.5	171.9	-174.6	0	113.1
212	S	27.7	Very low	31.7	Very low	111 Å²	111	145 Å²	145	78%	0.776	78%	0.779	S	S	*	*				-169	176.6	128.3	56.4	0	0	0	0	110.8
213	I	31.3	Very low	31.9	Very low	155 Å²	155	144.7 Å²	144.7	80%	0.795	77%	0.769	S	S	*	*			trans	79.7	77.6	-174.1	-47.7	175.5	0	0	0	113.4
214	D	28.2	Very low	32.3	Very low	170 Å²	170	147.4 Å²	147.4	91%	0.909	77%	0.769	S	S	*	*			trans	-81	134.6	144.4	-57	-71.8	0	0	0	108.1
215	A	34.5	Very low	33.4	Very low	88 Å²	88	140.5 Å²	140.5	73%	0.727	75%	0.752	S	S	*	*			trans	-164.4	135.7	165.7	0	0	0	0	0	108.3
216	D	32	Very low	33.9	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	74%	0.74	S	S	*	*			trans	-81.6	144.4	-170.8	-52.1	-82.3	0	0	0	113.3
217	D	35.6	Very low	34.9	Very low	170 Å²	170	138.9 Å²	138.9	91%	0.909	74%	0.738	S	S	*	*			trans	-168.3	131.3	131.4	-117.2	-25.5	0	0	0	110.9
218	D	33.7	Very low	36.1	Very low	147 Å²	147	132.8 Å²	132.8	79%	0.786	72%	0.715	S	S	*	*			trans	-91.7	120.4	-179	-95.4	-45.6	0	0	0	111.4
219	N	34.7	Very low	37.2	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	72%	0.718	S	S	*	*			trans	166.3	77.8	142.2	-93.4	-59.9	0	0	0	113.5
220	H	39.5	Very low	38.4	Very low	155 Å²	155	130.7 Å²	130.7	72%	0.718	70%	0.695	S	S	*	*			trans	-165.6	72	157.6	-101.7	-53.8	0	0	0	113.2
221	T	40.3	Very low	39.1	Very low	128 Å²	128	132.1 Å²	132.1	79%	0.785	69%	0.689	S	S	*	*	H	α-helix	trans	-84.9	-23.5	-170.3	45.2	0	0	0	0	116
222	S	43.4	Very low	40.6	Very low	91 Å²	91	128.3 Å²	128.3	64%	0.636	67%	0.669	S	S	*	*	H	α-helix	trans	-74.4	-58.1	-172.1	59.5	0	0	0	0	114.3	R224 G225 L226	S222-R224 PolarHBondContact O-N 3.39Å; S222-G225 PolarHBondContact O-N 3.01Å; S222-L226 PolarHBondContact O-N 2.78Å
223	L	39.2	Very low	42.1	Very low	130 Å²	130	126.3 Å²	126.3	68%	0.681	65%	0.653	S	S	*	*	H	α-helix	trans	-65.1	-37.3	-177.9	-77.3	167	0	0	0	112.5	G225 L226 F227	L223-G225 PolarHBondContact O-N 2.86Å; L223-L226 PolarHBondContact O-N 3.03Å; L223-L226 VanDerWaalsContact O-N 3.11Å; L223-F227 PolarHBondContact O-N 3.18Å; L223-F227 VanDerWaalsContact O-N 3.12Å
224	R	39.8	Very low	43.3	Very low	197 Å²	197	124 Å²	124	74%	0.743	64%	0.642	S	S	*	*	H	α-helix	trans	-60.8	-32.5	177.7	-144.3	178.3	-167.4	-166.5	6.1	111.4	S222 N228	S222-R224 PolarHBondContact O-N 3.39Å; R224-N228 WeakPolarHBondContact O-CB 3.41Å; R224-N228 PolarHBondContact O-N 3.21Å; R224-N228 PolarHBondContact O-ND2 3.18Å
225	G	46.9	Very low	44.5	Very low	30 Å²	30	120 Å²	120	31%	0.309	62%	0.62	S	S	.	*	H	α-helix	trans	-68.9	-40.4	173.7	0	0	0	0	0	113.7	S222 L223 R229	S222-G225 PolarHBondContact O-N 3.01Å; L223-G225 PolarHBondContact O-N 2.86Å; G225-R229 WeakPolarHBondContact O-CB 3.42Å; G225-R229 WeakPolarHBondContact O-CG 3.39Å; G225-R229 PolarHBondContact O-N 3.2Å
226	L	41	Very low	45.5	Very low	72 Å²	72	124.2 Å²	124.2	38%	0.377	62%	0.618	S	S	.	*	H	α-helix	trans	-71.8	-42.3	-176.6	-143.4	161.5	0	0	0	111.6	S222 L223 R229 T230	S222-L226 PolarHBondContact O-N 2.78Å; L223-L226 PolarHBondContact O-N 3.03Å; L223-L226 VanDerWaalsContact O-N 3.11Å; L226-R229 PolarHBondContact O-N 3.34Å; L226-T230 PolarHBondContact O-N 3.06Å; L226-T230 PolarHBondContact O-OG1 2.9Å
227	F	46.6	Very low	46.6	Very low	121 Å²	121	121.6 Å²	121.6	53%	0.531	60%	0.596	S	S	.	*	I	π-helix	trans	-61.2	-44.4	173.3	-173.1	-99.1	0	0	0	112.3	L223 F231 R232	L223-F227 PolarHBondContact O-N 3.18Å; L223-F227 VanDerWaalsContact O-N 3.12Å; F227-F231 HydrophobicContact CD2-CB 4.09Å; F227-F231 HydrophobicContact CE2-CB 4.27Å; F227-F231 PolarHBondContact O-N 3.13Å; F227-R232 PolarHBondContact O-N 3.3Å
228	N	53.4	Low	47.2	Very low	62 Å²	62	115.7 Å²	115.7	33%	0.332	57%	0.571	S	S	.	*	I	π-helix	trans	-69.4	-34.6	178.7	-83.9	-67	0	0	0	113.9	R224 R232	R224-N228 WeakPolarHBondContact O-CB 3.41Å; R224-N228 PolarHBondContact O-N 3.21Å; R224-N228 PolarHBondContact O-ND2 3.18Å; N228-R232 WeakPolarHBondContact OD1-CD 3.37Å; N228-R232 PolarHBondContact OD1-NH1 2.98Å
229	R	53.5	Low	48.4	Very low	216 Å²	216	113.3 Å²	113.3	82%	0.815	56%	0.557	S	S	*	*	I	π-helix	trans	-81.3	-37.9	-178.4	-77.3	-178.6	172.9	175	0	113.9	G225 L226 P233	G225-R229 WeakPolarHBondContact O-CB 3.42Å; G225-R229 WeakPolarHBondContact O-CG 3.39Å; G225-R229 PolarHBondContact O-N 3.2Å; L226-R229 PolarHBondContact O-N 3.34Å; R229-P233 WeakPolarHBondContact O-CG 3.25Å
230	T	49.6	Very low	49.1	Very low	77 Å²	77	108.6 Å²	108.6	47%	0.472	54%	0.535	S	S	.	.	I	π-helix	trans	-109.8	-39.9	-168.4	-42.7	0	0	0	0	113.3	L226 N234	L226-T230 PolarHBondContact O-N 3.06Å; L226-T230 PolarHBondContact O-OG1 2.9Å; T230-N234 PolarHBondContact O-ND2 3.12Å
231	F	44	Very low	49.7	Very low	135 Å²	135	106.5 Å²	106.5	59%	0.592	53%	0.526	S	S	*	.	I	π-helix	trans	-90.3	-46.6	-175	-127.3	-91.2	0	0	0	112.2	F227 N234 L235	F227-F231 HydrophobicContact CD2-CB 4.09Å; F227-F231 HydrophobicContact CE2-CB 4.27Å; F227-F231 PolarHBondContact O-N 3.13Å; F231-N234 PolarHBondContact O-N 2.98Å; F231-L235 WeakPolarHBondContact O-CB 3.35Å; F231-L235 PolarHBondContact O-N 2.85Å
232	R	57.2	Low	49.9	Very low	128 Å²	128	105.2 Å²	105.2	48%	0.483	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-36.9	-175.3	-161	175.1	-173.9	-166.2	-0	115	F227 N228 R236	F227-R232 PolarHBondContact O-N 3.3Å; N228-R232 WeakPolarHBondContact OD1-CD 3.37Å; N228-R232 PolarHBondContact OD1-NH1 2.98Å; R232-R236 WeakPolarHBondContact O-CB 3.27Å; R232-R236 PolarHBondContact O-N 2.73Å
233	P	60.5	Low	49.9	Very low	69 Å²	69	106.8 Å²	106.8	45%	0.448	51%	0.513	S	S	.	.	H	α-helix	trans	-69.8	-43.4	176.8	-20.3	34.5	0	0	0	112.4	R229 R236 R237	R229-P233 WeakPolarHBondContact O-CG 3.25Å; P233-R236 PolarHBondContact O-N 2.8Å; P233-R237 PolarHBondContact O-N 2.99Å
234	N	55.1	Low	50	Low	106 Å²	106	106.8 Å²	106.8	57%	0.567	51%	0.514	S	S	*	.	H	α-helix	trans	-66.9	-40.3	178.7	-70.4	-48.8	0	0	0	111.5	T230 F231 R237 A238	T230-N234 PolarHBondContact O-ND2 3.12Å; F231-N234 PolarHBondContact O-N 2.98Å; N234-R237 PolarHBondContact O-N 3.41Å; N234-A238 WeakPolarHBondContact O-CB 3.34Å; N234-A238 PolarHBondContact O-N 3.2Å
235	L	54.3	Low	50.3	Low	86 Å²	86	103.2 Å²	103.2	45%	0.45	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-38.7	173	-174.5	62.6	0	0	0	112	F231 I239	F231-L235 WeakPolarHBondContact O-CB 3.35Å; F231-L235 PolarHBondContact O-N 2.85Å; L235-I239 HydrophobicContact CD1-CD1 4.06Å; L235-I239 HydrophobicContact CD1-CG1 4.43Å; L235-I239 HydrophobicContact CG-CD1 3.92Å; L235-I239 WeakPolarHBondContact O-CB 3.14Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 3.47Å; L235-I239 PolarHBondContact O-N 3.44Å
236	R	55.8	Low	49.6	Very low	177 Å²	177	110.7 Å²	110.7	67%	0.668	53%	0.534	S	S	*	.	H	α-helix	trans	-62.2	-43.3	171.7	-93.7	-168.6	172.2	-173.2	-1.1	112.2	R232 P233 I239 S240	R232-R236 WeakPolarHBondContact O-CB 3.27Å; R232-R236 PolarHBondContact O-N 2.73Å; P233-R236 PolarHBondContact O-N 2.8Å; R236-I239 PolarHBondContact O-N 3.12Å; R236-S240 PolarHBondContact O-N 3.36Å; R236-S240 PolarHBondContact O-OG 3.5Å
237	R	55.1	Low	49.4	Very low	106 Å²	106	112.6 Å²	112.6	40%	0.4	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-45.5	177.5	174.7	171.3	-82.1	178.1	-8.7	111.6	P233 N234 I239 S240 E241 S1218	P233-R237 PolarHBondContact O-N 2.99Å; N234-R237 PolarHBondContact O-N 3.41Å; R237-I239 VanDerWaalsContact C-N 3.31Å; R237-I239 PolarHBondContact O-N 2.94Å; R237-S240 WeakPolarHBondContact CA-OG 3.46Å; R237-S240 PolarHBondContact O-N 3.49Å; R237-S240 PolarHBondContact O-OG 3.27Å; R237-E241 VanDerWaalsContact CD-OE1 3.3Å; R237-E241 WeakPolarHBondContact CD-OE1 3.36Å; R237-E241 HydrophobicContact CG-CG 4.31Å; R237-E241 WeakPolarHBondContact CG-OE1 3.44Å; R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.5Å; R237-E241 PolarHBondContact O-N 3.26Å; R237-S1218 PolarHBondContact NH1-OG 3.34Å; R237-S1218 PolarHBondContact NH2-OG 3.18Å
238	A	48.1	Very low	48.7	Very low	46 Å²	46	111.5 Å²	111.5	38%	0.38	55%	0.55	S	S	.	.	H	α-helix	trans	-61.1	-40	174.9	0	0	0	0	0	112.1	N234 V242	N234-A238 WeakPolarHBondContact O-CB 3.34Å; N234-A238 PolarHBondContact O-N 3.2Å; A238-V242 WeakPolarHBondContact O-CB 3.48Å; A238-V242 VanDerWaalsContact O-CG2 3.28Å; A238-V242 WeakPolarHBondContact O-CG2 3.49Å; A238-V242 PolarHBondContact O-N 3.4Å; A238-V242 VanDerWaalsContact O-N 3.08Å
239	I	58.6	Low	47.8	Very low	97 Å²	97	114 Å²	114	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-71.4	-35.1	176.7	-69.2	169.9	0	0	0	112	L235 R236 R237 K243	L235-I239 HydrophobicContact CD1-CD1 4.06Å; L235-I239 HydrophobicContact CD1-CG1 4.43Å; L235-I239 HydrophobicContact CG-CD1 3.92Å; L235-I239 WeakPolarHBondContact O-CB 3.14Å; L235-I239 VanDerWaalsContact O-CG1 3.25Å; L235-I239 WeakPolarHBondContact O-CG1 3.47Å; L235-I239 PolarHBondContact O-N 3.44Å; R236-I239 PolarHBondContact O-N 3.12Å; R237-I239 VanDerWaalsContact C-N 3.31Å; R237-I239 PolarHBondContact O-N 2.94Å; I239-K243 WeakPolarHBondContact O-CB 3.34Å; I239-K243 PolarHBondContact O-N 2.84Å
240	S	49	Very low	47	Very low	51 Å²	51	110.5 Å²	110.5	36%	0.357	56%	0.561	S	S	.	*	H	α-helix	trans	-69.4	-46.2	173.7	63.5	0	0	0	0	111.2	R236 R237 V242 K243 D244	R236-S240 PolarHBondContact O-N 3.36Å; R236-S240 PolarHBondContact O-OG 3.5Å; R237-S240 WeakPolarHBondContact CA-OG 3.46Å; R237-S240 PolarHBondContact O-N 3.49Å; R237-S240 PolarHBondContact O-OG 3.27Å; S240-V242 PolarHBondContact O-N 3.36Å; S240-K243 CarbonylContact O-C 3.55Å; S240-K243 WeakPolarHBondContact O-CA 3.45Å; S240-K243 PolarHBondContact O-N 2.91Å; S240-D244 WeakPolarHBondContact O-CB 3.28Å; S240-D244 PolarHBondContact O-N 2.83Å
241	E	52.4	Low	46.3	Very low	112 Å²	112	113.6 Å²	113.6	52%	0.523	58%	0.579	S	S	.	*	H	α-helix	trans	-60	-29.8	176.5	-71.7	168.7	-170.5	0	0	112.3	R237 V245	R237-E241 VanDerWaalsContact CD-OE1 3.3Å; R237-E241 WeakPolarHBondContact CD-OE1 3.36Å; R237-E241 HydrophobicContact CG-CG 4.31Å; R237-E241 WeakPolarHBondContact CG-OE1 3.44Å; R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.5Å; R237-E241 PolarHBondContact O-N 3.26Å; E241-V245 WeakPolarHBondContact O-CG2 3.46Å
242	V	45	Very low	45.5	Very low	101 Å²	101	114.5 Å²	114.5	61%	0.612	59%	0.585	S	S	*	*	H	α-helix	trans	-77.9	-38	170.3	171	0	0	0	0	112.7	A238 S240 V245 Y246	A238-V242 WeakPolarHBondContact O-CB 3.48Å; A238-V242 VanDerWaalsContact O-CG2 3.28Å; A238-V242 WeakPolarHBondContact O-CG2 3.49Å; A238-V242 PolarHBondContact O-N 3.4Å; A238-V242 VanDerWaalsContact O-N 3.08Å; S240-V242 PolarHBondContact O-N 3.36Å; V242-V245 PolarHBondContact O-N 2.92Å; V242-Y246 PolarHBondContact O-N 3.08Å
243	K	41.9	Very low	44.3	Very low	123 Å²	123	111.8 Å²	111.8	54%	0.535	60%	0.598	S	S	.	*	H	α-helix	trans	-70.6	-33.6	175.7	-99.4	-156.5	165.2	-143.4	0	113.5	I239 S240 V245 Y246 N247	I239-K243 WeakPolarHBondContact O-CB 3.34Å; I239-K243 PolarHBondContact O-N 2.84Å; S240-K243 CarbonylContact O-C 3.55Å; S240-K243 WeakPolarHBondContact O-CA 3.45Å; S240-K243 PolarHBondContact O-N 2.91Å; K243-V245 PolarHBondContact O-N 3.15Å; K243-Y246 CarbonylContact O-C 3.55Å; K243-Y246 WeakPolarHBondContact O-CA 3.32Å; K243-Y246 PolarHBondContact O-N 2.83Å; K243-N247 PolarHBondContact O-N 2.87Å; K243-N247 VanDerWaalsContact O-N 3.08Å
244	D	42.2	Very low	42.8	Very low	131 Å²	131	113.9 Å²	113.9	70%	0.701	61%	0.614	S	S	*	*	H	α-helix	trans	-71.3	-22.3	178.1	-62.2	-27.9	0	0	0	111.1	S240	S240-D244 WeakPolarHBondContact O-CB 3.28Å; S240-D244 PolarHBondContact O-N 2.83Å
245	V	45.9	Very low	41.7	Very low	122 Å²	122	116.1 Å²	116.1	74%	0.739	63%	0.625	S	S	*	*	H	α-helix	trans	-83.7	-17	167.9	173	0	0	0	0	112.3	E241 V242 K243	E241-V245 WeakPolarHBondContact O-CG2 3.46Å; V242-V245 PolarHBondContact O-N 2.92Å; K243-V245 PolarHBondContact O-N 3.15Å
246	Y	32.8	Very low	40.6	Very low	186 Å²	186	117.4 Å²	117.4	73%	0.729	64%	0.636	S	S	*	*			trans	-144.1	68.3	-173.2	-125.9	-81.1	0	0	0	112.1	V242 K243 P248	V242-Y246 PolarHBondContact O-N 3.08Å; K243-Y246 CarbonylContact O-C 3.55Å; K243-Y246 WeakPolarHBondContact O-CA 3.32Å; K243-Y246 PolarHBondContact O-N 2.83Å; Y246-P248 VanDerWaalsContact O-CD 3.31Å; Y246-P248 WeakPolarHBondContact O-CD 3.4Å
247	N	37.2	Very low	39.4	Very low	112 Å²	112	115.5 Å²	115.5	60%	0.599	64%	0.635	S	S	*	*			trans	-99.7	105.4	172.4	-175.5	9.3	0	0	0	110.6	K243 D249	K243-N247 PolarHBondContact O-N 2.87Å; K243-N247 VanDerWaalsContact O-N 3.08Å; N247-D249 PolarHBondContact OD1-N 3.21Å; N247-D249 VanDerWaalsContact OD1-N 3.13Å
248	P	32.2	Very low	38.1	Very low	99 Å²	99	120 Å²	120	64%	0.643	65%	0.652	S	S	*	*			trans	-92.3	4.8	178.7	38.9	-36.3	0	0	0	113.7	Y246 N250	Y246-P248 VanDerWaalsContact O-CD 3.31Å; Y246-P248 WeakPolarHBondContact O-CD 3.4Å; P248-N250 PolarHBondContact O-N 2.78Å; P248-N250 VanDerWaalsContact O-N 3.15Å
249	D	34.3	Very low	37.3	Very low	113 Å²	113	124.2 Å²	124.2	60%	0.604	67%	0.668	S	S	*	*			trans	-90	78.1	-172.8	-64.4	-47.7	0	0	0	111.8	N247	N247-D249 PolarHBondContact OD1-N 3.21Å; N247-D249 VanDerWaalsContact OD1-N 3.13Å
250	N	35.3	Very low	36	Very low	144 Å²	144	124.2 Å²	124.2	77%	0.77	68%	0.677	S	S	*	*	S	Bend	trans	-151.7	134.7	159.1	-100.4	-46.3	0	0	0	109	P248	P248-N250 PolarHBondContact O-N 2.78Å; P248-N250 VanDerWaalsContact O-N 3.15Å
251	T	34.7	Very low	35	Very low	142 Å²	142	130.6 Å²	130.6	87%	0.871	70%	0.701	S	S	*	*			trans	62.7	67	-178.9	55.9	0	0	0	0	117.7
252	E	28.8	Very low	33.9	Very low	153 Å²	153	134.1 Å²	134.1	72%	0.715	72%	0.718	S	S	*	*			trans	-111.3	131.2	136.4	-81.9	-161.6	149.5	0	0	108.4	R204	R204-E252 IonicContact CZ-OE1 2.73Å; R204-E252 IonicContact NH1-OE1 3.36Å; R204-E252 PolarHBondContact NH1-OE1 3.21Å; R204-E252 IonicContact NH2-OE1 2.69Å; R204-E252 PolarHBondContact NH2-OE1 3.38Å; R204-E252 IonicContact NH2-OE2 2.69Å
253	G	30.6	Very low	33.2	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	73%	0.731	S	S	*	*			trans	154.8	115.6	173.7	0	0	0	0	0	115
254	S	30.3	Very low	32.6	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	75%	0.746	S	S	*	*			trans	67.1	135.2	163.7	172.1	0	0	0	0	117.9
255	L	30.3	Very low	31.9	Very low	152 Å²	152	143.2 Å²	143.2	80%	0.796	75%	0.751	S	S	*	*			cis	-153.8	179	-13.2	-117.4	167.4	0	0	0	109.7
256	T	31.6	Very low	31.1	Very low	113 Å²	113	144.9 Å²	144.9	69%	0.693	76%	0.756	S	S	*	*			trans	-77.6	172	-172.6	44.3	0	0	0	0	116.1
257	E	30.3	Very low	31.1	Very low	137 Å²	137	143.3 Å²	143.3	64%	0.64	76%	0.755	S	S	*	*			trans	98.7	136.6	147.4	-95.8	-176.7	-126.1	0	0	121.8
258	R	29.8	Very low	30.7	Very low	200 Å²	200	143.3 Å²	143.3	76%	0.755	76%	0.764	S	S	*	*			trans	66.3	135.6	162.5	-57.9	161.7	-151.8	-170.6	7.5	115.9
259	N	31	Very low	30.8	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	77%	0.767	S	S	*	*			cis	-148.9	131.3	-6.8	-99.7	-26.3	0	0	0	106.8
260	S	30	Very low	30.7	Very low	97 Å²	97	150.3 Å²	150.3	68%	0.678	78%	0.775	S	S	*	*				81.6	109.9	75.1	-57.9	0	0	0	0	114.4
261	Q	28.9	Very low	30.8	Very low	186 Å²	186	147.5 Å²	147.5	87%	0.869	77%	0.767	S	S	*	*			trans	80.2	152.4	160.4	-55.3	178.4	0.3	0	0	119.6
262	Q	28.7	Very low	30.8	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	76%	0.758	S	S	*	*			trans	64.4	125.5	-178.5	-59.5	-172.4	12.1	0	0	115.7
263	Q	30.4	Very low	31.2	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	75%	0.746	S	S	*	*			cis	-124.6	153.4	-8.9	-82.9	172.6	-31.5	0	0	110.3
264	Q	28.9	Very low	31.7	Very low	181 Å²	181	149.3 Å²	149.3	85%	0.846	75%	0.746	S	S	*	*			trans	-114	165	-174.6	-141.4	171.5	11	0	0	110.5
265	Q	27.4	Very low	32	Very low	173 Å²	173	149.9 Å²	149.9	81%	0.808	74%	0.74	S	S	*	*			trans	65.5	85.1	172.4	-54	179.6	3.8	0	0	117.1
266	N	29.4	Very low	32.4	Very low	158 Å²	158	147.8 Å²	147.8	85%	0.845	73%	0.726	S	S	*	*				-178.3	90.8	127.9	-100.2	-38.7	0	0	0	113.1
267	H	33.5	Very low	32.9	Very low	153 Å²	153	150 Å²	150	71%	0.708	72%	0.721	S	S	*	*			trans	-173.8	13.1	147.5	-100.6	-9.6	0	0	0	116.7	H269	H267-H269 PolarHBondContact O-N 2.66Å
268	S	27.9	Very low	33.5	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	62.8	173.8	53.7	0	0	0	0	113.4
269	H	34.4	Very low	34.1	Very low	151 Å²	151	145.3 Å²	145.3	70%	0.699	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.4	-15.7	163.3	-109.2	-63.6	0	0	0	115.9	H267	H267-H269 PolarHBondContact O-N 2.66Å
270	R	32.9	Very low	34.7	Very low	208 Å²	208	143.8 Å²	143.8	79%	0.785	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-7.7	-175.5	-115.9	177.1	-177.6	177.4	1.3	115.3
271	S	36.3	Very low	35.2	Very low	85 Å²	85	145.3 Å²	145.3	59%	0.594	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-49.6	-176.4	49	0	0	0	0	113.8	N273 K274	S271-N273 VanDerWaalsContact C-N 3.32Å; S271-N273 PolarHBondContact O-N 2.91Å; S271-K274 PolarHBondContact O-N 3.33Å; S271-K274 VanDerWaalsContact O-N 3.09Å
272	Q	35.8	Very low	35.8	Very low	149 Å²	149	143.6 Å²	143.6	70%	0.696	69%	0.687	S	S	*	*	H	α-helix	trans	-61.2	-39.2	179.8	-75	-179.7	-30.3	0	0	112.4	K274 L275 H276	Q272-K274 PolarHBondContact O-N 3.18Å; Q272-L275 PolarHBondContact O-N 2.84Å; Q272-H276 PolarHBondContact O-N 3.02Å
273	N	37.5	Very low	36.2	Very low	86 Å²	86	140.4 Å²	140.4	46%	0.46	68%	0.676	S	S	.	*	H	α-helix	trans	-68	-10.1	177.3	-84.1	-37.8	0	0	0	114.6	S271 R277	S271-N273 VanDerWaalsContact C-N 3.32Å; S271-N273 PolarHBondContact O-N 2.91Å; N273-R277 WeakPolarHBondContact O-CB 3.37Å; N273-R277 VanDerWaalsContact O-CD 3.23Å; N273-R277 WeakPolarHBondContact O-CD 3.32Å; N273-R277 WeakPolarHBondContact O-CG 3.46Å; N273-R277 PolarHBondContact O-NE 3.03Å
274	K	39.7	Very low	36.6	Very low	169 Å²	169	136.8 Å²	136.8	74%	0.735	66%	0.659	S	S	*	*	H	α-helix	trans	-89.1	-38.5	172.5	-130.8	174	-175.2	179.9	0	111.8	S271 Q272 H278	S271-K274 PolarHBondContact O-N 3.33Å; S271-K274 VanDerWaalsContact O-N 3.09Å; Q272-K274 PolarHBondContact O-N 3.18Å; K274-H278 PolarHBondContact O-N 3.27Å
275	L	36.9	Very low	37.1	Very low	126 Å²	126	135.2 Å²	135.2	66%	0.66	66%	0.656	S	S	*	*	H	α-helix	trans	-68.7	-41.8	174.7	-164.6	68.7	0	0	0	111.5	Q272 R277 H278 L279	Q272-L275 PolarHBondContact O-N 2.84Å; L275-R277 PolarHBondContact O-N 2.99Å; L275-H278 PolarHBondContact O-N 3.07Å; L275-L279 PolarHBondContact O-N 2.99Å; L275-L279 VanDerWaalsContact O-N 3.13Å
276	H	39.2	Very low	37.5	Very low	108 Å²	108	133.9 Å²	133.9	50%	0.5	65%	0.653	S	S	.	*	H	α-helix	trans	-65.3	-37.5	177	-161.1	71.7	0	0	0	112.4	Q272 L279 Q280	Q272-H276 PolarHBondContact O-N 3.02Å; H276-L279 PolarHBondContact O-N 2.95Å; H276-Q280 PolarHBondContact NE2-NE2 3.43Å; H276-Q280 WeakPolarHBondContact O-CB 3.24Å; H276-Q280 WeakPolarHBondContact O-CG 3.45Å; H276-Q280 PolarHBondContact O-N 3.42Å
277	R	41.2	Very low	37.6	Very low	158 Å²	158	134.5 Å²	134.5	60%	0.596	65%	0.648	S	S	*	*	H	α-helix	trans	-67.8	-36.1	175.4	-74.6	175	-164.1	-155.9	1.1	113.1	N273 L275 Q280 Q281	N273-R277 WeakPolarHBondContact O-CB 3.37Å; N273-R277 VanDerWaalsContact O-CD 3.23Å; N273-R277 WeakPolarHBondContact O-CD 3.32Å; N273-R277 WeakPolarHBondContact O-CG 3.46Å; N273-R277 PolarHBondContact O-NE 3.03Å; L275-R277 PolarHBondContact O-N 2.99Å; R277-Q280 PolarHBondContact O-N 3.34Å; R277-Q281 WeakPolarHBondContact O-CB 3.3Å; R277-Q281 WeakPolarHBondContact O-CG 3.49Å; R277-Q281 PolarHBondContact O-N 3.5Å
278	H	43.1	Very low	37.4	Very low	135 Å²	135	133 Å²	133	63%	0.625	65%	0.645	S	S	*	*	H	α-helix	trans	-69.5	-36.3	176.5	-135.3	42.3	0	0	0	112	K274 L275 Q282	K274-H278 PolarHBondContact O-N 3.27Å; L275-H278 PolarHBondContact O-N 3.07Å; H278-Q282 PolarHBondContact O-N 3.13Å
279	L	43.1	Very low	37.6	Very low	105 Å²	105	136.3 Å²	136.3	55%	0.55	65%	0.652	S	S	.	*	H	α-helix	trans	-68.8	-39.3	170.6	-81.5	160.9	0	0	0	112.6	L275 H276 Q282 L283	L275-L279 PolarHBondContact O-N 2.99Å; L275-L279 VanDerWaalsContact O-N 3.13Å; H276-L279 PolarHBondContact O-N 2.95Å; L279-Q282 PolarHBondContact O-N 2.74Å; L279-L283 PolarHBondContact O-N 3.21Å; L279-L283 VanDerWaalsContact O-N 3.08Å
280	Q	43.4	Very low	37.4	Very low	103 Å²	103	133 Å²	133	48%	0.481	65%	0.646	S	S	.	*	H	α-helix	trans	-66	-36.8	173.8	-78.4	-177.8	-38.5	0	0	112.7	H276 R277 Q282 L283 H284	H276-Q280 PolarHBondContact NE2-NE2 3.43Å; H276-Q280 WeakPolarHBondContact O-CB 3.24Å; H276-Q280 WeakPolarHBondContact O-CG 3.45Å; H276-Q280 PolarHBondContact O-N 3.42Å; R277-Q280 PolarHBondContact O-N 3.34Å; Q280-Q282 VanDerWaalsContact C-N 3.33Å; Q280-Q282 PolarHBondContact O-N 3.21Å; Q280-L283 CarbonylContact O-C 3.59Å; Q280-L283 PolarHBondContact O-N 3.43Å; Q280-L283 VanDerWaalsContact O-N 3.09Å; Q280-H284 WeakPolarHBondContact O-CB 3.35Å; Q280-H284 PolarHBondContact O-N 3.06Å
281	Q	41.3	Very low	37.5	Very low	128 Å²	128	130.8 Å²	130.8	60%	0.598	64%	0.644	S	S	*	*	H	α-helix	trans	-69.5	-28	176.1	-75.6	178.5	-55.3	0	0	113	R277	R277-Q281 WeakPolarHBondContact O-CB 3.3Å; R277-Q281 WeakPolarHBondContact O-CG 3.49Å; R277-Q281 PolarHBondContact O-N 3.5Å
282	Q	40.7	Very low	37.4	Very low	150 Å²	150	132.4 Å²	132.4	70%	0.701	65%	0.652	S	S	*	*	H	α-helix	trans	-74.2	-27.2	167.8	-70.3	-68.4	-55.5	0	0	112.7	H278 L279 Q280	H278-Q282 PolarHBondContact O-N 3.13Å; L279-Q282 PolarHBondContact O-N 2.74Å; Q280-Q282 VanDerWaalsContact C-N 3.33Å; Q280-Q282 PolarHBondContact O-N 3.21Å
283	L	38.2	Very low	37.3	Very low	120 Å²	120	129.5 Å²	129.5	63%	0.628	65%	0.654	S	S	*	*	H	α-helix	trans	-84.4	-13.8	174.9	-85.6	159.3	0	0	0	114.5	L279 Q280	L279-L283 PolarHBondContact O-N 3.21Å; L279-L283 VanDerWaalsContact O-N 3.08Å; Q280-L283 CarbonylContact O-C 3.59Å; Q280-L283 PolarHBondContact O-N 3.43Å; Q280-L283 VanDerWaalsContact O-N 3.09Å
284	H	38.6	Very low	37.1	Very low	115 Å²	115	131 Å²	131	53%	0.532	67%	0.671	S	S	.	*	H	α-helix	trans	-82.9	-26.2	-177	-154.2	-64.2	0	0	0	113.4	Q280 I286 K287	Q280-H284 WeakPolarHBondContact O-CB 3.35Å; Q280-H284 PolarHBondContact O-N 3.06Å; H284-I286 PolarHBondContact O-N 2.84Å; H284-K287 PolarHBondContact O-N 3.47Å
285	N	38.3	Very low	36.5	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	9.2	175.5	-72.9	6.7	0	0	0	113.5
286	I	36.9	Very low	36.1	Very low	145 Å²	145	132.8 Å²	132.8	74%	0.744	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.4	7.2	172.3	-62.3	177.1	0	0	0	110.6	H284	H284-I286 PolarHBondContact O-N 2.84Å
287	K	29.9	Very low	35.9	Very low	170 Å²	170	135 Å²	135	74%	0.739	69%	0.689	S	S	*	*	S	Bend	trans	-133.9	69.9	173.8	-80.6	-168.6	169.8	-172.6	0	111.9	H284	H284-K287 PolarHBondContact O-N 3.47Å
288	L	30.6	Very low	35.4	Very low	123 Å²	123	134.5 Å²	134.5	64%	0.644	69%	0.693	S	S	*	*			trans	-157.9	49.8	167.2	-112.9	158.7	0	0	0	113.5
289	I	32.3	Very low	34.7	Very low	180 Å²	180	135.1 Å²	135.1	92%	0.923	70%	0.696	S	S	*	*			trans	-111.6	93.9	147.7	-61.5	179	0	0	0	105.7
290	S	30.3	Very low	34.1	Very low	82 Å²	82	135.3 Å²	135.3	57%	0.573	71%	0.706	S	S	*	*			trans	-165.2	102.1	-177.8	55.6	0	0	0	0	111.3
291	H	34.7	Very low	33.6	Very low	162 Å²	162	134.1 Å²	134.1	75%	0.75	71%	0.714	S	S	*	*			trans	-142.1	159.5	164.6	-101.7	-93.6	0	0	0	109.9
292	P	33.9	Very low	33.1	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	72%	0.723	S	S	*	*			trans	-131.5	158.4	-144	41.3	-26.7	0	0	0	117.3
293	A	33.3	Very low	32.8	Very low	89 Å²	89	135.1 Å²	135.1	74%	0.736	72%	0.723	S	S	*	*			trans	-159.1	112	159.4	0	0	0	0	0	107.1
294	S	32.6	Very low	32.5	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	72%	0.723	S	S	*	*				93.9	149.5	73.4	75.5	0	0	0	0	113.1
295	R	28.2	Very low	32.2	Very low	239 Å²	239	136 Å²	136	90%	0.902	73%	0.731	S	S	*	*			trans	-76.1	167.9	-175.9	-55.2	166	175.4	162.3	-4.6	109.8
296	S	29	Very low	31.8	Very low	92 Å²	92	138 Å²	138	64%	0.643	73%	0.729	S	S	*	*			cis	-164.1	-175.7	27.8	-33.2	0	0	0	0	112.6
297	H	34.3	Very low	31.5	Very low	154 Å²	154	138.1 Å²	138.1	71%	0.713	73%	0.726	S	S	*	*			trans	80.4	131.2	171.1	-57.2	-64.3	0	0	0	116.3
298	Q	30.7	Very low	31.4	Very low	148 Å²	148	135.7 Å²	135.7	69%	0.692	73%	0.726	S	S	*	*			cis	77.4	133.8	44.9	-74	-177.1	-68.4	0	0	113.4
299	Q	28.7	Very low	31.3	Very low	148 Å²	148	133.8 Å²	133.8	69%	0.692	73%	0.728	S	S	*	*			cis	-167.5	158.4	-11.4	-156.1	169.1	-37.1	0	0	109.2
300	S	30.4	Very low	31	Very low	109 Å²	109	131.3 Å²	131.3	76%	0.762	72%	0.721	S	S	*	*			trans	67.5	155.1	160.2	-64.2	0	0	0	0	118
301	A	33.9	Very low	30.9	Very low	78 Å²	78	134.5 Å²	134.5	65%	0.645	73%	0.732	S	S	*	*			cis	-163	166.8	-19.1	0	0	0	0	0	110.7
302	L	30.4	Very low	30.6	Very low	151 Å²	151	136.4 Å²	136.4	79%	0.791	74%	0.741	S	S	*	*			trans	28.6	149.3	142.6	-62.9	163.7	0	0	0	120.9
303	H	34.9	Very low	30.3	Very low	148 Å²	148	136.3 Å²	136.3	69%	0.685	74%	0.74	S	S	*	*			cis	-145.7	131.1	22.7	-118.9	-95.9	0	0	0	107.7
304	L	30.8	Very low	30	Very low	123 Å²	123	143.1 Å²	143.1	64%	0.644	75%	0.749	S	S	*	*				60.7	105.5	93.9	-162.8	95.6	0	0	0	116.3
305	N	33.3	Very low	30	Very low	130 Å²	130	145.9 Å²	145.9	70%	0.695	75%	0.753	S	S	*	*				178.4	130.8	117.8	-95.8	-26.9	0	0	0	116.2
306	Y	29.5	Very low	30.1	Very low	192 Å²	192	142.7 Å²	142.7	75%	0.753	75%	0.749	S	S	*	*			trans	49.1	108.8	135.3	-84.3	-104	0	0	0	123.2
307	H	30.3	Very low	30.4	Very low	147 Å²	147	144.1 Å²	144.1	68%	0.681	76%	0.756	S	S	*	*				98.4	118.8	116.4	-113.1	-105.1	0	0	0	123.3
308	T	27.8	Very low	30.3	Very low	119 Å²	119	147.5 Å²	147.5	73%	0.73	76%	0.764	S	S	*	*			trans	71.6	122.9	144.1	26.7	0	0	0	0	123
309	A	27.3	Very low	30.1	Very low	83 Å²	83	151.1 Å²	151.1	69%	0.686	77%	0.771	S	S	*	*			trans	87.7	134.8	140.7	0	0	0	0	0	121
310	T	27	Very low	30.2	Very low	128 Å²	128	151 Å²	151	79%	0.785	77%	0.774	S	S	*	*			trans	72.1	150.5	170.2	71.2	0	0	0	0	118.3
311	N	27.8	Very low	30	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	77%	0.766	S	S	*	*			trans	58.7	83.5	165.7	-56.7	-23	0	0	0	118.1	P313	N311-P313 WeakPolarHBondContact O-CD 3.38Å
312	Q	29.6	Very low	29.9	Very low	202 Å²	202	156.1 Å²	156.1	94%	0.944	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-75.2	120.7	149.9	-87.4	-170.5	-30.2	0	0	109.6
313	P	27.7	Very low	29.9	Very low	116 Å²	116	157.6 Å²	157.6	75%	0.753	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-82.3	167.7	177.1	34.1	-35.4	0	0	0	112.6	N311 L315	N311-P313 WeakPolarHBondContact O-CD 3.38Å; P313-L315 PolarHBondContact O-N 2.77Å
314	Y	26.8	Very low	29.8	Very low	232 Å²	232	154.6 Å²	154.6	91%	0.91	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-55.6	120.1	179.3	-80	-111.9	0	0	0	112.9	Q316	Y314-Q316 PolarHBondContact O-N 3.28Å
315	L	31	Very low	29.7	Very low	177 Å²	177	154.1 Å²	154.1	93%	0.927	77%	0.767	S	S	*	*			trans	-77.7	115.9	161.8	-95	163	0	0	0	109.5	P313	P313-L315 PolarHBondContact O-N 2.77Å
316	Q	30.4	Very low	29.7	Very low	172 Å²	172	153.3 Å²	153.3	80%	0.804	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.1	141.7	-175.2	-64.5	174.3	-17.5	0	0	112.1	Y314	Y314-Q316 PolarHBondContact O-N 3.28Å
317	P	35	Very low	29.8	Very low	122 Å²	122	152.9 Å²	152.9	79%	0.792	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-67	144.9	160.5	30.9	-33.1	0	0	0	109.9
318	Y	32.3	Very low	29.8	Very low	225 Å²	225	153.5 Å²	153.5	88%	0.882	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-58.8	143.3	179.5	-97.3	-117	0	0	0	112.4	I320	Y318-I320 PolarHBondContact O-N 3.27Å
319	R	27.1	Very low	29.9	Very low	223 Å²	223	156.5 Å²	156.5	84%	0.842	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-55.9	124.8	175.1	-76.2	179.6	174.6	165.3	-3.3	111.4	N321	R319-N321 HydrophobicContact CB-CB 4.24Å
320	I	30.9	Very low	30.1	Very low	147 Å²	147	158.3 Å²	158.3	75%	0.754	78%	0.78	S	S	*	*			trans	-102.5	80.3	157.9	-56.4	176.8	0	0	0	106.3	Y318	Y318-I320 PolarHBondContact O-N 3.27Å
321	N	27.2	Very low	30.3	Very low	110 Å²	110	161.8 Å²	161.8	59%	0.588	78%	0.78	S	S	*	*			trans	-115.4	23.8	-173.8	-95.8	66.7	0	0	0	113.2	R319	R319-N321 HydrophobicContact CB-CB 4.24Å
322	E	30.9	Very low	30.4	Very low	183 Å²	183	162 Å²	162	86%	0.855	78%	0.781	S	S	*	*	S	Bend	trans	-134.3	11.7	-170.8	-139.6	163.5	-136.5	0	0	113.9
323	F	31.2	Very low	30.4	Very low	183 Å²	183	158 Å²	158	80%	0.803	77%	0.77	S	S	*	*	S	Bend	trans	-135.2	6.3	177.6	-116.6	-89.7	0	0	0	115.1
324	T	31.6	Very low	30.4	Very low	85 Å²	85	158.6 Å²	158.6	52%	0.521	78%	0.775	S	S	.	*	S	Bend	trans	-107.6	-24.8	-179.7	28.5	0	0	0	0	113.9	T326 F327	T324-T326 PolarHBondContact O-N 3.42Å; T324-T326 VanDerWaalsContact O-N 3.16Å; T324-F327 PolarHBondContact O-N 2.94Å
325	N	28.9	Very low	30.7	Very low	113 Å²	113	155.7 Å²	155.7	60%	0.604	77%	0.769	S	S	*	*	H	α-helix	trans	-69.9	-11.7	-176.9	-73.3	2.8	0	0	0	114.4	F327	N325-F327 VanDerWaalsContact C-N 3.32Å
326	T	32.5	Very low	30.5	Very low	112 Å²	112	157.3 Å²	157.3	69%	0.687	77%	0.769	S	S	*	*	H	α-helix	trans	-82.1	-3.2	177.4	-3.9	0	0	0	0	114.3	T324	T324-T326 PolarHBondContact O-N 3.42Å; T324-T326 VanDerWaalsContact O-N 3.16Å
327	F	31.5	Very low	30.5	Very low	183 Å²	183	159.1 Å²	159.1	80%	0.803	77%	0.774	S	S	*	*	H	α-helix	trans	-118.7	-13.7	-177.2	-107	-92.7	0	0	0	115.6	T324 N325	T324-F327 PolarHBondContact O-N 2.94Å; N325-F327 VanDerWaalsContact C-N 3.32Å
328	E	31	Very low	30.2	Very low	160 Å²	160	159.9 Å²	159.9	75%	0.748	77%	0.772	S	S	*	*	H	α-helix	trans	-98	-14.1	179.8	-73	-166.7	129.8	0	0	115.1	V330	E328-V330 VanDerWaalsContact C-N 3.29Å; E328-V330 PolarHBondContact O-N 3.11Å
329	Q	29.8	Very low	29.9	Very low	182 Å²	182	153.8 Å²	153.8	85%	0.85	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-0.1	179.6	-77.6	-166.8	-22.9	0	0	115.5
330	V	32.7	Very low	29.9	Very low	121 Å²	121	147.8 Å²	147.8	73%	0.733	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-10.4	-176.9	-175.2	0	0	0	0	112.9	E328	E328-V330 VanDerWaalsContact C-N 3.29Å; E328-V330 PolarHBondContact O-N 3.11Å
331	Y	30.7	Very low	29.8	Very low	202 Å²	202	148.1 Å²	148.1	79%	0.792	76%	0.756	S	S	*	*	S	Bend	trans	-98.7	9.4	-165.7	-106.6	-76.7	0	0	0	117
332	N	28.8	Very low	30	Very low	153 Å²	153	150.1 Å²	150.1	82%	0.818	77%	0.766	S	S	*	*			trans	-137.9	55.7	-175.2	-85.4	-50.6	0	0	0	114.9
333	T	31.4	Very low	29.9	Very low	116 Å²	116	148.2 Å²	148.2	71%	0.712	76%	0.757	S	S	*	*			trans	-144.2	114.4	163.5	-30.1	0	0	0	0	112.1	Q335	T333-Q335 PolarHBondContact O-N 2.88Å
334	P	27.3	Very low	30	Very low	130 Å²	130	145.9 Å²	145.9	84%	0.844	75%	0.752	S	S	*	*			trans	-93.1	99.1	179.5	33.8	-31	0	0	0	111.6
335	Q	32.8	Very low	29.9	Very low	171 Å²	171	146.6 Å²	146.6	80%	0.799	76%	0.758	S	S	*	*			trans	-133.8	149.2	171	-72.8	-165.6	-19	0	0	113.1	T333 F337	T333-Q335 PolarHBondContact O-N 2.88Å; Q335-F337 PolarHBondContact O-N 3.33Å
336	K	27.3	Very low	30.1	Very low	210 Å²	210	147.5 Å²	147.5	91%	0.913	77%	0.767	S	S	*	*			trans	-66.3	127.1	-172.9	-61.7	172	179.6	175.6	0	110.9
337	F	30.5	Very low	30	Very low	210 Å²	210	148.8 Å²	148.8	92%	0.921	77%	0.77	S	S	*	*			trans	-94.9	114.2	161.3	-96.1	-89.7	0	0	0	109.6	Q335	Q335-F337 PolarHBondContact O-N 3.33Å
338	D	28.1	Very low	29.9	Very low	138 Å²	138	147.8 Å²	147.8	74%	0.738	77%	0.769	S	S	*	*			trans	-85.5	152.5	167.9	-135.1	-38.4	0	0	0	110.1	S340	D338-S340 PolarHBondContact O-N 3.21Å
339	S	25.5	Very low	29.8	Very low	97 Å²	97	150.3 Å²	150.3	68%	0.678	77%	0.774	S	S	*	*	S	Bend	trans	-86.2	83.7	-161	58.8	0	0	0	0	114.4
340	S	27.1	Very low	30	Very low	98 Å²	98	149.5 Å²	149.5	69%	0.685	78%	0.775	S	S	*	*			trans	-159.4	175.2	163.5	59.7	0	0	0	0	112.8	D338	D338-S340 PolarHBondContact O-N 3.21Å
341	I	30	Very low	29.7	Very low	154 Å²	154	153.2 Å²	153.2	79%	0.79	79%	0.785	S	S	*	*			trans	68.5	93.4	175.8	-46.2	172.3	0	0	0	115.6
342	L	30.5	Very low	29.8	Very low	151 Å²	151	148.5 Å²	148.5	79%	0.791	78%	0.781	S	S	*	*			trans	-146.5	54.6	146.7	-151.9	119.1	0	0	0	112
343	E	29.5	Very low	29.8	Very low	144 Å²	144	149.6 Å²	149.6	67%	0.673	78%	0.783	S	S	*	*			trans	-98	113.8	155.7	-63	-133	125.8	0	0	107.8	P345 K1204	E343-P345 WeakPolarHBondContact O-CD 3.5Å; E343-K1204 WeakPolarHBondContact OE1-CE 3.45Å; E343-K1204 IonicContact OE1-NZ 3.61Å; E343-K1204 PolarHBondContact OE1-NZ 3.3Å
344	I	33.5	Very low	29.7	Very low	133 Å²	133	147.4 Å²	147.4	68%	0.682	77%	0.773	S	S	*	*			trans	-95.9	108.3	174.5	-60.4	173.4	0	0	0	107.1	V346	I344-V346 HydrophobicContact CG2-CG2 4.47Å
345	P	29.5	Very low	29.7	Very low	100 Å²	100	147.7 Å²	147.7	65%	0.649	77%	0.768	S	S	*	*			trans	-68.3	142.5	167.6	29.9	-33.1	0	0	0	109.3	E343	E343-P345 WeakPolarHBondContact O-CD 3.5Å
346	V	32.9	Very low	29.5	Very low	133 Å²	133	147.1 Å²	147.1	81%	0.806	77%	0.77	S	S	*	*			trans	-121.5	72.4	175.8	-176.1	0	0	0	0	107	I344	I344-V346 HydrophobicContact CG2-CG2 4.47Å
347	D	29.7	Very low	29.5	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	76%	0.758	S	S	*	*			trans	-119.6	108.3	-179.7	-65.1	-60.2	0	0	0	109.4
348	M	28.4	Very low	29.5	Very low	162 Å²	162	140.4 Å²	140.4	80%	0.798	76%	0.756	S	S	*	*			trans	-163.8	144.1	164.5	-118	-176.2	-74.1	0	0	108.3
349	Y	30.7	Very low	29.6	Very low	214 Å²	214	139 Å²	139	84%	0.839	76%	0.756	S	S	*	*			trans	65.6	104.1	-169.1	-48	-77.9	0	0	0	112.8
350	D	32.3	Very low	29.6	Very low	164 Å²	164	145.3 Å²	145.3	88%	0.877	77%	0.765	S	S	*	*				-135.4	139.5	53.7	-81.1	-37.6	0	0	0	114.4
351	E	27.9	Very low	29.8	Very low	200 Å²	200	149.1 Å²	149.1	94%	0.935	77%	0.769	S	S	*	*			trans	-94.5	123.8	162.9	-72.2	-175.2	115.7	0	0	110.5
352	S	31.8	Very low	29.9	Very low	103 Å²	103	146.9 Å²	146.9	72%	0.72	76%	0.759	S	S	*	*			trans	-173.3	123.4	146.9	58	0	0	0	0	112.4
353	M	28.6	Very low	29.8	Very low	175 Å²	175	150.2 Å²	150.2	86%	0.862	76%	0.761	S	S	*	*			trans	51.8	137	145.6	-61.2	169.3	71.4	0	0	119.2
354	S	30.6	Very low	29.9	Very low	71 Å²	71	147.6 Å²	147.6	50%	0.497	76%	0.757	S	S	.	*			cis	-156.1	154.6	21.4	51.7	0	0	0	0	110.5
355	D	26.8	Very low	29.6	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	75%	0.752	S	S	*	*			trans	23.7	121.5	133.2	-36.3	-45.2	0	0	0	116.2
356	D	27.4	Very low	29.6	Very low	159 Å²	159	147 Å²	147	85%	0.85	77%	0.765	S	S	*	*				-168.5	169.3	64.7	-130.6	-39	0	0	0	116.2
357	A	28.8	Very low	29.2	Very low	79 Å²	79	147.7 Å²	147.7	65%	0.653	76%	0.764	S	S	*	*			trans	76.4	147.7	153	0	0	0	0	0	124.2
358	F	29.8	Very low	29.2	Very low	200 Å²	200	151.1 Å²	151.1	88%	0.877	77%	0.773	S	S	*	*			trans	74.6	71.5	162.9	-76.9	-78.4	0	0	0	124.2
359	S	30.8	Very low	29.1	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	77%	0.765	S	S	*	*				80.5	105.9	112.7	-150.6	0	0	0	0	123
360	R	26	Very low	28.9	Very low	231 Å²	231	148.4 Å²	148.4	87%	0.872	77%	0.766	S	S	*	*			trans	-28.1	149.5	157.1	-49.3	169.4	-175.7	-176.6	0.3	118.1
361	K	30.5	Very low	28.9	Very low	177 Å²	177	148.3 Å²	148.3	77%	0.77	76%	0.764	S	S	*	*				-174.7	129.3	113.7	-101.2	169	-178.3	178.2	0	117	K468	K361-K468 PolarHBondContact O-NZ 2.9Å
362	N	32.4	Very low	28.9	Very low	108 Å²	108	144.9 Å²	144.9	58%	0.578	75%	0.752	S	S	*	*			trans	66	110.3	157.3	-51.5	4.9	0	0	0	117.4	K468	N362-K468 WeakPolarHBondContact O-CE 3.48Å; N362-K468 PolarHBondContact O-NZ 2.91Å
363	W	28.7	Very low	28.7	Very low	221 Å²	221	145.4 Å²	145.4	84%	0.837	76%	0.756	S	S	*	*				71.9	155.1	64.5	-75.9	63.9	0	0	0	114.5
364	P	31.3	Very low	28.8	Very low	89 Å²	89	145.6 Å²	145.6	58%	0.578	75%	0.754	S	S	*	*			cis	-105.7	167.3	-8.4	38.4	-27.1	0	0	0	112.4
365	S	26.3	Very low	28.8	Very low	84 Å²	84	150 Å²	150	59%	0.587	77%	0.767	S	S	*	*			cis	80.4	110.9	41.1	-44.6	0	0	0	0	115.6
366	C	29	Very low	28.8	Very low	136 Å²	136	149 Å²	149	92%	0.919	77%	0.771	S	S	*	*			trans	-157.3	134	154.8	-109.4	0	0	0	0	109.2
367	D	25.5	Very low	28.9	Very low	147 Å²	147	149 Å²	149	79%	0.786	77%	0.769	S	S	*	*			trans	-83.6	155.8	178.7	-93.1	-72.4	0	0	0	112.7
368	F	30.1	Very low	29.1	Very low	211 Å²	211	153.3 Å²	153.3	93%	0.925	78%	0.775	S	S	*	*				-151.2	125	127.6	-121.6	-79.1	0	0	0	110.5
369	S	26	Very low	28.9	Very low	90 Å²	90	149.8 Å²	149.8	63%	0.629	78%	0.775	S	S	*	*			trans	-101.4	170.7	179.5	57	0	0	0	0	111.5
370	R	25.8	Very low	28.8	Very low	229 Å²	229	147.1 Å²	147.1	86%	0.864	76%	0.764	S	S	*	*			trans	67.1	148.3	-172.9	-84.9	170.5	166.1	153.8	-4.2	113.5
371	I	32.8	Very low	28.9	Very low	161 Å²	161	147.8 Å²	147.8	83%	0.826	77%	0.767	S	S	*	*			cis	-120.1	161.7	14.5	-66.9	175.1	0	0	0	111.2
372	D	27.7	Very low	28.9	Very low	128 Å²	128	146.3 Å²	146.3	68%	0.684	77%	0.767	S	S	*	*			trans	-74.2	172	-166.7	-51.7	-97.4	0	0	0	117.7
373	S	28.5	Very low	28.6	Very low	114 Å²	114	150 Å²	150	80%	0.797	78%	0.781	S	S	*	*			trans	99.6	141	148	76.1	0	0	0	0	121.1
374	E	29.3	Very low	28.5	Very low	179 Å²	179	147 Å²	147	84%	0.836	78%	0.776	S	S	*	*	S	Bend	trans	61.9	65.3	162	-53.2	-160.3	161.6	0	0	120.7
375	H	32.2	Very low	28.4	Very low	164 Å²	164	150.2 Å²	150.2	76%	0.759	79%	0.785	S	S	*	*				-179.6	119.9	106.2	-105.6	-81.4	0	0	0	112.4
376	S	26.3	Very low	28.4	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	79%	0.793	S	S	*	*			trans	-157.2	97.4	172.5	-177.7	0	0	0	0	112.9
377	I	30.2	Very low	28.3	Very low	158 Å²	158	151.2 Å²	151.2	81%	0.81	78%	0.784	S	S	*	*			trans	-151.9	96.3	152.7	-50.4	-178.9	0	0	0	108.9
378	H	31.5	Very low	28.4	Very low	171 Å²	171	148.9 Å²	148.9	79%	0.792	78%	0.779	S	S	*	*				-176.2	101.4	111	-131.5	-68.5	0	0	0	111.1
379	S	27.1	Very low	28.4	Very low	125 Å²	125	145 Å²	145	87%	0.874	77%	0.768	S	S	*	*			trans	-121	146.8	158.7	178.9	0	0	0	0	108.2
380	G	28.6	Very low	28.5	Very low	51 Å²	51	146.4 Å²	146.4	53%	0.526	77%	0.772	S	S	.	*			trans	97.2	147.1	166.8	0	0	0	0	0	117.4
381	R	27.4	Very low	28.6	Very low	245 Å²	245	143 Å²	143	93%	0.925	76%	0.764	S	S	*	*			trans	66.6	127	175.2	-65.1	178	173	161.4	-1.4	115.7
382	L	29.7	Very low	28.3	Very low	147 Å²	147	142.8 Å²	142.8	77%	0.77	76%	0.757	S	S	*	*			cis	-128.5	126.7	14	-82.8	98	0	0	0	113.9
383	H	26.3	Very low	28.3	Very low	186 Å²	186	143.3 Å²	143.3	86%	0.861	76%	0.756	S	S	*	*				-85.6	173.5	128.3	-128.2	-121.6	0	0	0	108
384	E	27.7	Very low	28.3	Very low	157 Å²	157	147.4 Å²	147.4	73%	0.734	75%	0.753	S	S	*	*			trans	69.3	154	-170.4	-53.2	-175.9	106.8	0	0	113.9
385	M	27.8	Very low	28.2	Very low	156 Å²	156	146.1 Å²	146.1	77%	0.768	75%	0.753	S	S	*	*			cis	-138.5	146.7	8.9	-149.8	172.9	-173.7	0	0	112
386	T	26.3	Very low	27.9	Very low	124 Å²	124	145.8 Å²	145.8	76%	0.761	76%	0.756	S	S	*	*			trans	-81.7	-169.3	162.1	45	0	0	0	0	110.1
387	T	28.5	Very low	28	Very low	118 Å²	118	147.4 Å²	147.4	72%	0.724	75%	0.754	S	S	*	*			trans	69.9	118	-174.2	70.5	0	0	0	0	112.6
388	S	26.5	Very low	27.8	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	75%	0.751	S	S	*	*				78.6	117.8	63.7	-164.3	0	0	0	0	112
389	D	29.9	Very low	27.5	Very low	130 Å²	130	146.1 Å²	146.1	70%	0.695	75%	0.754	S	S	*	*				-179.8	124.1	109.5	-94.4	-0.9	0	0	0	114.4
390	T	27.7	Very low	27.5	Very low	118 Å²	118	148.3 Å²	148.3	72%	0.724	75%	0.748	S	S	*	*			trans	64.7	157.7	148.9	72.8	0	0	0	0	118.6
391	F	28.5	Very low	27.6	Very low	158 Å²	158	152.3 Å²	152.3	69%	0.693	76%	0.757	S	S	*	*			cis	-147.4	166.4	-9	-134.8	-153.5	0	0	0	110.2
392	K	27.5	Very low	27.7	Very low	157 Å²	157	147.9 Å²	147.9	68%	0.683	75%	0.751	S	S	*	*			trans	6	148.1	144.3	-60.8	-179.9	-168.7	173.4	0	118.7
393	E	27.9	Very low	27.5	Very low	138 Å²	138	146.3 Å²	146.3	65%	0.645	75%	0.747	S	S	*	*			cis	-164.2	169.6	31.2	-143.9	-172.8	135.2	0	0	113.8
394	R	27.6	Very low	27.6	Very low	200 Å²	200	143.4 Å²	143.4	76%	0.755	74%	0.738	S	S	*	*			trans	68.9	86.4	159.7	-62.1	176.9	-162.1	152.3	19.5	119.4
395	D	26.2	Very low	27.7	Very low	153 Å²	153	143.6 Å²	143.6	82%	0.818	74%	0.744	S	S	*	*				-60.3	144.2	129	-63.3	-77	0	0	0	110.4
396	L	26.9	Very low	27.7	Very low	157 Å²	157	142.6 Å²	142.6	82%	0.822	74%	0.742	S	S	*	*			trans	170.1	156.7	133.8	-96.4	160.9	0	0	0	111.8
397	L	27.6	Very low	27.8	Very low	148 Å²	148	145.2 Å²	145.2	78%	0.775	75%	0.745	S	S	*	*			trans	68.7	134.4	173.4	-42.5	-172.5	0	0	0	115.6
398	L	26.8	Very low	28	Very low	143 Å²	143	145.5 Å²	145.5	75%	0.749	75%	0.747	S	S	*	*			cis	-156.3	132.2	-19.8	-137	163.3	0	0	0	108.5
399	N	24.4	Very low	27.9	Very low	160 Å²	160	148.3 Å²	148.3	86%	0.856	75%	0.754	S	S	*	*			trans	-94.1	102.8	173.2	179.1	25.8	0	0	0	110.2
400	K	28.5	Very low	27.9	Very low	171 Å²	171	149.6 Å²	149.6	74%	0.743	76%	0.76	S	S	*	*			trans	-165.5	152.3	162.6	-121.6	175.4	-176.2	-179.6	0	113.8
401	N	29.2	Very low	27.8	Very low	134 Å²	134	149.6 Å²	149.6	72%	0.717	76%	0.759	S	S	*	*			trans	71.7	137.7	168.1	-54.6	-4.3	0	0	0	116.2
402	I	29.4	Very low	27.9	Very low	153 Å²	153	148.2 Å²	148.2	79%	0.785	76%	0.763	S	S	*	*			cis	-147.4	155	-10	-116.1	161.2	0	0	0	108.4
403	T	25.9	Very low	27.9	Very low	113 Å²	113	148.5 Å²	148.5	69%	0.693	77%	0.767	S	S	*	*			trans	-108	167.9	-179.4	52.3	0	0	0	0	112.7
404	N	27.9	Very low	27.9	Very low	125 Å²	125	147.4 Å²	147.4	67%	0.668	78%	0.775	S	S	*	*			trans	82.6	108.3	165.3	-51.3	-11.2	0	0	0	117.5
405	N	30.4	Very low	28	Very low	161 Å²	161	143.2 Å²	143.2	86%	0.861	77%	0.771	S	S	*	*				-144.5	122.5	102.5	-79.3	-29.8	0	0	0	105.2
406	N	27.1	Very low	28.1	Very low	135 Å²	135	141.7 Å²	141.7	72%	0.722	77%	0.769	S	S	*	*				63.5	145	54.1	-82.7	6.5	0	0	0	115
407	E	29.8	Very low	28.2	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	77%	0.769	S	S	*	*			trans	74.4	138.7	-177.8	-56.3	-168.8	-179	0	0	116.4
408	T	31.2	Very low	28.2	Very low	125 Å²	125	146.7 Å²	146.7	77%	0.767	78%	0.778	S	S	*	*			cis	-147.5	157.8	-9.4	6.9	0	0	0	0	111.2
409	N	26	Very low	28.4	Very low	156 Å²	156	143.8 Å²	143.8	83%	0.834	77%	0.769	S	S	*	*			trans	-75.5	137.8	171.7	-67.2	-58.5	0	0	0	111.6
410	I	29	Very low	28.7	Very low	158 Å²	158	143.6 Å²	143.6	81%	0.81	77%	0.768	S	S	*	*			trans	-131.6	119.7	153.5	-63	-175.7	0	0	0	109.2	V412	I410-V412 HydrophobicContact CG2-CG2 4.35Å
411	V	26.2	Very low	28.8	Very low	118 Å²	118	145.7 Å²	145.7	72%	0.715	77%	0.772	S	S	*	*			trans	-93.4	129.4	177.1	174.9	0	0	0	0	109.6
412	V	29.8	Very low	28.8	Very low	128 Å²	128	145.4 Å²	145.4	78%	0.776	77%	0.769	S	S	*	*			trans	-137.3	125.2	162.9	-175.5	0	0	0	0	109.9	I410	I410-V412 HydrophobicContact CG2-CG2 4.35Å
413	H	27.8	Very low	28.9	Very low	164 Å²	164	144.1 Å²	144.1	76%	0.759	76%	0.764	S	S	*	*			trans	-75.2	140.8	177.4	-77.1	-130.3	0	0	0	112
414	S	29.1	Very low	29.2	Very low	115 Å²	115	143 Å²	143	80%	0.804	77%	0.766	S	S	*	*			trans	-145.6	96	152.9	64.8	0	0	0	0	112.2
415	V	29.5	Very low	29.4	Very low	111 Å²	111	143.6 Å²	143.6	67%	0.673	77%	0.774	S	S	*	*			trans	-39.6	124.1	177.9	177.3	0	0	0	0	114.6	K417	V415-K417 PolarHBondContact O-N 2.83Å
416	P	27.7	Very low	29.4	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	77%	0.766	S	S	*	*			trans	-71.4	113.9	155.3	30.1	-30.4	0	0	0	108.2	K418	P416-K418 PolarHBondContact O-N 3.18Å
417	K	29	Very low	29.5	Very low	191 Å²	191	147.9 Å²	147.9	83%	0.83	77%	0.768	S	S	*	*			trans	-58.5	113.5	-175.7	-77.8	-173.6	174.8	-177.9	0	111.4	V415 S419	V415-K417 PolarHBondContact O-N 2.83Å; K417-S419 VanDerWaalsContact C-N 3.31Å; K417-S419 PolarHBondContact O-N 3.21Å
418	K	26.6	Very low	29.6	Very low	220 Å²	220	147.8 Å²	147.8	96%	0.957	77%	0.77	S	S	*	*			trans	-62.1	94.9	155.8	-80	-175.3	175.6	176.8	0	107.9	P416	P416-K418 PolarHBondContact O-N 3.18Å
419	S	31.7	Very low	29.5	Very low	81 Å²	81	148.5 Å²	148.5	57%	0.566	77%	0.769	S	S	*	*			trans	-148.2	126.7	171.6	-174.8	0	0	0	0	109.8	K417 R421	K417-S419 VanDerWaalsContact C-N 3.31Å; K417-S419 PolarHBondContact O-N 3.21Å; S419-R421 PolarHBondContact O-N 2.87Å
420	N	30.9	Very low	29.7	Very low	156 Å²	156	147.1 Å²	147.1	83%	0.834	77%	0.766	S	S	*	*	S	Bend	trans	52.6	42.7	165.7	-61	-4.5	0	0	0	117.8
421	R	30.3	Very low	29.7	Very low	215 Å²	215	146.2 Å²	146.2	81%	0.811	77%	0.769	S	S	*	*			trans	-114.5	19.4	155.6	-115.3	-178.4	-178.5	-164.5	-1	115.4	S419	S419-R421 PolarHBondContact O-N 2.87Å
422	L	30.4	Very low	29.8	Very low	128 Å²	128	145.3 Å²	145.3	67%	0.67	77%	0.774	S	S	*	*	S	Bend	trans	-99.7	104.3	154.3	-86.5	73.7	0	0	0	108.3
423	N	30.6	Very low	29.8	Very low	127 Å²	127	145.5 Å²	145.5	68%	0.679	77%	0.774	S	S	*	*	S	Bend	trans	176.1	-22.1	154.3	-97	-24.1	0	0	0	112.9
424	A	32.7	Very low	29.8	Very low	89 Å²	89	145.4 Å²	145.4	74%	0.736	77%	0.774	S	S	*	*	S	Bend	trans	-84.7	-33.9	176.9	0	0	0	0	0	113.7
425	V	32.3	Very low	29.8	Very low	137 Å²	137	148.9 Å²	148.9	83%	0.83	78%	0.778	S	S	*	*	S	Bend	trans	-92.5	-1.6	-178	-174.2	0	0	0	0	112.3
426	R	29.3	Very low	29.7	Very low	185 Å²	185	151.9 Å²	151.9	70%	0.698	78%	0.784	S	S	*	*	S	Bend	trans	-110.7	32.5	178.2	-146.2	-179.7	-146.6	170.2	6.6	112.8
427	R	30.5	Very low	29.9	Very low	202 Å²	202	153.8 Å²	153.8	76%	0.762	78%	0.782	S	S	*	*	S	Bend	trans	-137.6	15.3	176.7	-77.4	-170.2	174.3	179.4	-0.9	114
428	M	31.6	Very low	29.8	Very low	177 Å²	177	150 Å²	150	87%	0.872	78%	0.777	S	S	*	*	S	Bend	trans	-114.8	-13.7	168.4	-76.6	-179	162	0	0	113.2
429	N	29.7	Very low	29.9	Very low	139 Å²	139	149.2 Å²	149.2	74%	0.743	77%	0.774	S	S	*	*	S	Bend	trans	-107	153.2	154.2	-68.4	-7.2	0	0	0	107.8
430	T	29.5	Very low	29.6	Very low	127 Å²	127	150 Å²	150	78%	0.779	78%	0.78	S	S	*	*	S	Bend	trans	69.6	51.7	-176.1	80.2	0	0	0	0	117.8
431	T	29.4	Very low	29.4	Very low	140 Å²	140	149 Å²	149	86%	0.859	77%	0.774	S	S	*	*			trans	-139	76.1	142.3	50.7	0	0	0	0	109.7
432	A	27.5	Very low	29.2	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	78%	0.775	S	S	*	*			trans	-130	68.7	175.6	0	0	0	0	0	109.3
433	V	30.8	Very low	29.2	Very low	131 Å²	131	147.1 Å²	147.1	79%	0.794	78%	0.781	S	S	*	*			trans	-136.9	111.3	165.2	-180	0	0	0	0	107.5
434	E	27.7	Very low	28.9	Very low	162 Å²	162	151.1 Å²	151.1	76%	0.757	79%	0.786	S	S	*	*			trans	13	114.5	156.5	-58.1	172.7	112.1	0	0	119.5
435	Q	28.7	Very low	28.7	Very low	189 Å²	189	155 Å²	155	88%	0.883	79%	0.787	S	S	*	*				-137.7	103.2	122.1	-77.7	-158	-27	0	0	109.5
436	H	27.9	Very low	28.4	Very low	174 Å²	174	155 Å²	155	81%	0.806	78%	0.783	S	S	*	*			trans	-75.7	127.3	168.2	-85.1	-94.2	0	0	0	110.1
437	H	30.5	Very low	28.4	Very low	160 Å²	160	156.3 Å²	156.3	74%	0.741	79%	0.794	S	S	*	*			trans	-132.2	123.9	157.8	-102.6	-76.6	0	0	0	109.1
438	P	27.2	Very low	28.1	Very low	111 Å²	111	156.8 Å²	156.8	72%	0.721	80%	0.796	S	S	*	*			trans	-79.7	138	178.7	32	-33.3	0	0	0	110.4
439	F	28.8	Very low	28	Very low	205 Å²	205	154.5 Å²	154.5	90%	0.899	78%	0.781	S	S	*	*			trans	-119.5	113.3	162.8	-103.6	-83.8	0	0	0	110.8
440	S	26.3	Very low	27.8	Very low	98 Å²	98	154.9 Å²	154.9	69%	0.685	78%	0.778	S	S	*	*			trans	-73.3	153.4	175.5	175.8	0	0	0	0	111.3	N442	S440-N442 PolarHBondContact O-N 3.5Å
441	N	26.5	Very low	27.7	Very low	133 Å²	133	153.9 Å²	153.9	71%	0.711	77%	0.772	S	S	*	*	S	Bend	trans	-34.8	119.1	167.8	-49.6	-82.2	0	0	0	113.6
442	N	25.6	Very low	27.6	Very low	155 Å²	155	156 Å²	156	83%	0.829	77%	0.769	S	S	*	*				169.5	100.7	113.5	-85.9	-20.6	0	0	0	109.9	S440	S440-N442 PolarHBondContact O-N 3.5Å
443	D	29.9	Very low	27.8	Very low	149 Å²	149	159.2 Å²	159.2	80%	0.797	77%	0.767	S	S	*	*			trans	-145.7	136.4	157.4	-134.5	-33	0	0	0	111.1
444	R	25	Very low	27.7	Very low	211 Å²	211	161.4 Å²	161.4	80%	0.796	77%	0.769	S	S	*	*			trans	-131.8	66.6	-154.7	-168.3	-171.3	-175.4	-172.8	3.8	111.8	N446	R444-N446 PolarHBondContact O-N 3.28Å
445	F	29.1	Very low	27.6	Very low	170 Å²	170	159.5 Å²	159.5	75%	0.746	77%	0.77	S	S	*	*			trans	-91.3	103.6	-179.5	-91.9	-85.6	0	0	0	113.5
446	N	25.1	Very low	27.4	Very low	139 Å²	139	156 Å²	156	74%	0.743	77%	0.766	S	S	*	*			trans	-65.4	131.7	169.7	-69.8	-42.9	0	0	0	111	R444	R444-N446 PolarHBondContact O-N 3.28Å
447	F	28.4	Very low	27.5	Very low	212 Å²	212	153.6 Å²	153.6	93%	0.93	77%	0.77	S	S	*	*			trans	-119.8	92	156.9	-129.6	-81.4	0	0	0	110	K449	F447-K449 PolarHBondContact O-N 3.31Å
448	R	24.1	Very low	27.3	Very low	212 Å²	212	151.3 Å²	151.3	80%	0.8	77%	0.772	S	S	*	*			trans	-71.8	117.7	-179.1	179.8	-177.7	-177	173.4	1.6	109.9
449	K	30	Very low	27.5	Very low	128 Å²	128	155.5 Å²	155.5	56%	0.557	78%	0.778	S	S	*	*			trans	-144.2	131.4	157	-150.7	159.5	-174.7	171.8	0	110.4	F447 T1200	F447-K449 PolarHBondContact O-N 3.31Å; K449-T1200 HydrophobicContact CD-CG2 4.2Å
450	Q	26.2	Very low	27.4	Very low	147 Å²	147	151.1 Å²	151.1	69%	0.687	77%	0.768	S	S	*	*			trans	-89.8	135.9	-170.3	-65.9	150.9	-74.2	0	0	111.4
451	T	28.1	Very low	27.5	Very low	106 Å²	106	154 Å²	154	65%	0.65	77%	0.771	S	S	*	*			trans	-137.8	130.8	138.9	39.3	0	0	0	0	107.3	S1201	T451-S1201 WeakPolarHBondContact CG2-OG 3.45Å
452	K	26.8	Very low	27.6	Very low	185 Å²	185	154.3 Å²	154.3	80%	0.804	77%	0.773	S	S	*	*			trans	-74.8	145.2	173.5	-63.8	176.3	178.5	178.7	0	109
453	H	30.5	Very low	27.6	Very low	167 Å²	167	157.4 Å²	157.4	77%	0.773	77%	0.774	S	S	*	*				-156.7	154	116.8	-102	-72.9	0	0	0	109
454	Q	28.8	Very low	27.7	Very low	177 Å²	177	155.4 Å²	155.4	83%	0.827	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-86.6	158.8	-169.9	-84	161.4	-90.7	0	0	112.9
455	P	26.6	Very low	27.6	Very low	121 Å²	121	150.5 Å²	150.5	79%	0.786	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-72.6	163.7	179.2	31.8	-36.9	0	0	0	112.8
456	S	25	Very low	27.5	Very low	115 Å²	115	148.2 Å²	148.2	80%	0.804	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-57.7	145.6	174.3	52.5	0	0	0	0	114.3
457	S	29.9	Very low	27.6	Very low	125 Å²	125	148.5 Å²	148.5	87%	0.874	77%	0.768	S	S	*	*			trans	-125.2	136.7	144.1	64.9	0	0	0	0	109.4
458	S	26	Very low	27.6	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	75%	0.754	S	S	*	*			trans	-113.2	127.6	-175.9	53.8	0	0	0	0	110.5
459	K	30.4	Very low	27.7	Very low	198 Å²	198	143.4 Å²	143.4	86%	0.861	75%	0.751	S	S	*	*			trans	-140.7	99.8	160.4	-85.1	-163.5	172.5	-174.7	0	111.5
460	T	27.2	Very low	27.6	Very low	113 Å²	113	145.6 Å²	145.6	69%	0.693	76%	0.757	S	S	*	*				43.9	133.4	124.6	50.4	0	0	0	0	121.4
461	E	27.7	Very low	27.6	Very low	159 Å²	159	143.8 Å²	143.8	74%	0.743	76%	0.757	S	S	*	*			trans	101.4	103.7	143.8	-72.7	160.6	-137.2	0	0	121.5
462	N	28.4	Very low	27.6	Very low	139 Å²	139	147.6 Å²	147.6	74%	0.743	77%	0.767	S	S	*	*				75.1	122.2	124.5	-60.7	-17.3	0	0	0	123.2
463	Y	26.2	Very low	27.7	Very low	220 Å²	220	141.8 Å²	141.8	86%	0.863	76%	0.759	S	S	*	*			trans	-24.1	165.8	146.4	-62.7	-82.3	0	0	0	118.5
464	P	32.1	Very low	27.6	Very low	107 Å²	107	139.8 Å²	139.8	70%	0.695	76%	0.759	S	S	*	*			cis	-142.1	179.1	-28.3	37.6	-19.2	0	0	0	115.6
465	C	23.6	Very low	27.6	Very low	109 Å²	109	138.6 Å²	138.6	74%	0.736	76%	0.758	S	S	*	*			trans	70.9	133	146.1	-79.5	0	0	0	0	123.5
466	T	27.2	Very low	27.6	Very low	122 Å²	122	136.9 Å²	136.9	75%	0.748	75%	0.748	S	S	*	*			trans	76.1	104.7	144.7	51.7	0	0	0	0	122.8
467	N	25.9	Very low	27.9	Very low	144 Å²	144	138.6 Å²	138.6	77%	0.77	74%	0.744	S	S	*	*				52.9	103.9	124.1	-82.5	-36.1	0	0	0	120.7
468	K	28	Very low	27.8	Very low	148 Å²	148	138.2 Å²	138.2	64%	0.643	73%	0.732	S	S	*	*				-174.5	176	94.9	-102.4	163.6	-164.6	-173.2	0	116.2	K361 N362	K361-K468 PolarHBondContact O-NZ 2.9Å; N362-K468 WeakPolarHBondContact O-CE 3.48Å; N362-K468 PolarHBondContact O-NZ 2.91Å
469	K	26.8	Very low	28.1	Very low	170 Å²	170	139.7 Å²	139.7	74%	0.739	73%	0.731	S	S	*	*			trans	-81.1	-179.7	-173	-66.3	177.3	173.4	-176.1	0	113.9
470	Y	27.5	Very low	28.2	Very low	173 Å²	173	136.4 Å²	136.4	68%	0.678	72%	0.721	S	S	*	*			trans	88.9	136.6	160.2	-61.5	-83.2	0	0	0	116.9
471	T	27.5	Very low	28.4	Very low	110 Å²	110	137.9 Å²	137.9	68%	0.675	73%	0.725	S	S	*	*			cis	-165.7	155.3	-26.7	8.8	0	0	0	0	111.2
472	H	28.4	Very low	28.5	Very low	186 Å²	186	135.5 Å²	135.5	86%	0.861	72%	0.722	S	S	*	*			trans	38.1	128.7	149.6	-87.1	-92.9	0	0	0	123.7
473	G	28.8	Very low	28.6	Very low	63 Å²	63	134.2 Å²	134.2	65%	0.649	72%	0.723	S	S	*	*			trans	101.9	159.9	133.3	0	0	0	0	0	118.1
474	T	28.4	Very low	28.8	Very low	124 Å²	124	127.9 Å²	127.9	76%	0.761	72%	0.716	S	S	*	*			cis	-171.1	149.6	-16.6	-1	0	0	0	0	110
475	L	27.5	Very low	28.6	Very low	153 Å²	153	128.6 Å²	128.6	80%	0.801	72%	0.723	S	S	*	*			trans	64.2	161.3	163.5	-87	73.2	0	0	0	116.5
476	S	28	Very low	28.9	Very low	84 Å²	84	131.4 Å²	131.4	59%	0.587	72%	0.722	S	S	*	*			cis	-168.3	152.5	-15.8	47.1	0	0	0	0	113.2
477	Q	29.6	Very low	28.9	Very low	152 Å²	152	131.9 Å²	131.9	71%	0.71	72%	0.72	S	S	*	*			trans	73.8	117.3	138.7	-76	177.8	-95.5	0	0	124.4
478	D	28.9	Very low	29.1	Very low	116 Å²	116	131.9 Å²	131.9	62%	0.62	72%	0.719	S	S	*	*				90.4	141.7	117.4	-58	-11.2	0	0	0	125.1
479	N	32.9	Very low	29	Very low	143 Å²	143	130.9 Å²	130.9	77%	0.765	72%	0.721	S	S	*	*			trans	82.5	156.2	157.8	-56.5	-47.8	0	0	0	120.8
480	I	31.7	Very low	29	Very low	130 Å²	130	127.2 Å²	127.2	67%	0.667	72%	0.716	S	S	*	*				-175.3	156.2	-54	-106	169.1	0	0	0	110.2
481	N	31.4	Very low	29	Very low	144 Å²	144	124 Å²	124	77%	0.77	72%	0.719	S	S	*	*			trans	78	162.7	170	-69.1	-33.1	0	0	0	120.7
482	T	29.5	Very low	28.9	Very low	109 Å²	109	123 Å²	123	67%	0.669	72%	0.717	S	S	*	*			cis	179	148.2	-45.9	-85.4	0	0	0	0	111.3
483	S	31.2	Very low	28.9	Very low	112 Å²	112	121.4 Å²	121.4	78%	0.783	71%	0.713	S	S	*	*			trans	69.8	158.6	160.3	62.5	0	0	0	0	121.7
484	A	29.6	Very low	28.7	Very low	86 Å²	86	127 Å²	127	71%	0.711	72%	0.722	S	S	*	*			cis	-176.3	161.2	-29	0	0	0	0	0	113.8
485	C	27.5	Very low	28.6	Very low	123 Å²	123	129.6 Å²	129.6	83%	0.831	73%	0.731	S	S	*	*			trans	74.3	157.9	158.5	-70.3	0	0	0	0	121.5
486	K	29.9	Very low	28.7	Very low	168 Å²	168	125 Å²	125	73%	0.73	72%	0.72	S	S	*	*			cis	-179.7	159.1	-27.9	-158.4	178.5	-175.8	178.5	0	112.6
487	L	28.4	Very low	28.7	Very low	132 Å²	132	126.2 Å²	126.2	69%	0.691	73%	0.729	S	S	*	*			trans	91.3	121.9	161.4	-51.4	176.4	0	0	0	118.4
488	L	30	Very low	28.8	Very low	144 Å²	144	126.4 Å²	126.4	75%	0.754	73%	0.734	S	S	*	*				76.3	145.7	93.4	-62.5	-176.6	0	0	0	115.4
489	D	26.7	Very low	28.8	Very low	127 Å²	127	125.1 Å²	125.1	68%	0.679	73%	0.734	S	S	*	*			cis	-157.9	164.1	7.3	-139.9	-42.8	0	0	0	115.1
490	S	26.8	Very low	28.6	Very low	92 Å²	92	125.2 Å²	125.2	64%	0.643	73%	0.732	S	S	*	*			trans	46	108.3	145.1	-72.1	0	0	0	0	125.9
491	S	26.4	Very low	28.4	Very low	105 Å²	105	127 Å²	127	73%	0.734	74%	0.738	S	S	*	*				87.1	151.8	116.1	83.1	0	0	0	0	124
492	S	26.3	Very low	28.4	Very low	91 Å²	91	125.7 Å²	125.7	64%	0.636	74%	0.739	S	S	*	*			trans	103.2	123.6	140.6	-59.4	0	0	0	0	121.8
493	I	26.7	Very low	28.3	Very low	151 Å²	151	131.4 Å²	131.4	77%	0.774	75%	0.749	S	S	*	*			trans	68	144.6	136.4	-63.4	170.1	0	0	0	118.4
494	E	26	Very low	28.6	Very low	180 Å²	180	131.8 Å²	131.8	84%	0.841	75%	0.749	S	S	*	*			cis	-158.3	-179.1	-27.6	-104.2	-166.5	133.4	0	0	108.1
495	L	25.7	Very low	28.6	Very low	180 Å²	180	133.5 Å²	133.5	94%	0.942	75%	0.75	S	S	*	*			trans	-91.5	135.6	174.3	-88.5	149.5	0	0	0	113.3
496	G	29.2	Very low	28.9	Very low	56 Å²	56	133.4 Å²	133.4	58%	0.577	75%	0.748	S	S	*	*			trans	-129.4	135.2	156.1	0	0	0	0	0	109
497	S	29.4	Very low	29.1	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	75%	0.753	S	S	*	*				59.9	123	87.2	69.1	0	0	0	0	113.2
498	D	30.7	Very low	29.1	Very low	155 Å²	155	130 Å²	130	83%	0.829	76%	0.757	S	S	*	*			cis	-159	179.3	13	-132.8	-41.3	0	0	0	115.6
499	S	29.1	Very low	29.2	Very low	89 Å²	89	129.7 Å²	129.7	62%	0.622	76%	0.762	S	S	*	*			trans	-58.7	159.8	-178	68.6	0	0	0	0	116.7
500	M	29.3	Very low	29.2	Very low	146 Å²	146	130.7 Å²	130.7	72%	0.719	77%	0.766	S	S	*	*				-174.2	148.3	93.7	-94.5	-158.4	175	0	0	114.9
501	Q	28	Very low	29.3	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	78%	0.776	S	S	*	*			trans	42.9	144.9	136	-51.2	-179.1	8.6	0	0	120.9
502	S	29.5	Very low	29.3	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	78%	0.784	S	S	*	*			cis	-155.1	-166.3	31	61.7	0	0	0	0	114.4
503	R	28.3	Very low	29.5	Very low	230 Å²	230	143.1 Å²	143.1	87%	0.868	79%	0.785	S	S	*	*			trans	-108.5	-157.2	-171.6	-54.8	169	165.7	173.8	-6.6	111.1
504	P	36.8	Very low	29.6	Very low	120 Å²	120	140.9 Å²	140.9	78%	0.779	78%	0.783	S	S	*	*			cis	-107.2	-134.7	-39.1	12.9	10.7	0	0	0	110.7
505	V	30.9	Very low	29.8	Very low	122 Å²	122	137.7 Å²	137.7	74%	0.739	78%	0.78	S	S	*	*			cis	-151.9	144.4	4	176.9	0	0	0	0	109.6
506	P	33.6	Very low	30	Very low	120 Å²	120	134.6 Å²	134.6	78%	0.779	77%	0.774	S	S	*	*			trans	-107.2	167.8	166.7	39.6	-32.3	0	0	0	114.1
507	A	33.4	Very low	30	Very low	103 Å²	103	135 Å²	135	85%	0.851	78%	0.777	S	S	*	*			trans	-139.8	152	171	0	0	0	0	0	112.1
508	T	28.7	Very low	29.9	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	78%	0.78	S	S	*	*			trans	-129.6	140.1	-169	-56.7	0	0	0	0	111.2
509	T	31.6	Very low	29.8	Very low	138 Å²	138	140.1 Å²	140.1	85%	0.847	78%	0.784	S	S	*	*			trans	-138.6	133	160.7	-47.1	0	0	0	0	110.4
510	L	27.2	Very low	30	Very low	147 Å²	147	143.4 Å²	143.4	77%	0.77	79%	0.794	S	S	*	*			trans	-107.8	155.3	170.8	-93.8	162.7	0	0	0	109.3
511	Y	28.2	Very low	30.2	Very low	216 Å²	216	141.7 Å²	141.7	85%	0.847	79%	0.794	S	S	*	*			trans	-142.2	144.4	152.6	-122.7	-87.3	0	0	0	110.8
512	R	26.2	Very low	30.3	Very low	238 Å²	238	141.6 Å²	141.6	90%	0.898	79%	0.794	S	S	*	*			trans	-154.4	118.3	-175.6	178.6	-165.7	-177	-168	3.1	110.6
513	S	31.7	Very low	30	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	80%	0.796	S	S	*	*			trans	-172.7	156.8	167.4	40.1	0	0	0	0	109.7
514	S	27.7	Very low	30	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	79%	0.789	S	S	*	*			cis	-175.4	175.9	-43.8	41.5	0	0	0	0	108.9
515	S	31.3	Very low	29.6	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	78%	0.784	S	S	*	*			trans	78.3	155	170	84.9	0	0	0	0	117.2
516	S	28.4	Very low	29.5	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	78%	0.779	S	S	*	*			cis	-173.9	152.9	-33.4	52.1	0	0	0	0	111.2
517	G	30	Very low	29.4	Very low	63 Å²	63	142.9 Å²	142.9	65%	0.649	78%	0.779	S	S	*	*			trans	112.8	103.8	166.5	0	0	0	0	0	113.1
518	T	27.5	Very low	29.2	Very low	135 Å²	135	141.4 Å²	141.4	83%	0.828	77%	0.774	S	S	*	*			cis	77.5	97.7	47.3	75.5	0	0	0	0	115.9
519	R	28.5	Very low	29.4	Very low	239 Å²	239	141.6 Å²	141.6	90%	0.902	78%	0.775	S	S	*	*				-179.8	108.9	124.5	-100.3	169.5	179.2	176.9	-0.4	113.5
520	N	33.4	Very low	29.4	Very low	157 Å²	157	140.4 Å²	140.4	84%	0.84	76%	0.763	S	S	*	*			trans	-81.5	161	134.6	-86.5	3.2	0	0	0	106.7
521	P	32.8	Very low	29.6	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	76%	0.759	S	S	*	*			cis	-130.1	-158.2	49.2	29.1	-3	0	0	0	111.3
522	E	29.8	Very low	29.8	Very low	165 Å²	165	136.8 Å²	136.8	77%	0.771	76%	0.76	S	S	*	*			cis	-140.9	147.3	13.9	-59	166	136.1	0	0	107.6
523	F	24.9	Very low	29.9	Very low	198 Å²	198	133.3 Å²	133.3	87%	0.868	75%	0.751	S	S	*	*				55.8	117	59.4	-109.2	-80.8	0	0	0	114.7
524	I	28.3	Very low	30	Very low	139 Å²	139	135.8 Å²	135.8	71%	0.713	76%	0.756	S	S	*	*			trans	165.4	117	141.5	-89.5	158.8	0	0	0	110.3
525	N	28.1	Very low	30.1	Very low	126 Å²	126	136.2 Å²	136.2	67%	0.674	75%	0.75	S	S	*	*			trans	61.2	150.3	145.4	-63.8	40.8	0	0	0	120.7
526	D	28.8	Very low	30.1	Very low	119 Å²	119	137.2 Å²	137.2	64%	0.636	75%	0.752	S	S	*	*			cis	-152.9	162.2	-0.3	-122.7	-31.6	0	0	0	113.4
527	I	30.3	Very low	30.1	Very low	153 Å²	153	134.6 Å²	134.6	79%	0.785	74%	0.742	S	S	*	*			trans	43.1	97.3	155.5	-55.2	156.6	0	0	0	115.5
528	G	30.4	Very low	30.2	Very low	72 Å²	72	140.4 Å²	140.4	74%	0.742	76%	0.757	S	S	*	*				136.6	-160.6	67.3	0	0	0	0	0	108.8
529	V	31.8	Very low	30.4	Very low	130 Å²	130	137.3 Å²	137.3	79%	0.788	75%	0.752	S	S	*	*			cis	-176.2	133.5	-24.9	144.5	0	0	0	0	102.9
530	D	31.9	Very low	30.7	Very low	112 Å²	112	132.6 Å²	132.6	60%	0.599	75%	0.749	S	S	*	*			cis	-144.2	156.2	6.2	-130.3	20.4	0	0	0	110.1
531	Q	31.5	Very low	30.8	Very low	146 Å²	146	129.8 Å²	129.8	68%	0.682	74%	0.74	S	S	*	*				50.2	133	104.9	-58.8	-175.3	59	0	0	116.7
532	T	31.6	Very low	30.7	Very low	141 Å²	141	131 Å²	131	87%	0.865	74%	0.74	S	S	*	*				-118.2	133.1	51.8	52.4	0	0	0	0	116.7
533	F	29.1	Very low	30.7	Very low	165 Å²	165	128.6 Å²	128.6	72%	0.724	74%	0.741	S	S	*	*			trans	-75.6	172.3	161.5	-104.7	-110.2	0	0	0	111
534	I	33.9	Very low	31.2	Very low	148 Å²	148	124.7 Å²	124.7	76%	0.759	74%	0.736	S	S	*	*				-167.3	126.7	84.6	-88.2	169.3	0	0	0	110.2
535	N	28.9	Very low	31.3	Very low	112 Å²	112	125.5 Å²	125.5	60%	0.599	74%	0.74	S	S	*	*				34.8	147.8	128.9	-48.2	-13.3	0	0	0	119.4
536	T	31.5	Very low	31.3	Very low	135 Å²	135	124.8 Å²	124.8	83%	0.828	74%	0.741	S	S	*	*			cis	-169.6	163.9	2	13.8	0	0	0	0	105.8
537	G	30.1	Very low	31.3	Very low	60 Å²	60	127 Å²	127	62%	0.619	75%	0.752	S	S	*	*			cis	147.2	166.5	6.1	0	0	0	0	0	109.6
538	I	30.3	Very low	31.3	Very low	185 Å²	185	124.5 Å²	124.5	95%	0.949	75%	0.754	S	S	*	*			trans	70.5	130.4	168.5	-51.2	165.7	0	0	0	116.3
539	G	33	Very low	31.4	Very low	71 Å²	71	128.6 Å²	128.6	73%	0.732	76%	0.758	S	S	*	*			trans	149.1	90.5	171.8	0	0	0	0	0	112.9
540	V	33.4	Very low	31.2	Very low	139 Å²	139	131.7 Å²	131.7	84%	0.842	76%	0.761	S	S	*	*			trans	-116.2	-173.6	-174.6	-136.7	0	0	0	0	110.3
541	P	35.7	Very low	31.3	Very low	98 Å²	98	132.3 Å²	132.3	64%	0.636	77%	0.774	S	S	*	*				-119.8	-167.2	-118.8	40.1	-22	0	0	0	115.3
542	N	31.6	Very low	31.1	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	78%	0.781	S	S	*	*			trans	116.2	108.8	148.7	-63.8	-33.5	0	0	0	119.7
543	S	29.5	Very low	31	Very low	114 Å²	114	131.6 Å²	131.6	80%	0.797	78%	0.78	S	S	*	*				79.9	158	128.6	73.3	0	0	0	0	120.8
544	P	34.7	Very low	30.8	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	78%	0.783	S	S	*	*			trans	-123.4	161.9	-156.4	42.1	-29	0	0	0	116.8
545	I	31.8	Very low	30.7	Very low	156 Å²	156	128.5 Å²	128.5	80%	0.8	79%	0.786	S	S	*	*			trans	-158.2	110.9	162.7	-97.1	141.3	0	0	0	105
546	T	27.5	Very low	30.5	Very low	111 Å²	111	127.9 Å²	127.9	68%	0.681	79%	0.791	S	S	*	*				74.7	144.1	74.2	59.5	0	0	0	0	115.8
547	L	29.6	Very low	30.4	Very low	165 Å²	165	128.2 Å²	128.2	86%	0.864	79%	0.786	S	S	*	*			trans	67.9	104.7	-170.9	-60.9	121.2	0	0	0	114
548	A	29.2	Very low	30.2	Very low	100 Å²	100	132 Å²	132	83%	0.826	79%	0.792	S	S	*	*			cis	87.2	113.3	42.2	0	0	0	0	0	114.1
549	D	32.2	Very low	30.2	Very low	158 Å²	158	128.7 Å²	128.7	85%	0.845	79%	0.785	S	S	*	*			trans	-141.4	167	155	-147.4	-18.7	0	0	0	110.7
550	K	28.7	Very low	30	Very low	195 Å²	195	130.6 Å²	130.6	85%	0.848	79%	0.788	S	S	*	*			trans	-98.5	128.2	-158.6	-59	161	-174.7	162.8	0	113.1
551	S	34.4	Very low	29.9	Very low	125 Å²	125	128.6 Å²	128.6	87%	0.874	78%	0.776	S	S	*	*			trans	-158	125.2	145	36.5	0	0	0	0	111.5
552	T	26.4	Very low	29.5	Very low	133 Å²	133	133.3 Å²	133.3	82%	0.816	79%	0.792	S	S	*	*			trans	-99.7	119.4	-177.6	-57.2	0	0	0	0	110.4
553	V	29.9	Very low	29.5	Very low	139 Å²	139	133 Å²	133	84%	0.842	79%	0.789	S	S	*	*			trans	-143.4	128.8	149.3	-177.5	0	0	0	0	109.4
554	T	25.1	Very low	29.5	Very low	128 Å²	128	134.8 Å²	134.8	79%	0.785	79%	0.788	S	S	*	*			trans	-97	133.2	173.3	48.4	0	0	0	0	110.8
555	S	30.4	Very low	29.4	Very low	120 Å²	120	136.7 Å²	136.7	84%	0.839	79%	0.791	S	S	*	*			trans	-146.6	110.3	163	45	0	0	0	0	113.6
556	S	26.1	Very low	29.3	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	79%	0.79	S	S	*	*			trans	-75.6	151.2	179.2	48.8	0	0	0	0	115.5
557	I	28	Very low	29.6	Very low	143 Å²	143	139.8 Å²	139.8	73%	0.733	80%	0.8	S	S	*	*			trans	61.7	119.4	135.4	-59.7	163.8	0	0	0	119
558	N	26.8	Very low	29.6	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	80%	0.799	S	S	*	*				172.9	128	118.3	-100.8	-57.3	0	0	0	115.2
559	S	30.2	Very low	29.7	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	80%	0.796	S	S	*	*	S	Bend	trans	169.6	118.3	144.9	-80.3	0	0	0	0	110.2
560	S	27.9	Very low	29.5	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	79%	0.792	S	S	*	*	S	Bend	cis	-148	109.8	-3.4	-62.5	0	0	0	0	109.9
561	T	31.6	Very low	29.4	Very low	97 Å²	97	133.2 Å²	133.2	60%	0.595	79%	0.786	S	S	*	*			trans	-132.9	99.3	-180	-43.5	0	0	0	0	109.5	I563	T561-I563 HydrophobicContact CG2-CD1 4.38Å; T561-I563 HydrophobicContact CG2-CG1 4.03Å; T561-I563 PolarHBondContact O-N 2.95Å; T561-I563 VanDerWaalsContact O-N 3.14Å
562	M	27.5	Very low	29.3	Very low	197 Å²	197	133.2 Å²	133.2	97%	0.97	78%	0.781	S	S	*	*			trans	-75.2	99.2	167.9	-98.7	-172.1	171.2	0	0	109.1
563	I	32.9	Very low	29.5	Very low	130 Å²	130	132.8 Å²	132.8	67%	0.667	78%	0.778	S	S	*	*			trans	-95.5	123.4	160.5	-65.9	-179.8	0	0	0	107.1	T561 L565	T561-I563 HydrophobicContact CG2-CD1 4.38Å; T561-I563 HydrophobicContact CG2-CG1 4.03Å; T561-I563 PolarHBondContact O-N 2.95Å; T561-I563 VanDerWaalsContact O-N 3.14Å; I563-L565 HydrophobicContact CG2-CG 4.36Å; I563-L565 PolarHBondContact O-N 3.36Å
564	I	28.3	Very low	29.8	Very low	152 Å²	152	132 Å²	132	78%	0.779	78%	0.776	S	S	*	*			trans	-78.6	118.4	170.1	-62.1	169.1	0	0	0	107.3
565	L	32.4	Very low	30	Very low	158 Å²	158	131.8 Å²	131.8	83%	0.827	78%	0.775	S	S	*	*			trans	-128	138.9	155.5	-78.6	175	0	0	0	108.1	I563	I563-L565 HydrophobicContact CG2-CG 4.36Å; I563-L565 PolarHBondContact O-N 3.36Å
566	Q	30.5	Very low	30.1	Very low	167 Å²	167	131.2 Å²	131.2	78%	0.78	77%	0.767	S	S	*	*			trans	-77.5	146.1	-174.7	-66.9	145.9	-98.5	0	0	111
567	N	33.6	Very low	30.5	Very low	165 Å²	165	133.5 Å²	133.5	88%	0.882	78%	0.776	S	S	*	*				-150.1	151.2	129.3	-105.6	-24.7	0	0	0	110
568	N	29.5	Very low	30.8	Very low	158 Å²	158	130.6 Å²	130.6	85%	0.845	77%	0.774	S	S	*	*			trans	-78.4	134.2	-174.5	-67.5	-33.6	0	0	0	111.2
569	A	30.4	Very low	31.2	Very low	93 Å²	93	130.6 Å²	130.6	77%	0.769	77%	0.773	S	S	*	*				-173.7	137	128.6	0	0	0	0	0	112.4
570	T	28.5	Very low	31.6	Very low	125 Å²	125	132.2 Å²	132.2	77%	0.767	78%	0.777	S	S	*	*			trans	-24.4	124.1	162.8	49.6	0	0	0	0	118.8
571	S	27.2	Very low	31.9	Very low	103 Å²	103	131.4 Å²	131.4	72%	0.72	78%	0.778	S	S	*	*			trans	64.8	171.6	139	75.5	0	0	0	0	120.5
572	T	31.5	Very low	32	Very low	126 Å²	126	134.4 Å²	134.4	77%	0.773	79%	0.789	S	S	*	*			trans	71.8	110.2	174.2	63	0	0	0	0	119.2
573	T	30.5	Very low	32.6	Very low	123 Å²	123	129.3 Å²	129.3	76%	0.755	78%	0.778	S	S	*	*			trans	-29	129.1	156.6	47.2	0	0	0	0	117.4
574	P	36.2	Very low	33	Very low	123 Å²	123	131.1 Å²	131.1	80%	0.799	79%	0.79	S	S	*	*			trans	-97.1	98.6	168.6	34.5	-30.3	0	0	0	112.9
575	T	30.8	Very low	33.4	Very low	123 Å²	123	127.8 Å²	127.8	76%	0.755	79%	0.793	S	S	*	*			trans	-101.7	65.7	171.3	48.6	0	0	0	0	111.7
576	T	31.9	Very low	33.7	Very low	109 Å²	109	126 Å²	126	67%	0.669	79%	0.793	S	S	*	*			trans	-139.1	75.6	-168.3	-43.3	0	0	0	0	113.6
577	T	33.5	Very low	33.9	Very low	146 Å²	146	124.2 Å²	124.2	90%	0.896	79%	0.794	S	S	*	*			trans	-155.2	36.8	170	-22.8	0	0	0	0	114.3
578	A	34.4	Very low	34.1	Very low	82 Å²	82	124 Å²	124	68%	0.678	79%	0.793	S	S	*	*			trans	-129.2	13.5	-170.3	0	0	0	0	0	115.7
579	I	35	Very low	34.4	Very low	140 Å²	140	125.1 Å²	125.1	72%	0.718	79%	0.793	S	S	*	*			trans	-101	-20.1	-165.1	-66.5	175.1	0	0	0	113.6	A581	I579-A581 VanDerWaalsContact C-N 3.34Å; I579-A581 PolarHBondContact O-N 2.99Å
580	T	38.9	Very low	34.7	Very low	148 Å²	148	125.9 Å²	125.9	91%	0.908	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	11.8	-169.2	-23.2	0	0	0	0	115.7
581	A	35.4	Very low	34.9	Very low	94 Å²	94	126.7 Å²	126.7	78%	0.777	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	7.1	-169.3	0	0	0	0	0	115.4	I579	I579-A581 VanDerWaalsContact C-N 3.34Å; I579-A581 PolarHBondContact O-N 2.99Å
582	L	34.1	Very low	35.7	Very low	160 Å²	160	127.2 Å²	127.2	84%	0.838	80%	0.796	S	S	*	*			trans	-100.5	9.5	-171.5	-83.1	161.7	0	0	0	115.2
583	A	39.7	Very low	36.4	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	78%	0.782	S	S	*	*	S	Bend	trans	-104.4	67	-177.3	0	0	0	0	0	112.9
584	N	40.6	Very low	37.3	Very low	169 Å²	169	124.7 Å²	124.7	90%	0.904	78%	0.779	S	S	*	*	S	Bend	trans	176.3	124.9	145.9	-90.3	-27.5	0	0	0	109.2
585	G	36.3	Very low	37.8	Very low	82 Å²	82	125.3 Å²	125.3	85%	0.845	78%	0.775	S	S	*	*			trans	-96.1	136.8	-163	0	0	0	0	0	115.9
586	S	39.4	Very low	38.7	Very low	119 Å²	119	126.3 Å²	126.3	83%	0.832	77%	0.768	S	S	*	*			trans	-155.7	106.4	145.3	-167.7	0	0	0	0	108
587	V	35.2	Very low	39.4	Very low	131 Å²	131	127.2 Å²	127.2	79%	0.794	77%	0.765	S	S	*	*			trans	-88.1	127.6	-177.1	177.1	0	0	0	0	109.6
588	N	37.1	Very low	40.8	Very low	161 Å²	161	124 Å²	124	86%	0.861	75%	0.749	S	S	*	*			trans	-142.6	151.6	153.3	-97	-41.9	0	0	0	108.7
589	E	35	Very low	42.6	Very low	181 Å²	181	124.2 Å²	124.2	85%	0.846	74%	0.741	S	S	*	*			trans	-110	111	-142.1	-172.1	174.2	-166	0	0	114.3
590	S	38.3	Very low	44.5	Very low	109 Å²	109	120.6 Å²	120.6	76%	0.762	73%	0.729	S	S	*	*			trans	-158.2	104.4	158.7	65.7	0	0	0	0	110.7
591	T	32.8	Very low	46.3	Very low	141 Å²	141	115.8 Å²	115.8	87%	0.865	70%	0.701	S	S	*	*			trans	-83.1	120.2	-173.1	37.8	0	0	0	0	113
592	V	43.8	Very low	48.5	Very low	114 Å²	114	117.8 Å²	117.8	69%	0.691	69%	0.69	S	S	*	*			trans	-137.5	124.4	172	-179.3	0	0	0	0	109.2	P594	V592-P594 WeakPolarHBondContact O-CD 3.25Å
593	D	45.3	Very low	50.8	Low	91 Å²	91	114.8 Å²	114.8	49%	0.487	67%	0.674	S	S	.	*			trans	-56.1	111.2	-173.3	-62.8	-35.4	0	0	0	113.8	L595 K596	D593-L595 PolarHBondContact O-N 3.07Å; D593-K596 HydrophobicContact CB-CB 4.47Å; D593-K596 HydrophobicContact CB-CD 4.28Å; D593-K596 HydrophobicContact CB-CG 4.41Å; D593-K596 PolarHBondContact O-N 2.75Å; D593-K596 IonicContact OD2-NZ 2.73Å; D593-K596 PolarHBondContact OD2-NZ 3.05Å
594	P	49.1	Very low	52.7	Low	106 Å²	106	116.1 Å²	116.1	69%	0.688	66%	0.663	S	S	*	*	H	α-helix	trans	-61.4	-30.6	179	-24.8	36	0	0	0	113.2	V592 K596 Q597 S598	V592-P594 WeakPolarHBondContact O-CD 3.25Å; P594-K596 PolarHBondContact O-N 2.92Å; P594-Q597 PolarHBondContact O-N 3.11Å; P594-S598 PolarHBondContact O-N 3.41Å
595	L	46.6	Very low	54.6	Low	136 Å²	136	114.2 Å²	114.2	71%	0.712	65%	0.649	S	S	*	*	H	α-helix	trans	-67.4	-32.6	-176.7	-75.2	164.2	0	0	0	113.8	D593 Q597	D593-L595 PolarHBondContact O-N 3.07Å; L595-Q597 VanDerWaalsContact C-N 3.34Å
596	K	50.1	Low	56.8	Low	143 Å²	143	114.9 Å²	114.9	62%	0.622	63%	0.63	S	S	*	*	H	α-helix	trans	-73.6	-27.1	175.5	-76.1	173.7	-176.6	144.4	0	112.5	D593 P594 T599 S600	D593-K596 HydrophobicContact CB-CB 4.47Å; D593-K596 HydrophobicContact CB-CD 4.28Å; D593-K596 HydrophobicContact CB-CG 4.41Å; D593-K596 PolarHBondContact O-N 2.75Å; D593-K596 IonicContact OD2-NZ 2.73Å; D593-K596 PolarHBondContact OD2-NZ 3.05Å; P594-K596 PolarHBondContact O-N 2.92Å; K596-T599 PolarHBondContact O-OG1 3.37Å; K596-S600 PolarHBondContact O-N 2.97Å; K596-S600 PolarHBondContact O-OG 2.74Å
597	Q	47.5	Very low	58.9	Low	129 Å²	129	114.5 Å²	114.5	60%	0.603	61%	0.613	S	S	*	*	H	α-helix	trans	-78.1	-31	-179.1	-139.8	167.3	20.4	0	0	112.1	P594 L595 S600 S601	P594-Q597 PolarHBondContact O-N 3.11Å; L595-Q597 VanDerWaalsContact C-N 3.34Å; Q597-S600 PolarHBondContact O-OG 3.09Å; Q597-S601 WeakPolarHBondContact O-CB 3.32Å; Q597-S601 PolarHBondContact O-N 2.83Å; Q597-S601 PolarHBondContact O-OG 3.3Å
598	S	63.2	Low	61.1	Low	79 Å²	79	111.9 Å²	111.9	55%	0.552	59%	0.592	S	S	*	*	H	α-helix	trans	-65.7	-55.4	173.5	179.4	0	0	0	0	112.6	P594 S600 S601 Y602	P594-S598 PolarHBondContact O-N 3.41Å; S598-S600 PolarHBondContact O-N 2.63Å; S598-S601 PolarHBondContact O-N 2.61Å; S598-S601 VanDerWaalsContact O-N 3.12Å; S598-Y602 PolarHBondContact O-N 3.26Å
599	T	71.7	Confident	63.2	Low	85 Å²	85	106.8 Å²	106.8	52%	0.521	57%	0.572	S	S	.	*	H	α-helix	trans	-62.9	-41.4	-175	54.1	0	0	0	0	113	K596 S601 Y602 L603	K596-T599 PolarHBondContact O-OG1 3.37Å; T599-S601 VanDerWaalsContact C-N 3.32Å; T599-S601 PolarHBondContact O-N 2.95Å; T599-Y602 PolarHBondContact O-N 2.88Å; T599-L603 WeakPolarHBondContact O-CG 3.33Å; T599-L603 PolarHBondContact O-N 3.41Å
600	S	74.8	Confident	65.7	Low	65 Å²	65	101.8 Å²	101.8	46%	0.455	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-31.4	176.5	56.9	0	0	0	0	112.9	K596 Q597 S598 K604	K596-S600 PolarHBondContact O-N 2.97Å; K596-S600 PolarHBondContact O-OG 2.74Å; Q597-S600 PolarHBondContact O-OG 3.09Å; S598-S600 PolarHBondContact O-N 2.63Å; S600-K604 WeakPolarHBondContact O-CB 3.35Å; S600-K604 PolarHBondContact O-N 2.93Å
601	S	77.2	Confident	68	Low	47 Å²	47	97.6 Å²	97.6	33%	0.329	52%	0.516	S	S	.	.	H	α-helix	trans	-73.7	-46.4	174.5	-60.2	0	0	0	0	112	Q597 S598 T599 L603 K604 E605	Q597-S601 WeakPolarHBondContact O-CB 3.32Å; Q597-S601 PolarHBondContact O-N 2.83Å; Q597-S601 PolarHBondContact O-OG 3.3Å; S598-S601 PolarHBondContact O-N 2.61Å; S598-S601 VanDerWaalsContact O-N 3.12Å; T599-S601 VanDerWaalsContact C-N 3.32Å; T599-S601 PolarHBondContact O-N 2.95Å; S601-L603 PolarHBondContact O-N 3.04Å; S601-K604 WeakPolarHBondContact O-CB 2.95Å; S601-K604 PolarHBondContact O-N 2.73Å; S601-E605 PolarHBondContact O-N 2.94Å
602	Y	80.8	Confident	70.5	Confident	136 Å²	136	93 Å²	93	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-58.4	-47.9	177	177.5	-101.5	0	0	0	112.4	S598 T599 K604 E605 Q606	S598-Y602 PolarHBondContact O-N 3.26Å; T599-Y602 PolarHBondContact O-N 2.88Å; Y602-K604 VanDerWaalsContact C-N 3.31Å; Y602-K604 PolarHBondContact O-N 3.15Å; Y602-E605 PolarHBondContact O-N 3.02Å; Y602-Q606 HydrophobicContact CD1-CG 4.36Å; Y602-Q606 HydrophobicContact CE1-CG 3.95Å; Y602-Q606 HydrophobicContact CE2-CG 4.3Å; Y602-Q606 WeakPolarHBondContact O-CG 3.17Å; Y602-Q606 PolarHBondContact O-N 2.94Å; Y602-Q606 PolarHBondContact OH-NE2 3.27Å; Y602-Q606 VanDerWaalsContact OH-NE2 3.15Å
603	L	81.5	Confident	72.4	Confident	97 Å²	97	87.7 Å²	87.7	51%	0.508	45%	0.453	S	S	.	.	H	α-helix	trans	-60.4	-41.5	177	-72.6	173	0	0	0	111.9	T599 S601 E605 Q606 F607	T599-L603 WeakPolarHBondContact O-CG 3.33Å; T599-L603 PolarHBondContact O-N 3.41Å; S601-L603 PolarHBondContact O-N 3.04Å; L603-E605 VanDerWaalsContact C-N 3.34Å; L603-E605 PolarHBondContact O-N 3.4Å; L603-Q606 PolarHBondContact O-N 2.86Å; L603-F607 WeakPolarHBondContact O-CD2 3.27Å; L603-F607 PolarHBondContact O-N 2.9Å
604	K	80.9	Confident	74.1	Confident	118 Å²	118	84.4 Å²	84.4	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-64.6	-35.3	177.7	168.1	-174.6	162	-154.8	0	112.6	S600 S601 Y602 Q608	S600-K604 WeakPolarHBondContact O-CB 3.35Å; S600-K604 PolarHBondContact O-N 2.93Å; S601-K604 WeakPolarHBondContact O-CB 2.95Å; S601-K604 PolarHBondContact O-N 2.73Å; Y602-K604 VanDerWaalsContact C-N 3.31Å; Y602-K604 PolarHBondContact O-N 3.15Å; K604-Q608 WeakPolarHBondContact O-CB 3.44Å; K604-Q608 VanDerWaalsContact O-CG 3.3Å; K604-Q608 WeakPolarHBondContact O-CG 3.31Å; K604-Q608 PolarHBondContact O-N 2.81Å
605	E	80.5	Confident	75.5	Confident	129 Å²	129	84.3 Å²	84.3	60%	0.603	43%	0.431	S	S	*	.	H	α-helix	trans	-69.9	-44.1	172.9	-74.1	176.2	-175.1	0	0	111.6	S601 Y602 L603 F607 Q608 A609	S601-E605 PolarHBondContact O-N 2.94Å; Y602-E605 PolarHBondContact O-N 3.02Å; L603-E605 VanDerWaalsContact C-N 3.34Å; L603-E605 PolarHBondContact O-N 3.4Å; E605-F607 PolarHBondContact O-N 2.81Å; E605-Q608 PolarHBondContact O-N 2.62Å; E605-Q608 VanDerWaalsContact O-N 3.14Å; E605-A609 PolarHBondContact O-N 3.33Å
606	Q	82.9	Confident	77	Confident	96 Å²	96	81.6 Å²	81.6	45%	0.449	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-43.9	174	-68.7	-66.5	-13.5	0	0	112	Y602 L603 Q608 A609 F610	Y602-Q606 HydrophobicContact CD1-CG 4.36Å; Y602-Q606 HydrophobicContact CE1-CG 3.95Å; Y602-Q606 HydrophobicContact CE2-CG 4.3Å; Y602-Q606 WeakPolarHBondContact O-CG 3.17Å; Y602-Q606 PolarHBondContact O-N 2.94Å; Y602-Q606 PolarHBondContact OH-NE2 3.27Å; Y602-Q606 VanDerWaalsContact OH-NE2 3.15Å; L603-Q606 PolarHBondContact O-N 2.86Å; Q606-Q608 PolarHBondContact O-N 2.81Å; Q606-A609 PolarHBondContact O-N 3.02Å; Q606-F610 WeakPolarHBondContact O-CB 3.47Å; Q606-F610 PolarHBondContact O-N 3.21Å
607	F	82.3	Confident	78.1	Confident	110 Å²	110	84.2 Å²	84.2	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-40.1	173.4	-77.4	-60.4	0	0	0	112.7	L603 E605 F610 F611	L603-F607 WeakPolarHBondContact O-CD2 3.27Å; L603-F607 PolarHBondContact O-N 2.9Å; E605-F607 PolarHBondContact O-N 2.81Å; F607-F610 PolarHBondContact O-N 2.88Å; F607-F611 HydrophobicContact CB-CE2 4.45Å; F607-F611 WeakPolarHBondContact O-CD2 3.48Å; F607-F611 WeakPolarHBondContact O-CG 3.34Å; F607-F611 PolarHBondContact O-N 3.17Å; F607-F611 VanDerWaalsContact O-N 3.15Å
608	Q	81.5	Confident	79.1	Confident	76 Å²	76	81 Å²	81	36%	0.355	42%	0.415	S	S	.	.	H	α-helix	trans	-67	-36.4	176	-76	177.8	36.1	0	0	112.7	K604 E605 Q606 F611 Q612	K604-Q608 WeakPolarHBondContact O-CB 3.44Å; K604-Q608 VanDerWaalsContact O-CG 3.3Å; K604-Q608 WeakPolarHBondContact O-CG 3.31Å; K604-Q608 PolarHBondContact O-N 2.81Å; E605-Q608 PolarHBondContact O-N 2.62Å; E605-Q608 VanDerWaalsContact O-N 3.14Å; Q606-Q608 PolarHBondContact O-N 2.81Å; Q608-F611 PolarHBondContact O-N 2.97Å; Q608-Q612 WeakPolarHBondContact O-CG 3.13Å; Q608-Q612 PolarHBondContact O-N 3.42Å; Q608-Q612 PolarHBondContact O-NE2 2.92Å
609	A	82.6	Confident	79.5	Confident	54 Å²	54	77.3 Å²	77.3	45%	0.446	39%	0.389	S	S	.	.	H	α-helix	trans	-66.4	-37.8	172	0	0	0	0	0	111.7	E605 Q606 F611 Q612	E605-A609 PolarHBondContact O-N 3.33Å; Q606-A609 PolarHBondContact O-N 3.02Å; A609-F611 VanDerWaalsContact C-N 3.3Å; A609-F611 PolarHBondContact O-N 3.31Å; A609-Q612 WeakPolarHBondContact O-CB 3.37Å; A609-Q612 PolarHBondContact O-N 2.97Å; A609-Q612 VanDerWaalsContact O-N 3.09Å
610	F	86.6	Confident	79.6	Confident	76 Å²	76	75.5 Å²	75.5	33%	0.333	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-28.4	178.7	-165	-135.8	0	0	0	113.4	Q606 F607 N649 F650 Y653	Q606-F610 WeakPolarHBondContact O-CB 3.47Å; Q606-F610 PolarHBondContact O-N 3.21Å; F607-F610 PolarHBondContact O-N 2.88Å; F610-N649 HydrophobicContact CD2-CB 3.83Å; F610-N649 HydrophobicContact CE2-CB 3.68Å; F610-F650 HydrophobicContact CD1-CB 3.65Å; F610-F650 AromaticContact CD1-CD2 3.77Å; F610-F650 HydrophobicContact CD1-CD2 3.77Å; F610-F650 HydrophobicContact CD1-CG 4.21Å; F610-F650 HydrophobicContact CE1-CB 3.82Å; F610-F650 AromaticContact CE1-CD2 3.67Å; F610-F650 HydrophobicContact CE1-CD2 3.67Å; F610-F650 HydrophobicContact CE1-CG 4.23Å; F610-F650 HydrophobicContact CG-CB 4.05Å; F610-F650 HydrophobicContact CZ-CB 4.36Å; F610-F650 VanDerWaalsContact O-CB 3.3Å; F610-F650 WeakPolarHBondContact O-CB 3.46Å; F610-F650 PolarHBondContact O-N 3.25Å; F610-Y653 AromaticContact CE2-CD2 3.91Å; F610-Y653 HydrophobicContact CE2-CD2 3.91Å; F610-Y653 HydrophobicContact CE2-CE2 4.32Å; F610-Y653 AromaticContact CZ-CD2 3.85Å; F610-Y653 HydrophobicContact CZ-CD2 3.85Å
611	F	87.5	Confident	79.5	Confident	22 Å²	22	78.6 Å²	78.6	10%	0.096	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.2	171.2	-61.5	-45.6	0	0	0	114.6	F607 Q608 A609 Q636 W642 I644 H645 S648 F650	F607-F611 HydrophobicContact CB-CE2 4.45Å; F607-F611 WeakPolarHBondContact O-CD2 3.48Å; F607-F611 WeakPolarHBondContact O-CG 3.34Å; F607-F611 PolarHBondContact O-N 3.17Å; F607-F611 VanDerWaalsContact O-N 3.15Å; Q608-F611 PolarHBondContact O-N 2.97Å; A609-F611 VanDerWaalsContact C-N 3.3Å; A609-F611 PolarHBondContact O-N 3.31Å; F611-Q636 PolarHBondContact O-NE2 3.15Å; F611-W642 AromaticContact CE2-CE3 3.61Å; F611-W642 HydrophobicContact CE2-CE3 3.61Å; F611-W642 AromaticContact CE2-CZ3 3.75Å; F611-W642 HydrophobicContact CE2-CZ3 3.75Å; F611-W642 HydrophobicContact CZ-CE3 4.12Å; F611-W642 HydrophobicContact CZ-CZ3 4.15Å; F611-I644 HydrophobicContact CD1-CD1 4.37Å; F611-I644 HydrophobicContact CD1-CG1 3.78Å; F611-I644 HydrophobicContact CD1-CG2 4.4Å; F611-I644 HydrophobicContact CE1-CD1 4.22Å; F611-I644 HydrophobicContact CE1-CG1 4.07Å; F611-I644 HydrophobicContact CG-CG1 4.31Å; F611-H645 PolarHBondContact O-N 2.86Å; F611-S648 VanDerWaalsContact C-CB 3.47Å; F611-S648 WeakPolarHBondContact O-CB 3.49Å; F611-F650 HydrophobicContact CD1-CB 3.73Å; F611-F650 AromaticContact CD1-CD1 3.88Å; F611-F650 HydrophobicContact CD1-CD1 3.88Å; F611-F650 HydrophobicContact CD1-CD2 4.11Å; F611-F650 AromaticContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CE1-CB 4.14Å; F611-F650 AromaticContact CE1-CD1 3.8Å; F611-F650 HydrophobicContact CE1-CD1 3.8Å; F611-F650 AromaticContact CE1-CD2 3.6Å; F611-F650 HydrophobicContact CE1-CD2 3.6Å; F611-F650 HydrophobicContact CE1-CE1 4.14Å; F611-F650 AromaticContact CE1-CE2 3.95Å; F611-F650 HydrophobicContact CE1-CE2 3.95Å; F611-F650 AromaticContact CE1-CG 3.53Å; F611-F650 HydrophobicContact CE1-CG 3.53Å; F611-F650 HydrophobicContact CE1-CZ 4.21Å
612	Q	85.1	Confident	79.4	Confident	45 Å²	45	78.8 Å²	78.8	21%	0.21	38%	0.378	C	S	.	.	S	Bend	trans	-79.8	156	178	-79.4	172.9	47.9	0	0	112.3	Q608 A609 S614 K633 S648	Q608-Q612 WeakPolarHBondContact O-CG 3.13Å; Q608-Q612 PolarHBondContact O-N 3.42Å; Q608-Q612 PolarHBondContact O-NE2 2.92Å; A609-Q612 WeakPolarHBondContact O-CB 3.37Å; A609-Q612 PolarHBondContact O-N 2.97Å; A609-Q612 VanDerWaalsContact O-N 3.09Å; Q612-S614 PolarHBondContact O-N 2.87Å; Q612-K633 HydrophobicContact CB-CG 4.38Å; Q612-K633 HydrophobicContact CG-CG 4.5Å; Q612-S648 VanDerWaalsContact O-CA 3.24Å; Q612-S648 WeakPolarHBondContact O-CA 3.26Å; Q612-S648 WeakPolarHBondContact O-CB 3.46Å
613	P	84	Confident	79.4	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.006	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-60.9	130.1	172.1	25.3	-33.7	0	0	0	110.9	L629 E632 K633 Q636 C647	P613-L629 HydrophobicContact CB-CD1 3.66Å; P613-L629 HydrophobicContact CG-CD1 3.58Å; P613-E632 HydrophobicContact CG-CG 4.35Å; P613-K633 HydrophobicContact CG-CG 3.84Å; P613-K633 WeakPolarHBondContact O-CE 3.35Å; P613-Q636 VanDerWaalsContact CD-OE1 3.23Å; P613-C647 WeakPolarHBondContact CA-O 3.16Å; P613-C647 HydrophobicContact CB-CB 4.48Å
614	S	80.1	Confident	79.3	Confident	22 Å²	22	71.7 Å²	71.7	15%	0.154	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-78.6	154.1	-179.4	-166.8	0	0	0	0	111.9	Q612 N616 A619 C647 N649	Q612-S614 PolarHBondContact O-N 2.87Å; S614-N616 WeakPolarHBondContact CB-OD1 3.09Å; S614-N616 PolarHBondContact O-N 2.81Å; S614-N616 PolarHBondContact OG-OD1 3.02Å; S614-A619 WeakPolarHBondContact O-CB 3.49Å; S614-C647 PolarHBondContact N-O 3Å; S614-N649 VanDerWaalsContact CB-CG 3.47Å; S614-N649 VanDerWaalsContact CB-ND2 3.29Å; S614-N649 WeakPolarHBondContact CB-ND2 3.19Å; S614-N649 WeakPolarHBondContact CB-OD1 3.17Å; S614-N649 PolarHBondContact OG-ND2 2.85Å; S614-N649 PolarHBondContact OG-OD1 2.85Å
615	D	79.4	Confident	79.4	Confident	105 Å²	105	68.8 Å²	68.8	56%	0.561	36%	0.358	S	S	*	.			trans	-77	29.4	180	-59.3	-26.2	0	0	0	113	L629 K633	D615-L629 HydrophobicContact CB-CD2 4.43Å; D615-L629 WeakPolarHBondContact OD1-CD2 3.28Å; D615-K633 VanDerWaalsContact CG-NZ 3.29Å; D615-K633 WeakPolarHBondContact OD1-CE 3.22Å; D615-K633 IonicContact OD1-NZ 2.95Å; D615-K633 PolarHBondContact OD1-NZ 2.94Å; D615-K633 IonicContact OD2-NZ 3.38Å; D615-K633 PolarHBondContact OD2-NZ 3.16Å
616	N	76.3	Confident	79.6	Confident	78 Å²	78	70 Å²	70	42%	0.417	36%	0.361	S	S	.	.	S	Bend	trans	-72.3	155	-176.9	-59.5	-4.9	0	0	0	110.4	S614 L618 A619 M620 N649	S614-N616 WeakPolarHBondContact CB-OD1 3.09Å; S614-N616 PolarHBondContact O-N 2.81Å; S614-N616 PolarHBondContact OG-OD1 3.02Å; N616-L618 PolarHBondContact O-N 3.41Å; N616-A619 PolarHBondContact O-N 3.37Å; N616-M620 PolarHBondContact O-N 3.49Å; N616-M620 VanDerWaalsContact O-N 3.13Å; N616-N649 PolarHBondContact ND2-OD1 2.98Å
617	K	74.6	Confident	79.8	Confident	198 Å²	198	71.4 Å²	71.4	86%	0.861	37%	0.372	S	S	*	.	H	α-helix	trans	-49.9	-32.9	175	-68.5	-175.3	178.1	-178.5	0	113.3	M620 K621	K617-M620 PolarHBondContact O-N 2.9Å; K617-K621 PolarHBondContact O-N 2.65Å
618	L	66.9	Low	79.9	Confident	62 Å²	62	67.7 Å²	67.7	33%	0.325	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-48.5	174.4	176.7	62.7	0	0	0	113	N616 M620 K621 L622 F795	N616-L618 PolarHBondContact O-N 3.41Å; L618-M620 VanDerWaalsContact C-N 3.28Å; L618-M620 PolarHBondContact O-N 3.31Å; L618-K621 WeakPolarHBondContact O-CB 3.43Å; L618-K621 PolarHBondContact O-N 3.12Å; L618-K621 VanDerWaalsContact O-N 3.16Å; L618-L622 PolarHBondContact O-N 3.01Å; L618-F795 HydrophobicContact CD1-CD1 3.56Å; L618-F795 HydrophobicContact CD1-CE1 3.89Å; L618-F795 HydrophobicContact CD2-CD1 3.59Å; L618-F795 HydrophobicContact CD2-CD2 4.44Å; L618-F795 HydrophobicContact CD2-CE1 3.62Å; L618-F795 HydrophobicContact CD2-CE2 4.46Å; L618-F795 HydrophobicContact CD2-CG 4.02Å; L618-F795 HydrophobicContact CD2-CZ 4.07Å; L618-F795 HydrophobicContact CG-CD1 4.22Å; L618-F795 HydrophobicContact CG-CE1 4.32Å
619	A	73	Confident	80.1	Confident	2 Å²	2	64.1 Å²	64.1	2%	0.017	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-33.9	177.5	0	0	0	0	0	111.1	S614 N616 L622 F623 L629	S614-A619 WeakPolarHBondContact O-CB 3.49Å; N616-A619 PolarHBondContact O-N 3.37Å; A619-L622 PolarHBondContact O-N 2.6Å; A619-F623 HydrophobicContact CB-CD2 4.27Å; A619-F623 WeakPolarHBondContact O-CB 3.45Å; A619-F623 VanDerWaalsContact O-CD2 3.29Å; A619-F623 WeakPolarHBondContact O-CD2 3.26Å; A619-F623 PolarHBondContact O-N 2.91Å; A619-L629 HydrophobicContact CB-CD1 4.43Å; A619-L629 HydrophobicContact CB-CD2 4.11Å
620	M	72.8	Confident	80.2	Confident	47 Å²	47	65.7 Å²	65.7	23%	0.232	35%	0.345	C	S	.	.	H	α-helix	trans	-68.8	-32.5	172.1	-61.8	-76.5	73.3	0	0	113	N616 K617 L618 L622 G624 S625 K626 L629	N616-M620 PolarHBondContact O-N 3.49Å; N616-M620 VanDerWaalsContact O-N 3.13Å; K617-M620 PolarHBondContact O-N 2.9Å; L618-M620 VanDerWaalsContact C-N 3.28Å; L618-M620 PolarHBondContact O-N 3.31Å; M620-L622 VanDerWaalsContact C-N 3.32Å; M620-G624 WeakPolarHBondContact O-CA 3.07Å; M620-G624 PolarHBondContact O-N 2.96Å; M620-S625 VanDerWaalsContact CE-O 3.3Å; M620-S625 WeakPolarHBondContact CE-O 3.45Å; M620-K626 HydrophobicContact SD-CG 3.82Å; M620-L629 HydrophobicContact CE-CB 3.75Å; M620-L629 HydrophobicContact CE-CD2 3.59Å; M620-L629 HydrophobicContact CE-CG 4.33Å
621	K	74.1	Confident	80.2	Confident	130 Å²	130	68.5 Å²	68.5	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-65.5	-33.5	170.5	-169.9	-175	177.6	-168.7	0	112.3	K617 L618 N797	K617-K621 PolarHBondContact O-N 2.65Å; L618-K621 WeakPolarHBondContact O-CB 3.43Å; L618-K621 PolarHBondContact O-N 3.12Å; L618-K621 VanDerWaalsContact O-N 3.16Å; K621-N797 PolarHBondContact NZ-OD1 2.94Å
622	L	74	Confident	80.2	Confident	50 Å²	50	68 Å²	68	26%	0.262	36%	0.355	S	S	.	.	H	α-helix	trans	-83.3	-51.1	-179.1	-175.7	61.2	0	0	0	113.1	L618 A619 M620 A713 I716	L618-L622 PolarHBondContact O-N 3.01Å; A619-L622 PolarHBondContact O-N 2.6Å; M620-L622 VanDerWaalsContact C-N 3.32Å; L622-A713 HydrophobicContact CD1-CB 4.25Å; L622-A713 HydrophobicContact CG-CB 4.1Å; L622-A713 WeakPolarHBondContact O-CB 3.28Å; L622-I716 HydrophobicContact CD2-CD1 4.22Å
623	F	80.1	Confident	80.2	Confident	22 Å²	22	67.4 Å²	67.4	10%	0.096	35%	0.352	C	S	.	.	H	α-helix	trans	-91.4	-8.3	-175.8	-62.3	-73.3	0	0	0	113.9	A619 S625 A628 L629 E632 H645 A713 I716	A619-F623 HydrophobicContact CB-CD2 4.27Å; A619-F623 WeakPolarHBondContact O-CB 3.45Å; A619-F623 VanDerWaalsContact O-CD2 3.29Å; A619-F623 WeakPolarHBondContact O-CD2 3.26Å; A619-F623 PolarHBondContact O-N 2.91Å; F623-S625 PolarHBondContact O-N 3.47Å; F623-A628 HydrophobicContact CB-CB 4.14Å; F623-A628 WeakPolarHBondContact O-CB 3.46Å; F623-L629 HydrophobicContact CB-CB 4.43Å; F623-L629 HydrophobicContact CD2-CD1 3.93Å; F623-L629 HydrophobicContact CE2-CD1 4.17Å; F623-E632 HydrophobicContact CD1-CB 4.38Å; F623-E632 HydrophobicContact CE1-CB 3.97Å; F623-E632 HydrophobicContact CE1-CG 3.74Å; F623-E632 HydrophobicContact CZ-CB 4.25Å; F623-E632 HydrophobicContact CZ-CG 3.7Å; F623-H645 AromaticContact CZ-CE1 3.84Å; F623-H645 AromaticContact CZ-NE2 3.69Å; F623-A713 HydrophobicContact CD1-CB 3.65Å; F623-A713 HydrophobicContact CE1-CB 3.81Å; F623-A713 HydrophobicContact CG-CB 4.49Å; F623-I716 HydrophobicContact CE1-CD1 3.95Å; F623-I716 HydrophobicContact CZ-CD1 3.66Å
624	G	80.4	Confident	80.3	Confident	63 Å²	63	74.9 Å²	74.9	65%	0.649	38%	0.38	S	S	*	.			trans	72.6	-40.9	177.7	0	0	0	0	0	115.7	M620	M620-G624 WeakPolarHBondContact O-CA 3.07Å; M620-G624 PolarHBondContact O-N 2.96Å
625	S	84	Confident	80.6	Confident	56 Å²	56	76.7 Å²	76.7	39%	0.392	38%	0.383	S	S	.	.	S	Bend	trans	-138.5	152.9	-175.1	71.1	0	0	0	0	113.6	M620 F623 N627 A628 L629	M620-S625 VanDerWaalsContact CE-O 3.3Å; M620-S625 WeakPolarHBondContact CE-O 3.45Å; F623-S625 PolarHBondContact O-N 3.47Å; S625-N627 PolarHBondContact O-N 3Å; S625-A628 PolarHBondContact O-N 3.44Å; S625-A628 WeakPolarHBondContact OG-CB 3.27Å; S625-A628 PolarHBondContact OG-N 3.34Å; S625-A628 VanDerWaalsContact OG-N 3.14Å; S625-L629 PolarHBondContact O-N 3.49Å
626	K	84.7	Confident	80.9	Confident	156 Å²	156	72 Å²	72	68%	0.678	36%	0.358	S	S	*	.	H	α-helix	trans	-56.3	-36.2	172.7	-68.6	-173.1	178.2	-176.9	0	112.1	M620 L629 L630	M620-K626 HydrophobicContact SD-CG 3.82Å; K626-L629 PolarHBondContact O-N 3.25Å; K626-L630 WeakPolarHBondContact O-CB 3.37Å; K626-L630 VanDerWaalsContact O-CG 3.3Å; K626-L630 WeakPolarHBondContact O-CG 3.4Å; K626-L630 PolarHBondContact O-N 2.9Å
627	N	85.6	Confident	81.2	Confident	125 Å²	125	72.7 Å²	72.7	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-69.6	-36.2	179.6	-70.3	-8.5	0	0	0	112.6	S625 K631	S625-N627 PolarHBondContact O-N 3Å; N627-K631 WeakPolarHBondContact O-CB 3.41Å; N627-K631 PolarHBondContact O-N 3.42Å
628	A	85.2	Confident	81.5	Confident	32 Å²	32	70.8 Å²	70.8	26%	0.264	36%	0.359	S	S	.	.	H	α-helix	trans	-67.5	-41.4	171.4	0	0	0	0	0	111.6	F623 S625 L630 K631 E632	F623-A628 HydrophobicContact CB-CB 4.14Å; F623-A628 WeakPolarHBondContact O-CB 3.46Å; S625-A628 PolarHBondContact O-N 3.44Å; S625-A628 WeakPolarHBondContact OG-CB 3.27Å; S625-A628 PolarHBondContact OG-N 3.34Å; S625-A628 VanDerWaalsContact OG-N 3.14Å; A628-L630 PolarHBondContact O-N 3.18Å; A628-K631 WeakPolarHBondContact O-CB 3.37Å; A628-K631 PolarHBondContact O-N 3.26Å; A628-K631 VanDerWaalsContact O-N 3.14Å; A628-E632 PolarHBondContact O-N 2.9Å
629	L	84.9	Confident	81.9	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-63.7	-38.7	174.5	-179.9	53	0	0	0	112.5	P613 D615 A619 M620 F623 S625 K626 K631 E632 K633	P613-L629 HydrophobicContact CB-CD1 3.66Å; P613-L629 HydrophobicContact CG-CD1 3.58Å; D615-L629 HydrophobicContact CB-CD2 4.43Å; D615-L629 WeakPolarHBondContact OD1-CD2 3.28Å; A619-L629 HydrophobicContact CB-CD1 4.43Å; A619-L629 HydrophobicContact CB-CD2 4.11Å; M620-L629 HydrophobicContact CE-CB 3.75Å; M620-L629 HydrophobicContact CE-CD2 3.59Å; M620-L629 HydrophobicContact CE-CG 4.33Å; F623-L629 HydrophobicContact CB-CB 4.43Å; F623-L629 HydrophobicContact CD2-CD1 3.93Å; F623-L629 HydrophobicContact CE2-CD1 4.17Å; S625-L629 PolarHBondContact O-N 3.49Å; K626-L629 PolarHBondContact O-N 3.25Å; L629-K631 VanDerWaalsContact C-N 3.34Å; L629-E632 PolarHBondContact O-N 3.17Å; L629-K633 WeakPolarHBondContact O-CG 3.35Å; L629-K633 PolarHBondContact O-N 3.18Å
630	L	85.8	Confident	81.6	Confident	86 Å²	86	72.3 Å²	72.3	45%	0.45	37%	0.373	S	S	.	.	H	α-helix	trans	-70.4	-26	172.2	-72.2	168.1	0	0	0	113.4	K626 A628 K633 R634	K626-L630 WeakPolarHBondContact O-CB 3.37Å; K626-L630 VanDerWaalsContact O-CG 3.3Å; K626-L630 WeakPolarHBondContact O-CG 3.4Å; K626-L630 PolarHBondContact O-N 2.9Å; A628-L630 PolarHBondContact O-N 3.18Å; L630-K633 HydrophobicContact CD2-CD 4.47Å; L630-R634 WeakPolarHBondContact O-CG 3.39Å; L630-R634 PolarHBondContact O-N 3.37Å; L630-R634 PolarHBondContact O-NE 2.8Å
631	K	86.8	Confident	81.6	Confident	135 Å²	135	78.6 Å²	78.6	59%	0.587	40%	0.399	S	S	*	.	H	α-helix	trans	-69.7	-40.4	168	-176.3	-168.7	173.4	-161.2	0	110.2	N627 A628 L629 R634 R635	N627-K631 WeakPolarHBondContact O-CB 3.41Å; N627-K631 PolarHBondContact O-N 3.42Å; A628-K631 WeakPolarHBondContact O-CB 3.37Å; A628-K631 PolarHBondContact O-N 3.26Å; A628-K631 VanDerWaalsContact O-N 3.14Å; L629-K631 VanDerWaalsContact C-N 3.34Å; K631-R634 PolarHBondContact O-N 3.06Å; K631-R635 PolarHBondContact O-N 3.23Å
632	E	86.1	Confident	81.9	Confident	12 Å²	12	80.5 Å²	80.5	6%	0.056	40%	0.402	C	S	.	.	H	α-helix	trans	-69.3	-45.3	178.9	-175.7	60.3	-167.1	0	0	113.1	P613 F623 A628 L629 R634 R635 Q636 H645 L718	P613-E632 HydrophobicContact CG-CG 4.35Å; F623-E632 HydrophobicContact CD1-CB 4.38Å; F623-E632 HydrophobicContact CE1-CB 3.97Å; F623-E632 HydrophobicContact CE1-CG 3.74Å; F623-E632 HydrophobicContact CZ-CB 4.25Å; F623-E632 HydrophobicContact CZ-CG 3.7Å; A628-E632 PolarHBondContact O-N 2.9Å; L629-E632 PolarHBondContact O-N 3.17Å; E632-R634 PolarHBondContact O-N 2.66Å; E632-R635 WeakPolarHBondContact O-CB 3.37Å; E632-R635 PolarHBondContact O-N 3.3Å; E632-R635 IonicContact OE1-CZ 3.53Å; E632-R635 IonicContact OE1-NE 3.21Å; E632-R635 PolarHBondContact OE1-NE 2.92Å; E632-R635 IonicContact OE1-NH2 3.61Å; E632-R635 PolarHBondContact OE1-NH2 3.07Å; E632-R635 IonicContact OE2-CZ 3.07Å; E632-R635 IonicContact OE2-NE 2.84Å; E632-R635 PolarHBondContact OE2-NE 2.94Å; E632-R635 IonicContact OE2-NH2 2.75Å; E632-R635 PolarHBondContact OE2-NH2 2.87Å; E632-Q636 PolarHBondContact O-N 3.49Å; E632-H645 IonicContact OE1-CD2 3.09Å; E632-H645 PolarHBondContact OE1-CD2 3.25Å; E632-H645 IonicContact OE1-NE2 3.8Å; E632-H645 PolarHBondContact OE1-NE2 2.88Å; E632-L718 WeakPolarHBondContact OE1-CD1 3.27Å
633	K	86.5	Confident	82.6	Confident	33 Å²	33	78.4 Å²	78.4	14%	0.143	39%	0.392	C	S	.	.	H	α-helix	trans	-52.5	-42.1	172	-71.8	178.5	-177.6	177.5	0	111.2	Q612 P613 D615 L629 L630 V637	Q612-K633 HydrophobicContact CB-CG 4.38Å; Q612-K633 HydrophobicContact CG-CG 4.5Å; P613-K633 HydrophobicContact CG-CG 3.84Å; P613-K633 WeakPolarHBondContact O-CE 3.35Å; D615-K633 VanDerWaalsContact CG-NZ 3.29Å; D615-K633 WeakPolarHBondContact OD1-CE 3.22Å; D615-K633 IonicContact OD1-NZ 2.95Å; D615-K633 PolarHBondContact OD1-NZ 2.94Å; D615-K633 IonicContact OD2-NZ 3.38Å; D615-K633 PolarHBondContact OD2-NZ 3.16Å; L629-K633 WeakPolarHBondContact O-CG 3.35Å; L629-K633 PolarHBondContact O-N 3.18Å; L630-K633 HydrophobicContact CD2-CD 4.47Å; K633-V637 WeakPolarHBondContact O-CG2 3.3Å; K633-V637 PolarHBondContact O-N 3.43Å
634	R	85.6	Confident	83	Confident	158 Å²	158	77.8 Å²	77.8	60%	0.596	39%	0.39	S	S	*	.	H	α-helix	trans	-67.2	-42.3	174	-74.5	-179.4	-71.8	171	-2.9	113	L630 K631 E632 Q636 V637 Q638	L630-R634 WeakPolarHBondContact O-CG 3.39Å; L630-R634 PolarHBondContact O-N 3.37Å; L630-R634 PolarHBondContact O-NE 2.8Å; K631-R634 PolarHBondContact O-N 3.06Å; E632-R634 PolarHBondContact O-N 2.66Å; R634-Q636 VanDerWaalsContact C-N 3.31Å; R634-Q636 PolarHBondContact O-N 3.13Å; R634-V637 PolarHBondContact O-N 2.86Å; R634-Q638 VanDerWaalsContact O-CG 3.31Å; R634-Q638 WeakPolarHBondContact O-CG 3.37Å; R634-Q638 PolarHBondContact O-N 2.97Å
635	R	86.5	Confident	83.4	Confident	59 Å²	59	74.8 Å²	74.8	22%	0.223	36%	0.359	C	S	.	.	H	α-helix	trans	-59.6	-40.6	176.8	-167.6	176.6	71.4	115	9.1	111.8	K631 E632 Q638 Q639 I716 L718	K631-R635 PolarHBondContact O-N 3.23Å; E632-R635 WeakPolarHBondContact O-CB 3.37Å; E632-R635 PolarHBondContact O-N 3.3Å; E632-R635 IonicContact OE1-CZ 3.53Å; E632-R635 IonicContact OE1-NE 3.21Å; E632-R635 PolarHBondContact OE1-NE 2.92Å; E632-R635 IonicContact OE1-NH2 3.61Å; E632-R635 PolarHBondContact OE1-NH2 3.07Å; E632-R635 IonicContact OE2-CZ 3.07Å; E632-R635 IonicContact OE2-NE 2.84Å; E632-R635 PolarHBondContact OE2-NE 2.94Å; E632-R635 IonicContact OE2-NH2 2.75Å; E632-R635 PolarHBondContact OE2-NH2 2.87Å; R635-Q638 PolarHBondContact O-N 3.01Å; R635-Q639 PolarHBondContact O-N 2.63Å; R635-Q639 VanDerWaalsContact O-N 3.12Å; R635-I716 VanDerWaalsContact CZ-O 3.31Å; R635-I716 PolarHBondContact NH1-O 3.49Å; R635-I716 PolarHBondContact NH2-O 2.96Å; R635-L718 HydrophobicContact CG-CD1 4.43Å
636	Q	84.8	Confident	83.4	Confident	8 Å²	8	73 Å²	73	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-48.6	175	-176	-175.2	-0.4	0	0	112.6	F611 P613 E632 R634 Q638 Q639 V643 L718	F611-Q636 PolarHBondContact O-NE2 3.15Å; P613-Q636 VanDerWaalsContact CD-OE1 3.23Å; E632-Q636 PolarHBondContact O-N 3.49Å; R634-Q636 VanDerWaalsContact C-N 3.31Å; R634-Q636 PolarHBondContact O-N 3.13Å; Q636-Q638 PolarHBondContact O-N 2.81Å; Q636-Q639 PolarHBondContact O-N 2.83Å; Q636-V643 PolarHBondContact NE2-O 3.1Å; Q636-L718 HydrophobicContact CB-CD1 4.11Å
637	V	82.5	Confident	83.3	Confident	91 Å²	91	66.8 Å²	66.8	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-59.5	-35	177.6	171.6	0	0	0	0	111.5	K633 R634	K633-V637 WeakPolarHBondContact O-CG2 3.3Å; K633-V637 PolarHBondContact O-N 3.43Å; R634-V637 PolarHBondContact O-N 2.86Å
638	Q	82.2	Confident	83.3	Confident	159 Å²	159	60.9 Å²	60.9	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-70.3	-38.5	176.7	-73.3	171.1	-16.2	0	0	114.1	R634 R635 Q636 G640	R634-Q638 VanDerWaalsContact O-CG 3.31Å; R634-Q638 WeakPolarHBondContact O-CG 3.37Å; R634-Q638 PolarHBondContact O-N 2.97Å; R635-Q638 PolarHBondContact O-N 3.01Å; Q636-Q638 PolarHBondContact O-N 2.81Å; Q638-G640 VanDerWaalsContact C-N 3.32Å; Q638-G640 PolarHBondContact O-N 2.87Å
639	Q	75.4	Confident	83.3	Confident	64 Å²	64	61.5 Å²	61.5	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-78.6	-11.1	-175.4	-70.2	-158.1	8.7	0	0	115	R635 Q636 L718 N719	R635-Q639 PolarHBondContact O-N 2.63Å; R635-Q639 VanDerWaalsContact O-N 3.12Å; Q636-Q639 PolarHBondContact O-N 2.83Å; Q639-L718 HydrophobicContact CB-CB 4.45Å; Q639-N719 PolarHBondContact OE1-OD1 3.33Å
640	G	66.7	Low	83.6	Confident	32 Å²	32	63.2 Å²	63.2	33%	0.33	30%	0.296	S	S	.	.			trans	142.3	161.9	159.9	0	0	0	0	0	115.6	Q638 W642	Q638-G640 VanDerWaalsContact C-N 3.32Å; Q638-G640 PolarHBondContact O-N 2.87Å; G640-W642 PolarHBondContact O-N 2.91Å
641	K	71.2	Confident	83.7	Confident	178 Å²	178	59.9 Å²	59.9	77%	0.774	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	133	175.7	-62.1	169	-176	169.2	0	109.4
642	W	80.6	Confident	83.6	Confident	170 Å²	170	57.4 Å²	57.4	64%	0.644	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	40.8	179.3	-46	93.6	0	0	0	116	F611 G640	F611-W642 AromaticContact CE2-CE3 3.61Å; F611-W642 HydrophobicContact CE2-CE3 3.61Å; F611-W642 AromaticContact CE2-CZ3 3.75Å; F611-W642 HydrophobicContact CE2-CZ3 3.75Å; F611-W642 HydrophobicContact CZ-CE3 4.12Å; F611-W642 HydrophobicContact CZ-CZ3 4.15Å; G640-W642 PolarHBondContact O-N 2.91Å
643	V	88.2	Confident	83.7	Confident	6 Å²	6	63.2 Å²	63.2	4%	0.036	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-97.8	133.1	159.6	-177	0	0	0	0	109.3	Q636 L718 P720	Q636-V643 PolarHBondContact NE2-O 3.1Å; V643-L718 HydrophobicContact CG1-CB 4.4Å; V643-L718 HydrophobicContact CG1-CD2 3.96Å; V643-P720 HydrophobicContact CG2-CG 3.82Å
644	I	90.5	Very high	84	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.051	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-101.3	120.4	-177.7	-58	170	0	0	0	108.4	F611 F650 R651 V701 R704 T705 G706	F611-I644 HydrophobicContact CD1-CD1 4.37Å; F611-I644 HydrophobicContact CD1-CG1 3.78Å; F611-I644 HydrophobicContact CD1-CG2 4.4Å; F611-I644 HydrophobicContact CE1-CD1 4.22Å; F611-I644 HydrophobicContact CE1-CG1 4.07Å; F611-I644 HydrophobicContact CG-CG1 4.31Å; I644-F650 HydrophobicContact CD1-CD1 4.09Å; I644-F650 HydrophobicContact CD1-CE1 3.8Å; I644-F650 HydrophobicContact CG2-CD1 3.92Å; I644-R651 HydrophobicContact CG2-CB 4.19Å; I644-V701 HydrophobicContact CD1-CG1 3.99Å; I644-R704 HydrophobicContact CD1-CB 4.25Å; I644-R704 HydrophobicContact CG1-CB 4.44Å; I644-R704 PolarHBondContact N-O 3.39Å; I644-T705 WeakPolarHBondContact O-CA 3.41Å; I644-G706 PolarHBondContact O-N 3.48Å
645	H	88.3	Confident	84	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-74.6	138.6	176.7	-173.3	-81.5	0	0	0	110.4	F611 F623 E632 C647 S648	F611-H645 PolarHBondContact O-N 2.86Å; F623-H645 AromaticContact CZ-CE1 3.84Å; F623-H645 AromaticContact CZ-NE2 3.69Å; E632-H645 IonicContact OE1-CD2 3.09Å; E632-H645 PolarHBondContact OE1-CD2 3.25Å; E632-H645 IonicContact OE1-NE2 3.8Å; E632-H645 PolarHBondContact OE1-NE2 2.88Å; H645-C647 VanDerWaalsContact C-N 3.31Å; H645-C647 PolarHBondContact ND1-N 3.46Å; H645-C647 PolarHBondContact O-N 2.94Å; H645-S648 WeakPolarHBondContact O-CB 3.46Å; H645-S648 PolarHBondContact O-N 2.71Å; H645-S648 PolarHBondContact O-OG 2.89Å
646	P	84.4	Confident	84.1	Confident	19 Å²	19	56.7 Å²	56.7	12%	0.123	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-38.2	-177.8	20	-32	0	0	0	113.2	S648 R651 V708 I716	P646-S648 VanDerWaalsContact C-N 3.27Å; P646-S648 PolarHBondContact O-N 3.13Å; P646-R651 WeakPolarHBondContact O-CG 3.47Å; P646-V708 HydrophobicContact CB-CG2 4.36Å; P646-V708 HydrophobicContact CG-CG2 3.97Å; P646-I716 HydrophobicContact CG-CG2 4.1Å
647	C	80.6	Confident	84.3	Confident	25 Å²	25	60.9 Å²	60.9	17%	0.169	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	24.2	175.9	-44.8	0	0	0	0	114.5	P613 S614 H645	P613-C647 WeakPolarHBondContact CA-O 3.16Å; P613-C647 HydrophobicContact CB-CB 4.48Å; S614-C647 PolarHBondContact N-O 3Å; H645-C647 VanDerWaalsContact C-N 3.31Å; H645-C647 PolarHBondContact ND1-N 3.46Å; H645-C647 PolarHBondContact O-N 2.94Å
648	S	86.2	Confident	84.7	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.007	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-83.9	154.1	178.3	63.3	0	0	0	0	112.8	F611 Q612 H645 P646 F650 R651 F652	F611-S648 VanDerWaalsContact C-CB 3.47Å; F611-S648 WeakPolarHBondContact O-CB 3.49Å; Q612-S648 VanDerWaalsContact O-CA 3.24Å; Q612-S648 WeakPolarHBondContact O-CA 3.26Å; Q612-S648 WeakPolarHBondContact O-CB 3.46Å; H645-S648 WeakPolarHBondContact O-CB 3.46Å; H645-S648 PolarHBondContact O-N 2.71Å; H645-S648 PolarHBondContact O-OG 2.89Å; P646-S648 VanDerWaalsContact C-N 3.27Å; P646-S648 PolarHBondContact O-N 3.13Å; S648-F650 VanDerWaalsContact C-N 3.32Å; S648-F650 PolarHBondContact O-N 2.91Å; S648-R651 PolarHBondContact O-N 2.82Å; S648-R651 VanDerWaalsContact OG-CB 3.28Å; S648-R651 WeakPolarHBondContact OG-CB 3.49Å; S648-R651 PolarHBondContact OG-N 3.44Å; S648-F652 PolarHBondContact O-N 3.34Å
649	N	86.2	Confident	84.9	Confident	45 Å²	45	50.4 Å²	50.4	24%	0.241	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-37	175.5	-71.2	-27.4	0	0	0	111.1	F610 S614 N616 R651 F652 Y653	F610-N649 HydrophobicContact CD2-CB 3.83Å; F610-N649 HydrophobicContact CE2-CB 3.68Å; S614-N649 VanDerWaalsContact CB-CG 3.47Å; S614-N649 VanDerWaalsContact CB-ND2 3.29Å; S614-N649 WeakPolarHBondContact CB-ND2 3.19Å; S614-N649 WeakPolarHBondContact CB-OD1 3.17Å; S614-N649 PolarHBondContact OG-ND2 2.85Å; S614-N649 PolarHBondContact OG-OD1 2.85Å; N616-N649 PolarHBondContact ND2-OD1 2.98Å; N649-R651 VanDerWaalsContact C-N 3.34Å; N649-R651 PolarHBondContact O-N 2.92Å; N649-F652 PolarHBondContact O-N 2.92Å; N649-Y653 HydrophobicContact CB-CD2 4.41Å; N649-Y653 HydrophobicContact CB-CE2 4.33Å; N649-Y653 WeakPolarHBondContact O-CD2 3.27Å; N649-Y653 PolarHBondContact O-N 2.96Å
650	F	90.4	Very high	85.5	Confident	36 Å²	36	53.2 Å²	53.2	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-53.5	-51.2	170.2	176.6	-89.3	0	0	0	111.3	F610 F611 I644 S648 F652 Y653 W654 V701	F610-F650 HydrophobicContact CD1-CB 3.65Å; F610-F650 AromaticContact CD1-CD2 3.77Å; F610-F650 HydrophobicContact CD1-CD2 3.77Å; F610-F650 HydrophobicContact CD1-CG 4.21Å; F610-F650 HydrophobicContact CE1-CB 3.82Å; F610-F650 AromaticContact CE1-CD2 3.67Å; F610-F650 HydrophobicContact CE1-CD2 3.67Å; F610-F650 HydrophobicContact CE1-CG 4.23Å; F610-F650 HydrophobicContact CG-CB 4.05Å; F610-F650 HydrophobicContact CZ-CB 4.36Å; F610-F650 VanDerWaalsContact O-CB 3.3Å; F610-F650 WeakPolarHBondContact O-CB 3.46Å; F610-F650 PolarHBondContact O-N 3.25Å; F611-F650 HydrophobicContact CD1-CB 3.73Å; F611-F650 AromaticContact CD1-CD1 3.88Å; F611-F650 HydrophobicContact CD1-CD1 3.88Å; F611-F650 HydrophobicContact CD1-CD2 4.11Å; F611-F650 AromaticContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CE1-CB 4.14Å; F611-F650 AromaticContact CE1-CD1 3.8Å; F611-F650 HydrophobicContact CE1-CD1 3.8Å; F611-F650 AromaticContact CE1-CD2 3.6Å; F611-F650 HydrophobicContact CE1-CD2 3.6Å; F611-F650 HydrophobicContact CE1-CE1 4.14Å; F611-F650 AromaticContact CE1-CE2 3.95Å; F611-F650 HydrophobicContact CE1-CE2 3.95Å; F611-F650 AromaticContact CE1-CG 3.53Å; F611-F650 HydrophobicContact CE1-CG 3.53Å; F611-F650 HydrophobicContact CE1-CZ 4.21Å; I644-F650 HydrophobicContact CD1-CD1 4.09Å; I644-F650 HydrophobicContact CD1-CE1 3.8Å; I644-F650 HydrophobicContact CG2-CD1 3.92Å; S648-F650 VanDerWaalsContact C-N 3.32Å; S648-F650 PolarHBondContact O-N 2.91Å; F650-F652 VanDerWaalsContact C-N 3.33Å; F650-F652 PolarHBondContact O-N 3.43Å; F650-Y653 PolarHBondContact O-N 3.32Å; F650-W654 HydrophobicContact CD1-CB 4.43Å; F650-W654 HydrophobicContact CE1-CB 4.04Å; F650-W654 HydrophobicContact CE1-CD2 4.36Å; F650-W654 HydrophobicContact CE1-CE3 4.45Å; F650-W654 HydrophobicContact CE1-CG 4.18Å; F650-W654 HydrophobicContact CE2-CE3 4.31Å; F650-W654 HydrophobicContact CZ-CB 4.31Å; F650-W654 HydrophobicContact CZ-CD2 4.07Å; F650-W654 AromaticContact CZ-CE3 3.72Å; F650-W654 HydrophobicContact CZ-CE3 3.72Å; F650-W654 HydrophobicContact CZ-CG 4.32Å; F650-W654 HydrophobicContact CZ-CZ3 4.45Å; F650-W654 WeakPolarHBondContact O-CB 3.23Å; F650-W654 PolarHBondContact O-N 3.01Å; F650-V701 HydrophobicContact CE1-CG1 4.12Å; F650-V701 HydrophobicContact CE1-CG2 4.5Å
651	R	88.1	Confident	86.6	Confident	17 Å²	17	53.2 Å²	53.2	6%	0.064	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-40.2	-177.1	-176	66.4	-162.6	-177.8	20.1	111.8	I644 P646 S648 N649 D655 T705	I644-R651 HydrophobicContact CG2-CB 4.19Å; P646-R651 WeakPolarHBondContact O-CG 3.47Å; S648-R651 PolarHBondContact O-N 2.82Å; S648-R651 VanDerWaalsContact OG-CB 3.28Å; S648-R651 WeakPolarHBondContact OG-CB 3.49Å; S648-R651 PolarHBondContact OG-N 3.44Å; N649-R651 VanDerWaalsContact C-N 3.34Å; N649-R651 PolarHBondContact O-N 2.92Å; R651-D655 IonicContact CZ-OD1 2.73Å; R651-D655 IonicContact CZ-OD2 3.04Å; R651-D655 VanDerWaalsContact NE-CG 3.34Å; R651-D655 IonicContact NE-OD1 3.81Å; R651-D655 PolarHBondContact NE-OD1 3.49Å; R651-D655 IonicContact NE-OD2 2.66Å; R651-D655 PolarHBondContact NE-OD2 3.4Å; R651-D655 IonicContact NH1-OD1 2.6Å; R651-D655 IonicContact NH2-OD1 2.84Å; R651-D655 PolarHBondContact NH2-OD1 3.42Å; R651-D655 IonicContact NH2-OD2 3.12Å; R651-D655 PolarHBondContact NH2-OD2 3.48Å; R651-D655 WeakPolarHBondContact O-CB 3.19Å; R651-D655 PolarHBondContact O-N 3.13Å; R651-T705 HydrophobicContact CG-CG2 4.38Å; R651-T705 PolarHBondContact NH1-OG1 3.06Å
652	F	84.5	Confident	87.5	Confident	82 Å²	82	44.8 Å²	44.8	36%	0.36	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-51.2	176.6	178.6	-97.1	0	0	0	112.7	S648 N649 F650 D655 L656 W792	S648-F652 PolarHBondContact O-N 3.34Å; N649-F652 PolarHBondContact O-N 2.92Å; F650-F652 VanDerWaalsContact C-N 3.33Å; F650-F652 PolarHBondContact O-N 3.43Å; F652-D655 PolarHBondContact O-N 2.89Å; F652-L656 PolarHBondContact O-N 3.3Å; F652-W792 HydrophobicContact CD2-CH2 4.13Å; F652-W792 HydrophobicContact CD2-CZ2 4.11Å; F652-W792 HydrophobicContact CE1-CH2 4.33Å; F652-W792 AromaticContact CE2-CH2 3.28Å; F652-W792 HydrophobicContact CE2-CH2 3.28Å; F652-W792 AromaticContact CE2-CZ2 3.7Å; F652-W792 HydrophobicContact CE2-CZ2 3.7Å; F652-W792 AromaticContact CE2-CZ3 3.81Å; F652-W792 HydrophobicContact CE2-CZ3 3.81Å; F652-W792 AromaticContact CZ-CH2 3.4Å; F652-W792 HydrophobicContact CZ-CH2 3.4Å; F652-W792 VanDerWaalsContact CZ-CH2 3.4Å; F652-W792 HydrophobicContact CZ-CZ2 4.16Å; F652-W792 HydrophobicContact CZ-CZ3 4Å
653	Y	89.3	Confident	87.8	Confident	134 Å²	134	40 Å²	40	53%	0.525	19%	0.194	S	C	.	.	H	α-helix	trans	-70.5	-33.5	179.2	-70.8	-64.2	0	0	0	112.7	F610 N649 F650 L656 L657	F610-Y653 AromaticContact CE2-CD2 3.91Å; F610-Y653 HydrophobicContact CE2-CD2 3.91Å; F610-Y653 HydrophobicContact CE2-CE2 4.32Å; F610-Y653 AromaticContact CZ-CD2 3.85Å; F610-Y653 HydrophobicContact CZ-CD2 3.85Å; N649-Y653 HydrophobicContact CB-CD2 4.41Å; N649-Y653 HydrophobicContact CB-CE2 4.33Å; N649-Y653 WeakPolarHBondContact O-CD2 3.27Å; N649-Y653 PolarHBondContact O-N 2.96Å; F650-Y653 PolarHBondContact O-N 3.32Å; Y653-L656 PolarHBondContact O-N 3.17Å; Y653-L657 WeakPolarHBondContact O-CB 3.24Å; Y653-L657 PolarHBondContact O-N 2.93Å
654	W	91.1	Very high	87.9	Confident	44 Å²	44	41.4 Å²	41.4	17%	0.167	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-48.7	172	-174.9	-91.7	0	0	0	110.9	F650 L656 L657 M658 A697 D698 V701	F650-W654 HydrophobicContact CD1-CB 4.43Å; F650-W654 HydrophobicContact CE1-CB 4.04Å; F650-W654 HydrophobicContact CE1-CD2 4.36Å; F650-W654 HydrophobicContact CE1-CE3 4.45Å; F650-W654 HydrophobicContact CE1-CG 4.18Å; F650-W654 HydrophobicContact CE2-CE3 4.31Å; F650-W654 HydrophobicContact CZ-CB 4.31Å; F650-W654 HydrophobicContact CZ-CD2 4.07Å; F650-W654 AromaticContact CZ-CE3 3.72Å; F650-W654 HydrophobicContact CZ-CE3 3.72Å; F650-W654 HydrophobicContact CZ-CG 4.32Å; F650-W654 HydrophobicContact CZ-CZ3 4.45Å; F650-W654 WeakPolarHBondContact O-CB 3.23Å; F650-W654 PolarHBondContact O-N 3.01Å; W654-L656 VanDerWaalsContact C-N 3.31Å; W654-L656 PolarHBondContact O-N 3.02Å; W654-L657 WeakPolarHBondContact O-CB 3.4Å; W654-L657 PolarHBondContact O-N 2.81Å; W654-L657 VanDerWaalsContact O-N 3.16Å; W654-M658 HydrophobicContact CG-CG 4.45Å; W654-M658 HydrophobicContact CZ2-SD 3.97Å; W654-M658 VanDerWaalsContact O-CG 3.3Å; W654-M658 WeakPolarHBondContact O-CG 3.28Å; W654-M658 PolarHBondContact O-N 2.98Å; W654-A697 HydrophobicContact CH2-CB 4.02Å; W654-A697 HydrophobicContact CZ2-CB 4.16Å; W654-D698 HydrophobicContact CZ2-CB 4.49Å; W654-V701 HydrophobicContact CD2-CG2 4.46Å; W654-V701 HydrophobicContact CZ2-CG2 4.04Å
655	D	86.8	Confident	87.8	Confident	4 Å²	4	41 Å²	41	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-68.6	-29.8	-179.6	-73.1	-10.8	0	0	0	112.8	R651 F652 L659 Y788	R651-D655 IonicContact CZ-OD1 2.73Å; R651-D655 IonicContact CZ-OD2 3.04Å; R651-D655 VanDerWaalsContact NE-CG 3.34Å; R651-D655 IonicContact NE-OD1 3.81Å; R651-D655 PolarHBondContact NE-OD1 3.49Å; R651-D655 IonicContact NE-OD2 2.66Å; R651-D655 PolarHBondContact NE-OD2 3.4Å; R651-D655 IonicContact NH1-OD1 2.6Å; R651-D655 IonicContact NH2-OD1 2.84Å; R651-D655 PolarHBondContact NH2-OD1 3.42Å; R651-D655 IonicContact NH2-OD2 3.12Å; R651-D655 PolarHBondContact NH2-OD2 3.48Å; R651-D655 WeakPolarHBondContact O-CB 3.19Å; R651-D655 PolarHBondContact O-N 3.13Å; F652-D655 PolarHBondContact O-N 2.89Å; D655-L659 WeakPolarHBondContact O-CB 3.33Å; D655-L659 PolarHBondContact O-N 3.28Å; D655-Y788 HydrophobicContact CB-CD1 4.25Å; D655-Y788 HydrophobicContact CB-CE1 4.01Å; D655-Y788 VanDerWaalsContact CG-CE1 3.44Å; D655-Y788 WeakPolarHBondContact OD1-CE1 3.15Å; D655-Y788 PolarHBondContact OD1-OH 2.79Å
656	L	87.1	Confident	87.8	Confident	65 Å²	65	41 Å²	41	34%	0.34	20%	0.203	S	C	.	.	H	α-helix	trans	-65.5	-44.6	169.2	-177.7	61.7	0	0	0	112.1	F652 Y653 W654 L659 M660 W792	F652-L656 PolarHBondContact O-N 3.3Å; Y653-L656 PolarHBondContact O-N 3.17Å; W654-L656 VanDerWaalsContact C-N 3.31Å; W654-L656 PolarHBondContact O-N 3.02Å; L656-L659 PolarHBondContact O-N 3Å; L656-M660 WeakPolarHBondContact O-CG 3.48Å; L656-M660 PolarHBondContact O-N 3.17Å; L656-W792 HydrophobicContact CB-CZ2 4.3Å; L656-W792 HydrophobicContact CD1-CH2 4.23Å; L656-W792 HydrophobicContact CD1-CZ2 4.42Å
657	L	91	Very high	88.1	Confident	96 Å²	96	44 Å²	44	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-45.3	174.8	176.8	63.7	0	0	0	111.3	Y653 W654 L659 M660 L661	Y653-L657 WeakPolarHBondContact O-CB 3.24Å; Y653-L657 PolarHBondContact O-N 2.93Å; W654-L657 WeakPolarHBondContact O-CB 3.4Å; W654-L657 PolarHBondContact O-N 2.81Å; W654-L657 VanDerWaalsContact O-N 3.16Å; L657-L659 VanDerWaalsContact C-N 3.32Å; L657-L659 PolarHBondContact O-N 3.36Å; L657-M660 PolarHBondContact O-N 2.94Å; L657-L661 WeakPolarHBondContact O-CB 3.48Å; L657-L661 PolarHBondContact O-N 3.05Å
658	M	89	Confident	88.5	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-39.9	176	-67.8	-48.7	-54.2	0	0	111.7	W654 L662 V694 F695 D698 Y788	W654-M658 HydrophobicContact CG-CG 4.45Å; W654-M658 HydrophobicContact CZ2-SD 3.97Å; W654-M658 VanDerWaalsContact O-CG 3.3Å; W654-M658 WeakPolarHBondContact O-CG 3.28Å; W654-M658 PolarHBondContact O-N 2.98Å; M658-L662 WeakPolarHBondContact O-CB 3.5Å; M658-L662 PolarHBondContact O-N 2.96Å; M658-V694 HydrophobicContact CE-CG1 4.18Å; M658-V694 HydrophobicContact SD-CG1 3.6Å; M658-F695 HydrophobicContact CE-CD1 3.3Å; M658-F695 HydrophobicContact CE-CE1 3.35Å; M658-F695 HydrophobicContact CE-CG 4.14Å; M658-F695 HydrophobicContact CE-CZ 4.22Å; M658-D698 HydrophobicContact CE-CB 3.72Å; M658-D698 HydrophobicContact SD-CB 4Å; M658-Y788 HydrophobicContact CB-CE2 4.11Å
659	L	86.9	Confident	88.5	Confident	29 Å²	29	46.3 Å²	46.3	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-48.9	176.8	178.9	62	0	0	0	111.6	D655 L656 L657 L662 I663 L785	D655-L659 WeakPolarHBondContact O-CB 3.33Å; D655-L659 PolarHBondContact O-N 3.28Å; L656-L659 PolarHBondContact O-N 3Å; L657-L659 VanDerWaalsContact C-N 3.32Å; L657-L659 PolarHBondContact O-N 3.36Å; L659-L662 PolarHBondContact O-N 3.09Å; L659-I663 HydrophobicContact CD1-CD1 3.86Å; L659-I663 HydrophobicContact CD1-CG1 4.29Å; L659-I663 HydrophobicContact CG-CD1 3.96Å; L659-I663 WeakPolarHBondContact O-CG1 3.18Å; L659-I663 PolarHBondContact O-N 3Å; L659-L785 HydrophobicContact CD1-CD1 3.38Å
660	M	88.9	Confident	88.7	Confident	123 Å²	123	44.3 Å²	44.3	61%	0.606	22%	0.217	S	C	*	.	H	α-helix	trans	-63.3	-47.4	179.1	-69.1	-64.3	-72.3	0	0	112	L656 L657 L662 I663 A664	L656-M660 WeakPolarHBondContact O-CG 3.48Å; L656-M660 PolarHBondContact O-N 3.17Å; L657-M660 PolarHBondContact O-N 2.94Å; M660-L662 VanDerWaalsContact C-N 3.29Å; M660-L662 PolarHBondContact O-N 3.26Å; M660-I663 PolarHBondContact O-N 3.36Å; M660-A664 PolarHBondContact O-N 3.47Å; M660-A664 VanDerWaalsContact O-N 3.08Å
661	L	90	Very high	88.7	Confident	33 Å²	33	43.4 Å²	43.4	17%	0.173	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-41.9	175.9	179.5	65.9	0	0	0	111.3	L657 A664 N665 V694 F695	L657-L661 WeakPolarHBondContact O-CB 3.48Å; L657-L661 PolarHBondContact O-N 3.05Å; L661-A664 PolarHBondContact O-N 2.84Å; L661-N665 PolarHBondContact O-N 3.04Å; L661-N665 PolarHBondContact O-ND2 2.98Å; L661-V694 HydrophobicContact CD2-CB 3.74Å; L661-V694 HydrophobicContact CD2-CG1 3.53Å; L661-F695 HydrophobicContact CD2-CD2 4.24Å; L661-F695 HydrophobicContact CD2-CE2 3.75Å; L661-F695 HydrophobicContact CD2-CZ 3.98Å; L661-F695 HydrophobicContact CG-CE2 3.86Å; L661-F695 HydrophobicContact CG-CZ 3.95Å
662	L	88.6	Confident	88.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-47.2	179.9	-172.6	161.1	0	0	0	111.6	M658 L659 M660 A664 N665 L666 F695 R781 R784 L785	M658-L662 WeakPolarHBondContact O-CB 3.5Å; M658-L662 PolarHBondContact O-N 2.96Å; L659-L662 PolarHBondContact O-N 3.09Å; M660-L662 VanDerWaalsContact C-N 3.29Å; M660-L662 PolarHBondContact O-N 3.26Å; L662-A664 VanDerWaalsContact C-N 3.3Å; L662-A664 PolarHBondContact O-N 3.16Å; L662-N665 PolarHBondContact O-N 3.04Å; L662-L666 HydrophobicContact CD2-CD1 3.63Å; L662-L666 HydrophobicContact CD2-CD2 3.65Å; L662-L666 HydrophobicContact CD2-CG 4.15Å; L662-L666 HydrophobicContact CG-CD1 3.92Å; L662-L666 WeakPolarHBondContact O-CB 3.2Å; L662-L666 WeakPolarHBondContact O-CD1 3.09Å; L662-L666 PolarHBondContact O-N 3.16Å; L662-F695 HydrophobicContact CB-CE1 4.25Å; L662-F695 HydrophobicContact CB-CZ 4.01Å; L662-F695 HydrophobicContact CD1-CE1 4.44Å; L662-F695 HydrophobicContact CG-CZ 4.47Å; L662-R781 HydrophobicContact CD1-CB 4.41Å; L662-R781 WeakPolarHBondContact CD1-O 3.47Å; L662-R781 HydrophobicContact CG-CB 4.43Å; L662-R784 HydrophobicContact CD1-CB 3.73Å; L662-L785 HydrophobicContact CD1-CB 4.36Å; L662-L785 HydrophobicContact CD2-CB 3.66Å; L662-L785 HydrophobicContact CD2-CD1 4.14Å; L662-L785 HydrophobicContact CD2-CD2 4.15Å; L662-L785 HydrophobicContact CD2-CG 4.19Å
663	I	87.9	Confident	88.7	Confident	71 Å²	71	39.1 Å²	39.1	36%	0.364	20%	0.197	S	C	.	.	H	α-helix	trans	-57.6	-45.5	176.9	-69.9	166	0	0	0	110.3	L659 M660 N665 L666 I667 L785	L659-I663 HydrophobicContact CD1-CD1 3.86Å; L659-I663 HydrophobicContact CD1-CG1 4.29Å; L659-I663 HydrophobicContact CG-CD1 3.96Å; L659-I663 WeakPolarHBondContact O-CG1 3.18Å; L659-I663 PolarHBondContact O-N 3Å; M660-I663 PolarHBondContact O-N 3.36Å; I663-N665 PolarHBondContact O-N 3.23Å; I663-L666 PolarHBondContact O-N 3.35Å; I663-I667 HydrophobicContact CG2-CD1 3.94Å; I663-I667 WeakPolarHBondContact O-CG1 3.47Å; I663-I667 PolarHBondContact O-N 3.42Å; I663-L785 HydrophobicContact CG1-CD1 4.43Å
664	A	89.6	Confident	88.6	Confident	35 Å²	35	32.7 Å²	32.7	29%	0.289	17%	0.171	S	C	.	.	H	α-helix	trans	-59	-47.1	175.6	0	0	0	0	0	112.2	M660 L661 L662 L666 I667 I668	M660-A664 PolarHBondContact O-N 3.47Å; M660-A664 VanDerWaalsContact O-N 3.08Å; L661-A664 PolarHBondContact O-N 2.84Å; L662-A664 VanDerWaalsContact C-N 3.3Å; L662-A664 PolarHBondContact O-N 3.16Å; A664-L666 PolarHBondContact O-N 2.95Å; A664-I667 PolarHBondContact O-N 2.92Å; A664-I668 HydrophobicContact CB-CD1 4.26Å; A664-I668 VanDerWaalsContact O-CB 3.31Å; A664-I668 WeakPolarHBondContact O-CB 3.39Å; A664-I668 WeakPolarHBondContact O-CD1 3.25Å; A664-I668 WeakPolarHBondContact O-CG1 3.2Å; A664-I668 PolarHBondContact O-N 3.48Å
665	N	88.2	Confident	88.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.5	-42	177.1	-85.8	-106.1	0	0	0	112.5	L661 L662 I663 I667 L669 S691 R781	L661-N665 PolarHBondContact O-N 3.04Å; L661-N665 PolarHBondContact O-ND2 2.98Å; L662-N665 PolarHBondContact O-N 3.04Å; I663-N665 PolarHBondContact O-N 3.23Å; N665-I667 PolarHBondContact O-N 3.49Å; N665-L669 HydrophobicContact CB-CD1 3.93Å; N665-L669 HydrophobicContact CB-CG 4.46Å; N665-L669 VanDerWaalsContact O-CB 3.23Å; N665-L669 WeakPolarHBondContact O-CB 3.4Å; N665-L669 WeakPolarHBondContact O-CD1 3.37Å; N665-L669 VanDerWaalsContact O-CG 3.24Å; N665-L669 WeakPolarHBondContact O-CG 3.26Å; N665-L669 PolarHBondContact O-N 3.33Å; N665-S691 PolarHBondContact ND2-OG 3.24Å; N665-S691 PolarHBondContact OD1-OG 3.32Å; N665-R781 PolarHBondContact OD1-NH1 2.92Å
666	L	88.4	Confident	88.4	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-71.3	-16.4	-176	-94.9	65.5	0	0	0	114	L662 I663 A664 P670 R781 L782 L785 L814 W818	L662-L666 HydrophobicContact CD2-CD1 3.63Å; L662-L666 HydrophobicContact CD2-CD2 3.65Å; L662-L666 HydrophobicContact CD2-CG 4.15Å; L662-L666 HydrophobicContact CG-CD1 3.92Å; L662-L666 WeakPolarHBondContact O-CB 3.2Å; L662-L666 WeakPolarHBondContact O-CD1 3.09Å; L662-L666 PolarHBondContact O-N 3.16Å; I663-L666 PolarHBondContact O-N 3.35Å; A664-L666 PolarHBondContact O-N 2.95Å; L666-P670 WeakPolarHBondContact O-CG 3.38Å; L666-R781 HydrophobicContact CD1-CB 3.95Å; L666-L782 HydrophobicContact CD2-CB 4.15Å; L666-L782 HydrophobicContact CD2-CD1 4.02Å; L666-L785 HydrophobicContact CD2-CD2 4.16Å; L666-L814 HydrophobicContact CB-CD1 4.27Å; L666-L814 HydrophobicContact CD2-CD2 4.19Å; L666-W818 HydrophobicContact CD2-CZ2 4.05Å; L666-W818 HydrophobicContact CG-CZ2 3.98Å; L666-W818 PolarHBondContact O-NE1 2.97Å
667	I	90.9	Very high	87.6	Confident	83 Å²	83	36.9 Å²	36.9	43%	0.426	19%	0.193	S	C	.	.	H	α-helix	trans	-98.4	-41.9	173.8	-62.3	168.3	0	0	0	111.2	I663 A664 N665 V671 H817	I663-I667 HydrophobicContact CG2-CD1 3.94Å; I663-I667 WeakPolarHBondContact O-CG1 3.47Å; I663-I667 PolarHBondContact O-N 3.42Å; A664-I667 PolarHBondContact O-N 2.92Å; N665-I667 PolarHBondContact O-N 3.49Å; I667-V671 WeakPolarHBondContact O-CG2 3.26Å; I667-H817 PolarHBondContact O-CE1 3.49Å; I667-H817 PolarHBondContact O-NE2 2.89Å; I667-H817 VanDerWaalsContact O-NE2 3.09Å
668	I	89.6	Confident	86.4	Confident	70 Å²	70	39.2 Å²	39.2	36%	0.359	21%	0.206	S	C	.	.	H	α-helix	trans	-81	-39.7	-172.4	-61	167.5	0	0	0	111.9	A664 V671 A672 W684 F687	A664-I668 HydrophobicContact CB-CD1 4.26Å; A664-I668 VanDerWaalsContact O-CB 3.31Å; A664-I668 WeakPolarHBondContact O-CB 3.39Å; A664-I668 WeakPolarHBondContact O-CD1 3.25Å; A664-I668 WeakPolarHBondContact O-CG1 3.2Å; A664-I668 PolarHBondContact O-N 3.48Å; I668-V671 PolarHBondContact O-N 2.85Å; I668-A672 PolarHBondContact O-N 3.3Å; I668-W684 HydrophobicContact CG2-CH2 3.93Å; I668-W684 HydrophobicContact CG2-CZ3 3.64Å; I668-F687 HydrophobicContact CD1-CZ 4.19Å
669	L	86.5	Confident	85.1	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-46.2	-177.4	-67.3	168.7	0	0	0	113.4	N665 V671 A672 I673 W684 N688 R778	N665-L669 HydrophobicContact CB-CD1 3.93Å; N665-L669 HydrophobicContact CB-CG 4.46Å; N665-L669 VanDerWaalsContact O-CB 3.23Å; N665-L669 WeakPolarHBondContact O-CB 3.4Å; N665-L669 WeakPolarHBondContact O-CD1 3.37Å; N665-L669 VanDerWaalsContact O-CG 3.24Å; N665-L669 WeakPolarHBondContact O-CG 3.26Å; N665-L669 PolarHBondContact O-N 3.33Å; L669-V671 VanDerWaalsContact C-N 3.32Å; L669-V671 PolarHBondContact O-N 3.46Å; L669-A672 PolarHBondContact O-N 2.73Å; L669-I673 HydrophobicContact CB-CD1 4.44Å; L669-I673 WeakPolarHBondContact O-CB 3.46Å; L669-I673 WeakPolarHBondContact O-CD1 3.46Å; L669-I673 WeakPolarHBondContact O-CG1 3.44Å; L669-I673 PolarHBondContact O-N 2.98Å; L669-W684 HydrophobicContact CD2-CH2 3.88Å; L669-W684 HydrophobicContact CD2-CZ2 4.03Å; L669-N688 WeakPolarHBondContact CD2-OD1 3.37Å; L669-R778 HydrophobicContact CD1-CB 3.76Å; L669-R778 HydrophobicContact CD1-CG 4.42Å
670	P	89.3	Confident	84	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-40.2	177.7	-23.1	33.7	0	0	0	113.1	L666 S674 L779 C821	L666-P670 WeakPolarHBondContact O-CG 3.38Å; P670-S674 WeakPolarHBondContact O-CB 3.47Å; P670-S674 PolarHBondContact O-N 3.07Å; P670-S674 PolarHBondContact O-OG 3.05Å; P670-L779 HydrophobicContact CG-CD2 3.99Å; P670-C821 HydrophobicContact CB-CB 3.81Å
671	V	90.7	Very high	83.5	Confident	18 Å²	18	41.9 Å²	41.9	11%	0.109	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-50.3	179.2	178.8	0	0	0	0	110.2	I667 I668 L669 I673 S674 F675 W848 Y852	I667-V671 WeakPolarHBondContact O-CG2 3.26Å; I668-V671 PolarHBondContact O-N 2.85Å; L669-V671 VanDerWaalsContact C-N 3.32Å; L669-V671 PolarHBondContact O-N 3.46Å; V671-I673 PolarHBondContact O-N 3.37Å; V671-S674 PolarHBondContact O-N 2.93Å; V671-S674 PolarHBondContact O-OG 3.33Å; V671-F675 HydrophobicContact CB-CD2 4.48Å; V671-F675 HydrophobicContact CG1-CD2 3.96Å; V671-F675 WeakPolarHBondContact O-CD2 3.37Å; V671-F675 PolarHBondContact O-N 3.13Å; V671-W848 HydrophobicContact CG1-CE3 4.08Å; V671-W848 HydrophobicContact CG1-CZ3 3.88Å; V671-Y852 HydrophobicContact CG2-CE2 4.49Å
672	A	87.5	Confident	83.1	Confident	2 Å²	2	45.7 Å²	45.7	2%	0.017	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-49	-179.2	0	0	0	0	0	112.2	I668 L669 S674 F676 W684	I668-A672 PolarHBondContact O-N 3.3Å; L669-A672 PolarHBondContact O-N 2.73Å; A672-S674 PolarHBondContact O-N 3.44Å; A672-S674 VanDerWaalsContact O-N 3.13Å; A672-F676 HydrophobicContact CB-CD2 4.04Å; A672-F676 PolarHBondContact O-N 2.87Å; A672-F676 VanDerWaalsContact O-N 3.13Å; A672-W684 HydrophobicContact CB-CH2 3.37Å; A672-W684 HydrophobicContact CB-CZ2 3.21Å; A672-W684 HydrophobicContact CB-CZ3 4.15Å
673	I	84.5	Confident	82.9	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-32.5	179.5	-67	165.4	0	0	0	111.8	L669 V671 K772 M776 L825	L669-I673 HydrophobicContact CB-CD1 4.44Å; L669-I673 WeakPolarHBondContact O-CB 3.46Å; L669-I673 WeakPolarHBondContact O-CD1 3.46Å; L669-I673 WeakPolarHBondContact O-CG1 3.44Å; L669-I673 PolarHBondContact O-N 2.98Å; V671-I673 PolarHBondContact O-N 3.37Å; I673-K772 HydrophobicContact CG2-CB 4.09Å; I673-K772 HydrophobicContact CG2-CG 4.39Å; I673-K772 PolarHBondContact O-NZ 3.13Å; I673-M776 HydrophobicContact CD1-CG 4.32Å; I673-M776 HydrophobicContact CD1-SD 3.81Å; I673-M776 HydrophobicContact CG2-CG 4.38Å; I673-M776 HydrophobicContact CG2-SD 4.12Å; I673-L825 HydrophobicContact CG2-CD1 4.18Å; I673-L825 HydrophobicContact CG2-CD2 4.37Å
674	S	88	Confident	82.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-98.5	-32.2	-174.8	59	0	0	0	0	116	P670 V671 A672 C821 Y824	P670-S674 WeakPolarHBondContact O-CB 3.47Å; P670-S674 PolarHBondContact O-N 3.07Å; P670-S674 PolarHBondContact O-OG 3.05Å; V671-S674 PolarHBondContact O-N 2.93Å; V671-S674 PolarHBondContact O-OG 3.33Å; A672-S674 PolarHBondContact O-N 3.44Å; A672-S674 VanDerWaalsContact O-N 3.13Å; S674-C821 WeakPolarHBondContact CB-O 3.44Å; S674-C821 WeakPolarHBondContact OG-CB 3.3Å; S674-Y824 WeakPolarHBondContact O-CD1 3.48Å; S674-Y824 WeakPolarHBondContact O-CE1 3.33Å
675	F	89.4	Confident	82.4	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-112.8	-24	-174.3	-59.1	-78.6	0	0	0	114.8	V671 Y824 W848 Q851 Y852 A855	V671-F675 HydrophobicContact CB-CD2 4.48Å; V671-F675 HydrophobicContact CG1-CD2 3.96Å; V671-F675 WeakPolarHBondContact O-CD2 3.37Å; V671-F675 PolarHBondContact O-N 3.13Å; F675-Y824 AromaticContact CD1-CD1 3.46Å; F675-Y824 HydrophobicContact CD1-CD1 3.46Å; F675-Y824 VanDerWaalsContact CD1-CD1 3.46Å; F675-Y824 HydrophobicContact CD1-CD2 4.44Å; F675-Y824 AromaticContact CD1-CE1 3.57Å; F675-Y824 HydrophobicContact CD1-CE1 3.57Å; F675-Y824 AromaticContact CD1-CG 3.93Å; F675-Y824 HydrophobicContact CD1-CG 3.93Å; F675-Y824 AromaticContact CE1-CD1 3.33Å; F675-Y824 HydrophobicContact CE1-CD1 3.33Å; F675-Y824 AromaticContact CE1-CD2 3.81Å; F675-Y824 HydrophobicContact CE1-CD2 3.81Å; F675-Y824 AromaticContact CE1-CE1 3.86Å; F675-Y824 HydrophobicContact CE1-CE1 3.86Å; F675-Y824 HydrophobicContact CE1-CE2 4.29Å; F675-Y824 AromaticContact CE1-CG 3.3Å; F675-Y824 HydrophobicContact CE1-CG 3.3Å; F675-Y824 HydrophobicContact CG-CD1 4.29Å; F675-Y824 HydrophobicContact CG-CE1 4.44Å; F675-Y824 HydrophobicContact CZ-CD1 4.05Å; F675-Y824 AromaticContact CZ-CG 3.92Å; F675-Y824 HydrophobicContact CZ-CG 3.92Å; F675-W848 HydrophobicContact CB-CB 4.14Å; F675-Q851 HydrophobicContact CD1-CB 3.65Å; F675-Q851 HydrophobicContact CE1-CB 3.67Å; F675-Y852 AromaticContact CE2-CD2 3.69Å; F675-Y852 HydrophobicContact CE2-CD2 3.69Å; F675-Y852 HydrophobicContact CE2-CG 4.29Å; F675-Y852 VanDerWaalsContact CZ-CA 3.5Å; F675-Y852 HydrophobicContact CZ-CD2 4.01Å; F675-Y852 HydrophobicContact CZ-CG 4.46Å; F675-A855 HydrophobicContact CZ-CB 4.2Å
676	F	85.3	Confident	82.4	Confident	89 Å²	89	56.5 Å²	56.5	39%	0.39	29%	0.29	S	S	.	.			trans	-96	134.8	174.5	-58.9	-45.8	0	0	0	110.1	A672 K772 W848	A672-F676 HydrophobicContact CB-CD2 4.04Å; A672-F676 PolarHBondContact O-N 2.87Å; A672-F676 VanDerWaalsContact O-N 3.13Å; F676-K772 PolarHBondContact O-NZ 3.29Å; F676-W848 HydrophobicContact CE1-CB 4.08Å; F676-W848 AromaticContact CE1-CD1 3.95Å; F676-W848 AromaticContact CE1-CD2 3.96Å; F676-W848 HydrophobicContact CE1-CD2 3.96Å; F676-W848 AromaticContact CE1-CG 3.68Å; F676-W848 HydrophobicContact CE1-CG 3.68Å; F676-W848 AromaticContact CZ-CD2 3.88Å; F676-W848 HydrophobicContact CZ-CD2 3.88Å; F676-W848 HydrophobicContact CZ-CE3 4.2Å; F676-W848 HydrophobicContact CZ-CG 4.12Å
677	N	69.3	Low	82.3	Confident	101 Å²	101	59.7 Å²	59.7	54%	0.54	30%	0.304	S	S	.	.	S	Bend	trans	-102.4	-27.6	176.5	-74.4	-47.2	0	0	0	112.3	D679	N677-D679 PolarHBondContact O-N 3.11Å
678	D	66	Low	82.1	Confident	145 Å²	145	55.9 Å²	55.9	78%	0.775	29%	0.285	S	S	*	.			trans	-85.5	51.1	178.8	-57.9	-52.9	0	0	0	112.3	L680 S681	D678-L680 PolarHBondContact O-N 3.36Å; D678-S681 PolarHBondContact O-N 3.27Å
679	D	61.8	Low	81.9	Confident	31 Å²	31	54.9 Å²	54.9	17%	0.166	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	12.9	-178.1	-76.9	-43.1	0	0	0	114.9	N677 K772	N677-D679 PolarHBondContact O-N 3.11Å; D679-K772 VanDerWaalsContact OD2-CE 3.24Å; D679-K772 WeakPolarHBondContact OD2-CE 3.4Å; D679-K772 IonicContact OD2-NZ 3.8Å; D679-K772 PolarHBondContact OD2-NZ 3.26Å
680	L	63.5	Low	82.1	Confident	116 Å²	116	59.7 Å²	59.7	61%	0.607	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	9.6	177.6	-69.7	90.3	0	0	0	113.3	D678 I682	D678-L680 PolarHBondContact O-N 3.36Å; L680-I682 PolarHBondContact O-N 3.29Å
681	S	79	Confident	82.1	Confident	62 Å²	62	59.6 Å²	59.6	43%	0.434	31%	0.308	S	S	.	.			trans	-53.6	130.3	168.7	178.2	0	0	0	0	111.2	D678 H683 W684 I685	D678-S681 PolarHBondContact O-N 3.27Å; S681-H683 PolarHBondContact O-N 3.14Å; S681-W684 WeakPolarHBondContact O-CB 3.47Å; S681-W684 PolarHBondContact O-N 3.06Å; S681-I685 PolarHBondContact O-N 3.31Å; S681-I685 VanDerWaalsContact O-N 3.12Å
682	I	82	Confident	82	Confident	113 Å²	113	59 Å²	59	58%	0.579	30%	0.304	S	S	*	.	H	α-helix	trans	-60	-34.2	-172.7	-162.4	168.5	0	0	0	112.4	L680 W684 I685 I686	L680-I682 PolarHBondContact O-N 3.29Å; I682-W684 PolarHBondContact O-N 3.37Å; I682-I685 PolarHBondContact O-N 3.03Å; I682-I686 HydrophobicContact CG1-CD1 4.08Å; I682-I686 WeakPolarHBondContact O-CB 3.37Å; I682-I686 WeakPolarHBondContact O-CD1 3.44Å; I682-I686 VanDerWaalsContact O-CG1 3.23Å; I682-I686 WeakPolarHBondContact O-CG1 3.05Å; I682-I686 PolarHBondContact O-N 2.82Å
683	H	84.6	Confident	82.2	Confident	143 Å²	143	63.5 Å²	63.5	66%	0.662	33%	0.331	S	S	*	.	H	α-helix	trans	-66	-36.5	176.5	-57.9	-69.7	0	0	0	112.6	S681 F687	S681-H683 PolarHBondContact O-N 3.14Å; H683-F687 WeakPolarHBondContact O-CB 3.41Å; H683-F687 PolarHBondContact O-N 3.34Å
684	W	83.3	Confident	82.6	Confident	46 Å²	46	64.8 Å²	64.8	17%	0.174	34%	0.339	C	S	.	.	H	α-helix	trans	-69.6	-43.2	176.9	-179.2	-123.5	0	0	0	111.5	I668 L669 A672 S681 I682 I686 F687 N688	I668-W684 HydrophobicContact CG2-CH2 3.93Å; I668-W684 HydrophobicContact CG2-CZ3 3.64Å; L669-W684 HydrophobicContact CD2-CH2 3.88Å; L669-W684 HydrophobicContact CD2-CZ2 4.03Å; A672-W684 HydrophobicContact CB-CH2 3.37Å; A672-W684 HydrophobicContact CB-CZ2 3.21Å; A672-W684 HydrophobicContact CB-CZ3 4.15Å; S681-W684 WeakPolarHBondContact O-CB 3.47Å; S681-W684 PolarHBondContact O-N 3.06Å; I682-W684 PolarHBondContact O-N 3.37Å; W684-I686 PolarHBondContact O-N 2.99Å; W684-F687 HydrophobicContact CE3-CD1 4.06Å; W684-F687 AromaticContact CZ3-CD1 3.79Å; W684-F687 HydrophobicContact CZ3-CD1 3.79Å; W684-F687 HydrophobicContact CZ3-CE1 4.08Å; W684-F687 PolarHBondContact O-N 2.95Å; W684-N688 WeakPolarHBondContact CZ2-ND2 3.21Å; W684-N688 PolarHBondContact NE1-ND2 3.3Å; W684-N688 PolarHBondContact O-N 3.38Å
685	I	83.4	Confident	82.7	Confident	57 Å²	57	64.8 Å²	64.8	29%	0.292	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-43.5	174.9	-61.6	172.4	0	0	0	110.7	S681 I682 S689 Y744	S681-I685 PolarHBondContact O-N 3.31Å; S681-I685 VanDerWaalsContact O-N 3.12Å; I682-I685 PolarHBondContact O-N 3.03Å; I685-S689 VanDerWaalsContact O-CB 3.22Å; I685-S689 WeakPolarHBondContact O-CB 3.46Å; I685-S689 PolarHBondContact O-N 2.87Å; I685-S689 PolarHBondContact O-OG 3.39Å; I685-Y744 HydrophobicContact CG1-CE1 4.34Å
686	I	87.4	Confident	82.8	Confident	86 Å²	86	68.4 Å²	68.4	44%	0.441	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-48.8	176	-71.5	164.9	0	0	0	111	I682 W684 N688 S689 I690	I682-I686 HydrophobicContact CG1-CD1 4.08Å; I682-I686 WeakPolarHBondContact O-CB 3.37Å; I682-I686 WeakPolarHBondContact O-CD1 3.44Å; I682-I686 VanDerWaalsContact O-CG1 3.23Å; I682-I686 WeakPolarHBondContact O-CG1 3.05Å; I682-I686 PolarHBondContact O-N 2.82Å; W684-I686 PolarHBondContact O-N 2.99Å; I686-N688 PolarHBondContact O-N 3.04Å; I686-S689 PolarHBondContact O-N 3.44Å; I686-I690 HydrophobicContact CG2-CD1 3.69Å; I686-I690 HydrophobicContact CG2-CG1 4.45Å; I686-I690 WeakPolarHBondContact O-CG1 3.44Å; I686-I690 PolarHBondContact O-N 3.27Å
687	F	86.5	Confident	83.2	Confident	68 Å²	68	66 Å²	66	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-50.2	179.2	173.5	-100.9	0	0	0	112.3	I668 H683 W684 I690 S691	I668-F687 HydrophobicContact CD1-CZ 4.19Å; H683-F687 WeakPolarHBondContact O-CB 3.41Å; H683-F687 PolarHBondContact O-N 3.34Å; W684-F687 HydrophobicContact CE3-CD1 4.06Å; W684-F687 AromaticContact CZ3-CD1 3.79Å; W684-F687 HydrophobicContact CZ3-CD1 3.79Å; W684-F687 HydrophobicContact CZ3-CE1 4.08Å; W684-F687 PolarHBondContact O-N 2.95Å; F687-I690 PolarHBondContact O-N 2.9Å; F687-S691 VanDerWaalsContact O-CB 3.3Å; F687-S691 WeakPolarHBondContact O-CB 3.32Å; F687-S691 PolarHBondContact O-N 2.97Å
688	N	85.9	Confident	84.2	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-65.1	-39.9	178	-75.3	-27.2	0	0	0	112.1	L669 W684 I686 S691 D692 Y744	L669-N688 WeakPolarHBondContact CD2-OD1 3.37Å; W684-N688 WeakPolarHBondContact CZ2-ND2 3.21Å; W684-N688 PolarHBondContact NE1-ND2 3.3Å; W684-N688 PolarHBondContact O-N 3.38Å; I686-N688 PolarHBondContact O-N 3.04Å; N688-S691 WeakPolarHBondContact O-CB 3.24Å; N688-S691 PolarHBondContact O-N 3.31Å; N688-D692 WeakPolarHBondContact O-CB 3.44Å; N688-D692 PolarHBondContact O-N 3.49Å; N688-Y744 HydrophobicContact CB-CE2 4.03Å; N688-Y744 WeakPolarHBondContact CB-OH 3.48Å; N688-Y744 PolarHBondContact ND2-OH 3.07Å
689	S	86.5	Confident	85.5	Confident	49 Å²	49	54.9 Å²	54.9	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-44.3	178.1	-60.1	0	0	0	0	112.1	I685 I686 D692 V693	I685-S689 VanDerWaalsContact O-CB 3.22Å; I685-S689 WeakPolarHBondContact O-CB 3.46Å; I685-S689 PolarHBondContact O-N 2.87Å; I685-S689 PolarHBondContact O-OG 3.39Å; I686-S689 PolarHBondContact O-N 3.44Å; S689-D692 PolarHBondContact O-N 2.8Å; S689-V693 WeakPolarHBondContact O-CB 3.44Å; S689-V693 VanDerWaalsContact O-CG2 3.26Å; S689-V693 WeakPolarHBondContact O-CG2 3.35Å; S689-V693 PolarHBondContact O-N 3.26Å
690	I	90.3	Very high	86.9	Confident	105 Å²	105	56.3 Å²	56.3	54%	0.538	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-46.5	175	-68.2	168.2	0	0	0	110.2	I686 F687 D692 V693 V694	I686-I690 HydrophobicContact CG2-CD1 3.69Å; I686-I690 HydrophobicContact CG2-CG1 4.45Å; I686-I690 WeakPolarHBondContact O-CG1 3.44Å; I686-I690 PolarHBondContact O-N 3.27Å; F687-I690 PolarHBondContact O-N 2.9Å; I690-D692 PolarHBondContact O-N 3.19Å; I690-V693 PolarHBondContact O-N 3.48Å; I690-V694 WeakPolarHBondContact O-CG2 3.43Å; I690-V694 PolarHBondContact O-N 3.17Å
691	S	89.3	Confident	88.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-54.5	-52.8	176.8	-179	0	0	0	0	111.6	N665 F687 N688 V693 V694 F695 R781	N665-S691 PolarHBondContact ND2-OG 3.24Å; N665-S691 PolarHBondContact OD1-OG 3.32Å; F687-S691 VanDerWaalsContact O-CB 3.3Å; F687-S691 WeakPolarHBondContact O-CB 3.32Å; F687-S691 PolarHBondContact O-N 2.97Å; N688-S691 WeakPolarHBondContact O-CB 3.24Å; N688-S691 PolarHBondContact O-N 3.31Å; S691-V693 PolarHBondContact O-N 3.13Å; S691-V694 PolarHBondContact O-N 3.42Å; S691-F695 WeakPolarHBondContact O-CD2 3.39Å; S691-F695 PolarHBondContact O-N 3.25Å; S691-F695 WeakPolarHBondContact OG-CE2 3.48Å; S691-R781 PolarHBondContact OG-NH1 3.38Å
692	D	89	Confident	88.8	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-39.4	-177	-63.5	-26.1	0	0	0	112.1	N688 S689 I690 V694 F695 I696 R778 R781	N688-D692 WeakPolarHBondContact O-CB 3.44Å; N688-D692 PolarHBondContact O-N 3.49Å; S689-D692 PolarHBondContact O-N 2.8Å; I690-D692 PolarHBondContact O-N 3.19Å; D692-V694 VanDerWaalsContact C-N 3.32Å; D692-V694 PolarHBondContact O-N 3.37Å; D692-F695 CarbonylContact O-C 3.56Å; D692-F695 PolarHBondContact O-N 2.77Å; D692-I696 VanDerWaalsContact O-CG1 3.28Å; D692-I696 WeakPolarHBondContact O-CG1 3.46Å; D692-I696 PolarHBondContact O-N 2.86Å; D692-R778 IonicContact OD1-CZ 2.83Å; D692-R778 IonicContact OD1-NH1 3.94Å; D692-R778 PolarHBondContact OD1-NH1 2.8Å; D692-R778 IonicContact OD2-CZ 2.7Å; D692-R778 IonicContact OD2-NH1 3.46Å; D692-R778 PolarHBondContact OD2-NH1 3.35Å; D692-R778 IonicContact OD2-NH2 3.25Å; D692-R778 PolarHBondContact OD2-NH2 3Å; D692-R781 IonicContact OD1-CZ 3.86Å; D692-R781 IonicContact OD1-NH1 3.78Å; D692-R781 PolarHBondContact OD1-NH1 3.02Å; D692-R781 VanDerWaalsContact OD1-NH1 3.09Å; D692-R781 IonicContact OD1-NH2 2.72Å; D692-R781 PolarHBondContact OD1-NH2 2.9Å
693	V	91.6	Very high	89.3	Confident	97 Å²	97	46.9 Å²	46.9	59%	0.588	26%	0.255	S	S	*	.	H	α-helix	trans	-58.9	-41.9	173	166.8	0	0	0	0	111.5	S689 I690 S691 I696 A697	S689-V693 WeakPolarHBondContact O-CB 3.44Å; S689-V693 VanDerWaalsContact O-CG2 3.26Å; S689-V693 WeakPolarHBondContact O-CG2 3.35Å; S689-V693 PolarHBondContact O-N 3.26Å; I690-V693 PolarHBondContact O-N 3.48Å; S691-V693 PolarHBondContact O-N 3.13Å; V693-I696 PolarHBondContact O-N 3.38Å; V693-A697 PolarHBondContact O-N 3.34Å
694	V	92.4	Very high	89.6	Confident	34 Å²	34	45.7 Å²	45.7	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-38.9	176	175.3	0	0	0	0	111.6	M658 L661 I690 S691 D692 I696 A697 D698	M658-V694 HydrophobicContact CE-CG1 4.18Å; M658-V694 HydrophobicContact SD-CG1 3.6Å; L661-V694 HydrophobicContact CD2-CB 3.74Å; L661-V694 HydrophobicContact CD2-CG1 3.53Å; I690-V694 WeakPolarHBondContact O-CG2 3.43Å; I690-V694 PolarHBondContact O-N 3.17Å; S691-V694 PolarHBondContact O-N 3.42Å; D692-V694 VanDerWaalsContact C-N 3.32Å; D692-V694 PolarHBondContact O-N 3.37Å; V694-I696 VanDerWaalsContact C-N 3.27Å; V694-I696 PolarHBondContact O-N 2.76Å; V694-A697 PolarHBondContact O-N 3.36Å; V694-D698 PolarHBondContact O-N 2.91Å
695	F	90.3	Very high	89.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69	-20.9	173.5	-74.5	-65.9	0	0	0	114	M658 L661 L662 S691 D692 S739 R781 R784	M658-F695 HydrophobicContact CE-CD1 3.3Å; M658-F695 HydrophobicContact CE-CE1 3.35Å; M658-F695 HydrophobicContact CE-CG 4.14Å; M658-F695 HydrophobicContact CE-CZ 4.22Å; L661-F695 HydrophobicContact CD2-CD2 4.24Å; L661-F695 HydrophobicContact CD2-CE2 3.75Å; L661-F695 HydrophobicContact CD2-CZ 3.98Å; L661-F695 HydrophobicContact CG-CE2 3.86Å; L661-F695 HydrophobicContact CG-CZ 3.95Å; L662-F695 HydrophobicContact CB-CE1 4.25Å; L662-F695 HydrophobicContact CB-CZ 4.01Å; L662-F695 HydrophobicContact CD1-CE1 4.44Å; L662-F695 HydrophobicContact CG-CZ 4.47Å; S691-F695 WeakPolarHBondContact O-CD2 3.39Å; S691-F695 PolarHBondContact O-N 3.25Å; S691-F695 WeakPolarHBondContact OG-CE2 3.48Å; D692-F695 CarbonylContact O-C 3.56Å; D692-F695 PolarHBondContact O-N 2.77Å; F695-S739 VanDerWaalsContact C-OG 3.27Å; F695-S739 PolarHBondContact O-OG 3.48Å; F695-R781 VanDerWaalsContact CD2-CZ 3.49Å; F695-R784 PolarHBondContact O-NH1 2.68Å
696	I	91.5	Very high	90.1	Very high	87 Å²	87	41.7 Å²	41.7	45%	0.446	23%	0.229	S	C	.	.	H	α-helix	trans	-79.1	-41.7	168.7	-68.7	165.4	0	0	0	110.3	D692 V693 V694 D698 I699 A700	D692-I696 VanDerWaalsContact O-CG1 3.28Å; D692-I696 WeakPolarHBondContact O-CG1 3.46Å; D692-I696 PolarHBondContact O-N 2.86Å; V693-I696 PolarHBondContact O-N 3.38Å; V694-I696 VanDerWaalsContact C-N 3.27Å; V694-I696 PolarHBondContact O-N 2.76Å; I696-D698 VanDerWaalsContact C-N 3.3Å; I696-D698 PolarHBondContact O-N 3.32Å; I696-I699 WeakPolarHBondContact O-CB 3.15Å; I696-I699 PolarHBondContact O-N 3.36Å; I696-I699 VanDerWaalsContact O-N 3.09Å; I696-A700 PolarHBondContact O-N 3.44Å
697	A	92.6	Very high	90	Very high	37 Å²	37	39.3 Å²	39.3	31%	0.306	22%	0.217	S	C	.	.	H	α-helix	trans	-60	-38.3	174.3	0	0	0	0	0	112.3	W654 V693 V694 I699 A700 V701	W654-A697 HydrophobicContact CH2-CB 4.02Å; W654-A697 HydrophobicContact CZ2-CB 4.16Å; V693-A697 PolarHBondContact O-N 3.34Å; V694-A697 PolarHBondContact O-N 3.36Å; A697-I699 VanDerWaalsContact C-N 3.28Å; A697-I699 PolarHBondContact O-N 3.28Å; A697-A700 WeakPolarHBondContact O-CB 3.47Å; A697-A700 PolarHBondContact O-N 3.32Å; A697-A700 VanDerWaalsContact O-N 3.08Å; A697-V701 WeakPolarHBondContact O-CG2 3.23Å; A697-V701 PolarHBondContact O-N 3.35Å
698	D	92.2	Very high	89.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-55.2	-38.7	172.3	172.7	50.1	0	0	0	112.9	W654 M658 V694 I696 V701 K702 R784 Y788	W654-D698 HydrophobicContact CZ2-CB 4.49Å; M658-D698 HydrophobicContact CE-CB 3.72Å; M658-D698 HydrophobicContact SD-CB 4Å; V694-D698 PolarHBondContact O-N 2.91Å; I696-D698 VanDerWaalsContact C-N 3.3Å; I696-D698 PolarHBondContact O-N 3.32Å; D698-V701 PolarHBondContact O-N 3.02Å; D698-K702 WeakPolarHBondContact O-CB 3.47Å; D698-K702 VanDerWaalsContact O-CG 3.26Å; D698-K702 WeakPolarHBondContact O-CG 3.2Å; D698-K702 PolarHBondContact O-N 3.21Å; D698-K702 WeakPolarHBondContact OD1-CE 3.38Å; D698-K702 IonicContact OD1-NZ 3.46Å; D698-K702 WeakPolarHBondContact OD2-CE 3.42Å; D698-K702 IonicContact OD2-NZ 3.77Å; D698-K702 PolarHBondContact OD2-NZ 2.87Å; D698-R784 IonicContact OD2-CZ 2.71Å; D698-R784 IonicContact OD2-NE 3.96Å; D698-R784 IonicContact OD2-NH1 3.53Å; D698-R784 PolarHBondContact OD2-NH1 2.88Å; D698-Y788 PolarHBondContact OD1-OH 2.92Å
699	I	91.5	Very high	89	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.072	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-44.1	175.6	-63.5	173.7	0	0	0	110.2	I696 A697 K702 F703 Y727 F732 D735 S739	I696-I699 WeakPolarHBondContact O-CB 3.15Å; I696-I699 PolarHBondContact O-N 3.36Å; I696-I699 VanDerWaalsContact O-N 3.09Å; A697-I699 VanDerWaalsContact C-N 3.28Å; A697-I699 PolarHBondContact O-N 3.28Å; I699-K702 PolarHBondContact O-N 2.9Å; I699-F703 HydrophobicContact CG2-CD2 4.04Å; I699-F703 HydrophobicContact CG2-CE2 3.76Å; I699-F703 WeakPolarHBondContact O-CD2 3.16Å; I699-F703 PolarHBondContact O-N 3.44Å; I699-F703 VanDerWaalsContact O-N 3.1Å; I699-Y727 HydrophobicContact CG2-CE1 4.16Å; I699-F732 HydrophobicContact CG2-CD2 4.16Å; I699-F732 HydrophobicContact CG2-CE2 3.96Å; I699-D735 HydrophobicContact CD1-CB 4.42Å; I699-D735 HydrophobicContact CG1-CB 4.24Å; I699-S739 WeakPolarHBondContact CD1-OG 3.47Å
700	A	92.4	Very high	87.9	Confident	60 Å²	60	43.5 Å²	43.5	50%	0.496	24%	0.242	S	C	.	.	H	α-helix	trans	-65	-39.1	177	0	0	0	0	0	112.5	I696 A697 F703	I696-A700 PolarHBondContact O-N 3.44Å; A697-A700 WeakPolarHBondContact O-CB 3.47Å; A697-A700 PolarHBondContact O-N 3.32Å; A697-A700 VanDerWaalsContact O-N 3.08Å; A700-F703 PolarHBondContact O-N 2.92Å
701	V	92.1	Very high	86.5	Confident	19 Å²	19	45 Å²	45	12%	0.115	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-41.4	173.4	168.5	0	0	0	0	111.1	I644 F650 W654 A697 D698 F703 R704 T705	I644-V701 HydrophobicContact CD1-CG1 3.99Å; F650-V701 HydrophobicContact CE1-CG1 4.12Å; F650-V701 HydrophobicContact CE1-CG2 4.5Å; W654-V701 HydrophobicContact CD2-CG2 4.46Å; W654-V701 HydrophobicContact CZ2-CG2 4.04Å; A697-V701 WeakPolarHBondContact O-CG2 3.23Å; A697-V701 PolarHBondContact O-N 3.35Å; D698-V701 PolarHBondContact O-N 3.02Å; V701-F703 PolarHBondContact O-N 3.47Å; V701-R704 CarbonylContact O-C 3.44Å; V701-R704 WeakPolarHBondContact O-CA 3.49Å; V701-R704 PolarHBondContact O-N 3.05Å; V701-T705 PolarHBondContact O-N 3.05Å; V701-T705 PolarHBondContact O-OG1 2.69Å
702	K	89.6	Confident	85.1	Confident	22 Å²	22	52.2 Å²	52.2	10%	0.096	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-39.2	175.8	-77.3	165.5	176.1	167.4	0	112.9	D698 I699 R704 T705 Y727 D735	D698-K702 WeakPolarHBondContact O-CB 3.47Å; D698-K702 VanDerWaalsContact O-CG 3.26Å; D698-K702 WeakPolarHBondContact O-CG 3.2Å; D698-K702 PolarHBondContact O-N 3.21Å; D698-K702 WeakPolarHBondContact OD1-CE 3.38Å; D698-K702 IonicContact OD1-NZ 3.46Å; D698-K702 WeakPolarHBondContact OD2-CE 3.42Å; D698-K702 IonicContact OD2-NZ 3.77Å; D698-K702 PolarHBondContact OD2-NZ 2.87Å; I699-K702 PolarHBondContact O-N 2.9Å; K702-R704 PolarHBondContact O-N 2.99Å; K702-R704 VanDerWaalsContact O-N 3.08Å; K702-T705 PolarHBondContact O-N 3.41Å; K702-Y727 HydrophobicContact CB-CD1 4.34Å; K702-Y727 HydrophobicContact CB-CE1 3.87Å; K702-Y727 HydrophobicContact CB-CE2 4.34Å; K702-Y727 HydrophobicContact CD-CE2 4.04Å; K702-Y727 WeakPolarHBondContact CD-OH 3.47Å; K702-D735 IonicContact NZ-OD1 3.35Å; K702-D735 IonicContact NZ-OD2 2.85Å; K702-D735 PolarHBondContact NZ-OD2 3.04Å
703	F	91.9	Very high	83.8	Confident	53 Å²	53	52.9 Å²	52.9	23%	0.232	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.1	171.6	-82.5	-67.7	0	0	0	114.5	I699 A700 V701 A724 Y727 L728 F732	I699-F703 HydrophobicContact CG2-CD2 4.04Å; I699-F703 HydrophobicContact CG2-CE2 3.76Å; I699-F703 WeakPolarHBondContact O-CD2 3.16Å; I699-F703 PolarHBondContact O-N 3.44Å; I699-F703 VanDerWaalsContact O-N 3.1Å; A700-F703 PolarHBondContact O-N 2.92Å; V701-F703 PolarHBondContact O-N 3.47Å; F703-A724 HydrophobicContact CD1-CB 3.79Å; F703-A724 HydrophobicContact CE1-CB 4.02Å; F703-Y727 HydrophobicContact CD1-CD1 4.07Å; F703-Y727 HydrophobicContact CD2-CD1 4.24Å; F703-Y727 HydrophobicContact CD2-CE1 4.19Å; F703-Y727 AromaticContact CE1-CD1 3.87Å; F703-Y727 HydrophobicContact CE1-CD1 3.87Å; F703-Y727 HydrophobicContact CE2-CD1 4.04Å; F703-Y727 AromaticContact CE2-CE1 3.96Å; F703-Y727 HydrophobicContact CE2-CE1 3.96Å; F703-Y727 HydrophobicContact CG-CD1 4.24Å; F703-Y727 AromaticContact CZ-CD1 3.85Å; F703-Y727 HydrophobicContact CZ-CD1 3.85Å; F703-Y727 HydrophobicContact CZ-CE1 4.17Å; F703-L728 HydrophobicContact CE1-CD1 4.36Å; F703-L728 HydrophobicContact CE1-CD2 4.25Å; F703-L728 HydrophobicContact CE1-CG 3.95Å; F703-L728 HydrophobicContact CZ-CD2 3.93Å; F703-L728 HydrophobicContact CZ-CG 4.15Å; F703-F732 AromaticContact CE2-CD2 3.84Å; F703-F732 HydrophobicContact CE2-CD2 3.84Å; F703-F732 AromaticContact CE2-CE2 3.81Å; F703-F732 HydrophobicContact CE2-CE2 3.81Å; F703-F732 AromaticContact CZ-CD2 3.72Å; F703-F732 HydrophobicContact CZ-CD2 3.72Å; F703-F732 AromaticContact CZ-CE2 3.89Å; F703-F732 HydrophobicContact CZ-CE2 3.89Å; F703-F732 HydrophobicContact CZ-CG 4.49Å
704	R	91	Very high	82.4	Confident	117 Å²	117	54.8 Å²	54.8	44%	0.442	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-1.7	177.4	-61.5	-60.4	-178	156	-3.1	114.3	I644 V701 K702	I644-R704 HydrophobicContact CD1-CB 4.25Å; I644-R704 HydrophobicContact CG1-CB 4.44Å; I644-R704 PolarHBondContact N-O 3.39Å; V701-R704 CarbonylContact O-C 3.44Å; V701-R704 WeakPolarHBondContact O-CA 3.49Å; V701-R704 PolarHBondContact O-N 3.05Å; K702-R704 PolarHBondContact O-N 2.99Å; K702-R704 VanDerWaalsContact O-N 3.08Å
705	T	90.1	Very high	81.3	Confident	15 Å²	15	57.6 Å²	57.6	9%	0.092	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-90.7	126.1	-178.7	-58.1	0	0	0	0	110.2	I644 R651 V701 K702 I723	I644-T705 WeakPolarHBondContact O-CA 3.41Å; R651-T705 HydrophobicContact CG-CG2 4.38Å; R651-T705 PolarHBondContact NH1-OG1 3.06Å; V701-T705 PolarHBondContact O-N 3.05Å; V701-T705 PolarHBondContact O-OG1 2.69Å; K702-T705 PolarHBondContact O-N 3.41Å; T705-I723 VanDerWaalsContact O-CG2 3.31Å; T705-I723 WeakPolarHBondContact O-CG2 3.34Å
706	G	87.7	Confident	80.8	Confident	5 Å²	5	57.6 Å²	57.6	5%	0.052	30%	0.304	C	S	.	.			trans	-63.2	147.2	176.8	0	0	0	0	0	113.3	I644 I717	I644-G706 PolarHBondContact O-N 3.48Å; G706-I717 CarbonylContact C-O 3.57Å; G706-I717 WeakPolarHBondContact CA-O 3.47Å
707	I	85.2	Confident	80.5	Confident	36 Å²	36	55.1 Å²	55.1	19%	0.185	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-108.8	126.5	-174.1	-58.1	178.8	0	0	0	109.7	T709 I716 I717 I723 H726	I707-T709 HydrophobicContact CG2-CG2 4.25Å; I707-I716 WeakPolarHBondContact O-CA 3.45Å; I707-I717 PolarHBondContact N-O 3.46Å; I707-I717 PolarHBondContact O-N 3.48Å; I707-I723 HydrophobicContact CD1-CB 4.48Å; I707-I723 HydrophobicContact CD1-CG2 4.24Å; I707-I723 HydrophobicContact CG1-CG1 4.41Å; I707-I723 HydrophobicContact CG1-CG2 4.42Å; I707-H726 HydrophobicContact CD1-CB 3.94Å
708	V	80.9	Confident	80.1	Confident	58 Å²	58	53.4 Å²	53.4	35%	0.352	28%	0.276	S	S	.	.			trans	-84.8	128.9	167.5	-167.4	0	0	0	0	107.9	P646 I716	P646-V708 HydrophobicContact CB-CG2 4.36Å; P646-V708 HydrophobicContact CG-CG2 3.97Å; V708-I716 HydrophobicContact CG1-CG1 4.47Å; V708-I716 HydrophobicContact CG2-CG1 4.24Å
709	T	70.1	Confident	79.8	Confident	54 Å²	54	56.9 Å²	56.9	33%	0.331	30%	0.295	S	S	.	.			trans	-106.9	-31	-171.8	50	0	0	0	0	115.9	I707 E715 I717	I707-T709 HydrophobicContact CG2-CG2 4.25Å; T709-E715 WeakPolarHBondContact OG1-CB 3.3Å; T709-E715 PolarHBondContact OG1-O 2.95Å; T709-E715 VanDerWaalsContact OG1-O 3.07Å; T709-I717 HydrophobicContact CG2-CD1 3.65Å; T709-I717 HydrophobicContact CG2-CG1 4.1Å
710	N	63.4	Low	79.7	Confident	95 Å²	95	58.1 Å²	58.1	51%	0.508	30%	0.304	S	S	.	.	S	Bend	trans	-147.4	38.8	-173.3	-69.5	-62.5	0	0	0	113.4	Y712 E715	N710-Y712 HydrophobicContact CB-CD2 4.38Å; N710-Y712 WeakPolarHBondContact O-CD2 3.31Å; N710-Y712 PolarHBondContact O-N 3.15Å; N710-E715 WeakPolarHBondContact CB-OE2 3.31Å; N710-E715 PolarHBondContact ND2-OE2 3.15Å
711	D	61.6	Low	79.5	Confident	138 Å²	138	63.6 Å²	63.6	74%	0.738	32%	0.317	S	S	*	.	S	Bend	trans	60.1	-20.4	-176.9	-54.8	-18.7	0	0	0	117.1
712	Y	61.1	Low	79.3	Confident	151 Å²	151	66.6 Å²	66.6	59%	0.592	33%	0.329	S	S	*	.			trans	-80.8	135.4	178.8	-59.9	-65.4	0	0	0	112.3	N710 D714 E715	N710-Y712 HydrophobicContact CB-CD2 4.38Å; N710-Y712 WeakPolarHBondContact O-CD2 3.31Å; N710-Y712 PolarHBondContact O-N 3.15Å; Y712-D714 VanDerWaalsContact C-N 3.27Å; Y712-D714 PolarHBondContact O-N 3.22Å; Y712-E715 PolarHBondContact O-N 3.43Å
713	A	61.1	Low	79.3	Confident	18 Å²	18	65.6 Å²	65.6	15%	0.149	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.8	-29.2	-178.4	0	0	0	0	0	114.8	L622 F623 E715 I716	L622-A713 HydrophobicContact CD1-CB 4.25Å; L622-A713 HydrophobicContact CG-CB 4.1Å; L622-A713 WeakPolarHBondContact O-CB 3.28Å; F623-A713 HydrophobicContact CD1-CB 3.65Å; F623-A713 HydrophobicContact CE1-CB 3.81Å; F623-A713 HydrophobicContact CG-CB 4.49Å; A713-E715 VanDerWaalsContact C-N 3.26Å; A713-E715 PolarHBondContact O-N 3.47Å; A713-I716 WeakPolarHBondContact O-CG1 3.49Å
714	D	62.4	Low	79.2	Confident	137 Å²	137	64.2 Å²	64.2	73%	0.733	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-71.4	-18	-177.6	-70.9	-47.8	0	0	0	113.4	Y712	Y712-D714 VanDerWaalsContact C-N 3.27Å; Y712-D714 PolarHBondContact O-N 3.22Å
715	E	68	Low	79.3	Confident	93 Å²	93	67.6 Å²	67.6	44%	0.435	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-105	21.6	-175.7	-59	-167.8	169.1	0	0	113.9	T709 N710 Y712 A713 I717	T709-E715 WeakPolarHBondContact OG1-CB 3.3Å; T709-E715 PolarHBondContact OG1-O 2.95Å; T709-E715 VanDerWaalsContact OG1-O 3.07Å; N710-E715 WeakPolarHBondContact CB-OE2 3.31Å; N710-E715 PolarHBondContact ND2-OE2 3.15Å; Y712-E715 PolarHBondContact O-N 3.43Å; A713-E715 VanDerWaalsContact C-N 3.26Å; A713-E715 PolarHBondContact O-N 3.47Å; E715-I717 PolarHBondContact O-N 3.31Å
716	I	81.4	Confident	79.3	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	35%	0.353	C	S	.	.			trans	-71	113.2	172.2	-59.2	174.7	0	0	0	109.4	L622 F623 R635 P646 I707 V708 A713 L718	L622-I716 HydrophobicContact CD2-CD1 4.22Å; F623-I716 HydrophobicContact CE1-CD1 3.95Å; F623-I716 HydrophobicContact CZ-CD1 3.66Å; R635-I716 VanDerWaalsContact CZ-O 3.31Å; R635-I716 PolarHBondContact NH1-O 3.49Å; R635-I716 PolarHBondContact NH2-O 2.96Å; P646-I716 HydrophobicContact CG-CG2 4.1Å; I707-I716 WeakPolarHBondContact O-CA 3.45Å; V708-I716 HydrophobicContact CG1-CG1 4.47Å; V708-I716 HydrophobicContact CG2-CG1 4.24Å; A713-I716 WeakPolarHBondContact O-CG1 3.49Å; I716-L718 HydrophobicContact CG2-CD2 4.35Å; I716-L718 HydrophobicContact CG2-CG 4.39Å; I716-L718 PolarHBondContact O-N 3.5Å
717	I	83.6	Confident	79.4	Confident	34 Å²	34	72 Å²	72	17%	0.174	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-79.7	112.4	177.4	-59.5	179.1	0	0	0	109.5	G706 I707 T709 E715 N719 E722 I723	G706-I717 CarbonylContact C-O 3.57Å; G706-I717 WeakPolarHBondContact CA-O 3.47Å; I707-I717 PolarHBondContact N-O 3.46Å; I707-I717 PolarHBondContact O-N 3.48Å; T709-I717 HydrophobicContact CG2-CD1 3.65Å; T709-I717 HydrophobicContact CG2-CG1 4.1Å; E715-I717 PolarHBondContact O-N 3.31Å; I717-N719 HydrophobicContact CG2-CB 4.35Å; I717-E722 HydrophobicContact CD1-CG 4.35Å; I717-E722 HydrophobicContact CG2-CB 3.82Å; I717-E722 HydrophobicContact CG2-CG 3.77Å; I717-I723 HydrophobicContact CG2-CG1 4.21Å
718	L	85.1	Confident	79.7	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	37%	0.366	C	S	.	.			trans	-101.9	-11.8	174.7	-69.6	175.5	0	0	0	113.5	E632 R635 Q636 Q639 V643 I716 P720 I723	E632-L718 WeakPolarHBondContact OE1-CD1 3.27Å; R635-L718 HydrophobicContact CG-CD1 4.43Å; Q636-L718 HydrophobicContact CB-CD1 4.11Å; Q639-L718 HydrophobicContact CB-CB 4.45Å; V643-L718 HydrophobicContact CG1-CB 4.4Å; V643-L718 HydrophobicContact CG1-CD2 3.96Å; I716-L718 HydrophobicContact CG2-CD2 4.35Å; I716-L718 HydrophobicContact CG2-CG 4.39Å; I716-L718 PolarHBondContact O-N 3.5Å; L718-P720 VanDerWaalsContact O-CD 3.25Å; L718-P720 WeakPolarHBondContact O-CD 3.36Å; L718-I723 WeakPolarHBondContact O-CD1 3.27Å
719	N	86.4	Confident	80.1	Confident	74 Å²	74	80.6 Å²	80.6	40%	0.396	39%	0.388	S	S	.	.			trans	-63.4	114.5	-177.2	-78.5	-41.3	0	0	0	111.6	Q639 I717 K721 E722 I723	Q639-N719 PolarHBondContact OE1-OD1 3.33Å; I717-N719 HydrophobicContact CG2-CB 4.35Å; N719-K721 VanDerWaalsContact C-N 3.32Å; N719-K721 PolarHBondContact O-N 3.08Å; N719-E722 HydrophobicContact CB-CB 3.65Å; N719-E722 WeakPolarHBondContact CB-OE2 3.23Å; N719-E722 PolarHBondContact ND2-OE2 3.45Å; N719-E722 WeakPolarHBondContact O-CB 3.5Å; N719-E722 PolarHBondContact O-N 2.95Å; N719-I723 WeakPolarHBondContact O-CG1 3.27Å; N719-I723 PolarHBondContact O-N 2.89Å
720	P	87.6	Confident	80.8	Confident	40 Å²	40	80.5 Å²	80.5	26%	0.26	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-35.9	-174.3	-27.5	36.7	0	0	0	114.5	V643 L718 E722 A724	V643-P720 HydrophobicContact CG2-CG 3.82Å; L718-P720 VanDerWaalsContact O-CD 3.25Å; L718-P720 WeakPolarHBondContact O-CD 3.36Å; P720-E722 VanDerWaalsContact C-N 3.25Å; P720-E722 PolarHBondContact O-N 3.37Å; P720-A724 VanDerWaalsContact O-CB 3.28Å; P720-A724 WeakPolarHBondContact O-CB 3.37Å; P720-A724 PolarHBondContact O-N 2.92Å
721	K	88.4	Confident	81.8	Confident	175 Å²	175	81.1 Å²	81.1	76%	0.761	39%	0.385	S	S	*	.	H	α-helix	trans	-66.6	-27.6	176.3	-66.4	-178.1	179.9	177.7	0	112.6	N719 R725	N719-K721 VanDerWaalsContact C-N 3.32Å; N719-K721 PolarHBondContact O-N 3.08Å; K721-R725 WeakPolarHBondContact O-CD 3.31Å; K721-R725 VanDerWaalsContact O-CG 3.24Å; K721-R725 WeakPolarHBondContact O-CG 3.44Å; K721-R725 PolarHBondContact O-N 3.4Å
722	E	88.6	Confident	83.1	Confident	82 Å²	82	76.6 Å²	76.6	38%	0.383	36%	0.359	S	S	.	.	H	α-helix	trans	-87.6	-45.9	-176	-163.2	170.1	-170.1	0	0	110.8	I717 N719 P720 A724 R725 H726	I717-E722 HydrophobicContact CD1-CG 4.35Å; I717-E722 HydrophobicContact CG2-CB 3.82Å; I717-E722 HydrophobicContact CG2-CG 3.77Å; N719-E722 HydrophobicContact CB-CB 3.65Å; N719-E722 WeakPolarHBondContact CB-OE2 3.23Å; N719-E722 PolarHBondContact ND2-OE2 3.45Å; N719-E722 WeakPolarHBondContact O-CB 3.5Å; N719-E722 PolarHBondContact O-N 2.95Å; P720-E722 VanDerWaalsContact C-N 3.25Å; P720-E722 PolarHBondContact O-N 3.37Å; E722-A724 VanDerWaalsContact C-N 3.29Å; E722-A724 PolarHBondContact O-N 3.45Å; E722-R725 PolarHBondContact O-N 2.75Å; E722-H726 WeakPolarHBondContact O-CB 3.38Å; E722-H726 PolarHBondContact O-N 2.91Å
723	I	89.4	Confident	84.3	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-49.3	-51.8	167.2	-65.2	164.7	0	0	0	109.9	T705 I707 I717 L718 N719 R725 H726 Y727	T705-I723 VanDerWaalsContact O-CG2 3.31Å; T705-I723 WeakPolarHBondContact O-CG2 3.34Å; I707-I723 HydrophobicContact CD1-CB 4.48Å; I707-I723 HydrophobicContact CD1-CG2 4.24Å; I707-I723 HydrophobicContact CG1-CG1 4.41Å; I707-I723 HydrophobicContact CG1-CG2 4.42Å; I717-I723 HydrophobicContact CG2-CG1 4.21Å; L718-I723 WeakPolarHBondContact O-CD1 3.27Å; N719-I723 WeakPolarHBondContact O-CG1 3.27Å; N719-I723 PolarHBondContact O-N 2.89Å; I723-R725 PolarHBondContact O-N 2.95Å; I723-H726 PolarHBondContact O-N 3.22Å; I723-Y727 WeakPolarHBondContact O-CB 3.44Å; I723-Y727 PolarHBondContact O-N 3.46Å
724	A	91.1	Very high	85.5	Confident	23 Å²	23	75 Å²	75	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-60.3	-47.4	-179.6	0	0	0	0	0	112.8	F703 P720 E722 H726 Y727 L728	F703-A724 HydrophobicContact CD1-CB 3.79Å; F703-A724 HydrophobicContact CE1-CB 4.02Å; P720-A724 VanDerWaalsContact O-CB 3.28Å; P720-A724 WeakPolarHBondContact O-CB 3.37Å; P720-A724 PolarHBondContact O-N 2.92Å; E722-A724 VanDerWaalsContact C-N 3.29Å; E722-A724 PolarHBondContact O-N 3.45Å; A724-H726 VanDerWaalsContact C-N 3.35Å; A724-H726 PolarHBondContact O-N 3.39Å; A724-Y727 PolarHBondContact O-N 3.41Å; A724-L728 VanDerWaalsContact O-CB 3.27Å; A724-L728 WeakPolarHBondContact O-CB 3.39Å; A724-L728 WeakPolarHBondContact O-CD1 3.44Å; A724-L728 WeakPolarHBondContact O-CG 3.39Å; A724-L728 PolarHBondContact O-N 3.02Å
725	R	91.9	Very high	86.6	Confident	188 Å²	188	68.5 Å²	68.5	71%	0.709	32%	0.322	S	S	*	.	H	α-helix	trans	-60	-43.7	176.4	-75.9	168.2	178.9	176.2	-1.8	112	K721 E722 I723 K729	K721-R725 WeakPolarHBondContact O-CD 3.31Å; K721-R725 VanDerWaalsContact O-CG 3.24Å; K721-R725 WeakPolarHBondContact O-CG 3.44Å; K721-R725 PolarHBondContact O-N 3.4Å; E722-R725 PolarHBondContact O-N 2.75Å; I723-R725 PolarHBondContact O-N 2.95Å; R725-K729 VanDerWaalsContact O-CB 3.31Å; R725-K729 WeakPolarHBondContact O-CB 3.24Å; R725-K729 PolarHBondContact O-N 3.06Å; R725-K729 VanDerWaalsContact O-N 3.09Å
726	H	89.3	Confident	87.6	Confident	97 Å²	97	68.9 Å²	68.9	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-67.7	-42.3	-178.7	-167.1	-100.6	0	0	0	111.9	I707 E722 I723 A724 K729 S730	I707-H726 HydrophobicContact CD1-CB 3.94Å; E722-H726 WeakPolarHBondContact O-CB 3.38Å; E722-H726 PolarHBondContact O-N 2.91Å; I723-H726 PolarHBondContact O-N 3.22Å; A724-H726 VanDerWaalsContact C-N 3.35Å; A724-H726 PolarHBondContact O-N 3.39Å; H726-K729 PolarHBondContact O-N 2.9Å; H726-S730 WeakPolarHBondContact O-CB 3.48Å; H726-S730 PolarHBondContact O-N 3.46Å; H726-S730 PolarHBondContact O-OG 3.2Å
727	Y	90.4	Very high	87.8	Confident	16 Å²	16	72.2 Å²	72.2	6%	0.063	34%	0.34	C	S	.	.	H	α-helix	trans	-68	-43.8	177.4	-177.3	-131.6	0	0	0	112.6	I699 K702 F703 I723 A724 K729 S730 W731 F732 D735	I699-Y727 HydrophobicContact CG2-CE1 4.16Å; K702-Y727 HydrophobicContact CB-CD1 4.34Å; K702-Y727 HydrophobicContact CB-CE1 3.87Å; K702-Y727 HydrophobicContact CB-CE2 4.34Å; K702-Y727 HydrophobicContact CD-CE2 4.04Å; K702-Y727 WeakPolarHBondContact CD-OH 3.47Å; F703-Y727 HydrophobicContact CD1-CD1 4.07Å; F703-Y727 HydrophobicContact CD2-CD1 4.24Å; F703-Y727 HydrophobicContact CD2-CE1 4.19Å; F703-Y727 AromaticContact CE1-CD1 3.87Å; F703-Y727 HydrophobicContact CE1-CD1 3.87Å; F703-Y727 HydrophobicContact CE2-CD1 4.04Å; F703-Y727 AromaticContact CE2-CE1 3.96Å; F703-Y727 HydrophobicContact CE2-CE1 3.96Å; F703-Y727 HydrophobicContact CG-CD1 4.24Å; F703-Y727 AromaticContact CZ-CD1 3.85Å; F703-Y727 HydrophobicContact CZ-CD1 3.85Å; F703-Y727 HydrophobicContact CZ-CE1 4.17Å; I723-Y727 WeakPolarHBondContact O-CB 3.44Å; I723-Y727 PolarHBondContact O-N 3.46Å; A724-Y727 PolarHBondContact O-N 3.41Å; Y727-K729 VanDerWaalsContact C-N 3.32Å; Y727-K729 PolarHBondContact O-N 3.29Å; Y727-S730 PolarHBondContact O-N 3.22Å; Y727-S730 PolarHBondContact O-OG 2.72Å; Y727-W731 HydrophobicContact CD2-CB 4.31Å; Y727-W731 HydrophobicContact CE2-CB 4.04Å; Y727-W731 PolarHBondContact O-N 3.31Å; Y727-F732 HydrophobicContact CD1-CB 4.29Å; Y727-F732 HydrophobicContact CD1-CD2 4.39Å; Y727-F732 HydrophobicContact CE1-CB 4.23Å; Y727-F732 AromaticContact CE1-CD2 3.92Å; Y727-F732 HydrophobicContact CE1-CD2 3.92Å; Y727-F732 HydrophobicContact CG-CB 4.48Å; Y727-F732 WeakPolarHBondContact O-CB 3.4Å; Y727-F732 PolarHBondContact O-N 2.95Å; Y727-F732 VanDerWaalsContact O-N 3.1Å; Y727-D735 WeakPolarHBondContact CE2-OD2 3.41Å; Y727-D735 VanDerWaalsContact OH-CB 3.24Å; Y727-D735 WeakPolarHBondContact OH-CB 3.3Å; Y727-D735 PolarHBondContact OH-OD2 3.39Å
728	L	91.6	Very high	87.9	Confident	84 Å²	84	70.6 Å²	70.6	44%	0.44	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-40.1	174.8	-75.5	167.1	0	0	0	112.7	F703 A724 S730 F732	F703-L728 HydrophobicContact CE1-CD1 4.36Å; F703-L728 HydrophobicContact CE1-CD2 4.25Å; F703-L728 HydrophobicContact CE1-CG 3.95Å; F703-L728 HydrophobicContact CZ-CD2 3.93Å; F703-L728 HydrophobicContact CZ-CG 4.15Å; A724-L728 VanDerWaalsContact O-CB 3.27Å; A724-L728 WeakPolarHBondContact O-CB 3.39Å; A724-L728 WeakPolarHBondContact O-CD1 3.44Å; A724-L728 WeakPolarHBondContact O-CG 3.39Å; A724-L728 PolarHBondContact O-N 3.02Å; L728-S730 VanDerWaalsContact C-N 3.31Å; L728-S730 PolarHBondContact O-N 2.9Å; L728-F732 HydrophobicContact CD2-CB 4.3Å; L728-F732 HydrophobicContact CD2-CD1 3.64Å; L728-F732 HydrophobicContact CD2-CD2 4.27Å; L728-F732 HydrophobicContact CD2-CE1 4Å; L728-F732 HydrophobicContact CD2-CG 3.79Å; L728-F732 HydrophobicContact CD2-CZ 4.46Å
729	K	90.4	Very high	87.9	Confident	190 Å²	190	70.6 Å²	70.6	83%	0.826	33%	0.332	S	S	*	.	H	α-helix	trans	-72.5	-20.5	179.5	-173.9	178.5	176.1	-173	0	113.7	R725 H726 Y727	R725-K729 VanDerWaalsContact O-CB 3.31Å; R725-K729 WeakPolarHBondContact O-CB 3.24Å; R725-K729 PolarHBondContact O-N 3.06Å; R725-K729 VanDerWaalsContact O-N 3.09Å; H726-K729 PolarHBondContact O-N 2.9Å; Y727-K729 VanDerWaalsContact C-N 3.32Å; Y727-K729 PolarHBondContact O-N 3.29Å
730	S	83.1	Confident	87.8	Confident	53 Å²	53	69.2 Å²	69.2	37%	0.371	32%	0.324	S	S	.	.	H	α-helix	trans	-112.6	-83.2	-170	55.8	0	0	0	0	113.2	H726 Y727 L728	H726-S730 WeakPolarHBondContact O-CB 3.48Å; H726-S730 PolarHBondContact O-N 3.46Å; H726-S730 PolarHBondContact O-OG 3.2Å; Y727-S730 PolarHBondContact O-N 3.22Å; Y727-S730 PolarHBondContact O-OG 2.72Å; L728-S730 VanDerWaalsContact C-N 3.31Å; L728-S730 PolarHBondContact O-N 2.9Å
731	W	84.4	Confident	87.7	Confident	108 Å²	108	69 Å²	69	41%	0.409	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-13.7	-165.1	-65	100.6	0	0	0	114.6	Y727 I733 L734 D735	Y727-W731 HydrophobicContact CD2-CB 4.31Å; Y727-W731 HydrophobicContact CE2-CB 4.04Å; Y727-W731 PolarHBondContact O-N 3.31Å; W731-I733 VanDerWaalsContact C-N 3.3Å; W731-I733 PolarHBondContact O-N 3.36Å; W731-L734 HydrophobicContact CE3-CD1 3.9Å; W731-L734 HydrophobicContact CZ3-CD1 3.93Å; W731-L734 PolarHBondContact O-N 3.1Å; W731-L734 VanDerWaalsContact O-N 3.13Å; W731-D735 PolarHBondContact O-N 3.33Å
732	F	89.3	Confident	87.1	Confident	42 Å²	42	63.6 Å²	63.6	18%	0.184	30%	0.301	C	S	.	.	H	α-helix	trans	-51.8	-43.9	-175.1	171.5	-102.2	0	0	0	113.4	I699 F703 Y727 L728 L734 D735 F736	I699-F732 HydrophobicContact CG2-CD2 4.16Å; I699-F732 HydrophobicContact CG2-CE2 3.96Å; F703-F732 AromaticContact CE2-CD2 3.84Å; F703-F732 HydrophobicContact CE2-CD2 3.84Å; F703-F732 AromaticContact CE2-CE2 3.81Å; F703-F732 HydrophobicContact CE2-CE2 3.81Å; F703-F732 AromaticContact CZ-CD2 3.72Å; F703-F732 HydrophobicContact CZ-CD2 3.72Å; F703-F732 AromaticContact CZ-CE2 3.89Å; F703-F732 HydrophobicContact CZ-CE2 3.89Å; F703-F732 HydrophobicContact CZ-CG 4.49Å; Y727-F732 HydrophobicContact CD1-CB 4.29Å; Y727-F732 HydrophobicContact CD1-CD2 4.39Å; Y727-F732 HydrophobicContact CE1-CB 4.23Å; Y727-F732 AromaticContact CE1-CD2 3.92Å; Y727-F732 HydrophobicContact CE1-CD2 3.92Å; Y727-F732 HydrophobicContact CG-CB 4.48Å; Y727-F732 WeakPolarHBondContact O-CB 3.4Å; Y727-F732 PolarHBondContact O-N 2.95Å; Y727-F732 VanDerWaalsContact O-N 3.1Å; L728-F732 HydrophobicContact CD2-CB 4.3Å; L728-F732 HydrophobicContact CD2-CD1 3.64Å; L728-F732 HydrophobicContact CD2-CD2 4.27Å; L728-F732 HydrophobicContact CD2-CE1 4Å; L728-F732 HydrophobicContact CD2-CG 3.79Å; L728-F732 HydrophobicContact CD2-CZ 4.46Å; F732-L734 VanDerWaalsContact C-N 3.34Å; F732-L734 PolarHBondContact O-N 3.5Å; F732-D735 PolarHBondContact O-N 3.43Å; F732-F736 HydrophobicContact CE1-CB 4.31Å; F732-F736 HydrophobicContact CE1-CG 4.41Å; F732-F736 HydrophobicContact CE2-CB 4.28Å; F732-F736 HydrophobicContact CE2-CD2 4.43Å; F732-F736 HydrophobicContact CZ-CB 4.09Å; F732-F736 HydrophobicContact CZ-CD2 4.04Å; F732-F736 HydrophobicContact CZ-CG 4.05Å; F732-F736 WeakPolarHBondContact O-CB 3.45Å; F732-F736 PolarHBondContact O-N 2.84Å
733	I	87.5	Confident	86.6	Confident	93 Å²	93	60.1 Å²	60.1	48%	0.477	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-41.2	-176.9	-61.5	173.3	0	0	0	111.5	W731 I737	W731-I733 VanDerWaalsContact C-N 3.3Å; W731-I733 PolarHBondContact O-N 3.36Å; I733-I737 HydrophobicContact CG2-CD1 3.8Å; I733-I737 WeakPolarHBondContact O-CB 3.34Å; I733-I737 VanDerWaalsContact O-CG1 3.28Å; I733-I737 WeakPolarHBondContact O-CG1 3.4Å; I733-I737 PolarHBondContact O-N 2.94Å
734	L	84.6	Confident	86.2	Confident	43 Å²	43	62 Å²	62	23%	0.225	29%	0.292	C	S	.	.	H	α-helix	trans	-73.1	-40	179	-67.1	172.6	0	0	0	111.7	W731 F732 S738	W731-L734 HydrophobicContact CE3-CD1 3.9Å; W731-L734 HydrophobicContact CZ3-CD1 3.93Å; W731-L734 PolarHBondContact O-N 3.1Å; W731-L734 VanDerWaalsContact O-N 3.13Å; F732-L734 VanDerWaalsContact C-N 3.34Å; F732-L734 PolarHBondContact O-N 3.5Å; L734-S738 VanDerWaalsContact O-CB 3.26Å; L734-S738 WeakPolarHBondContact O-CB 3.44Å; L734-S738 PolarHBondContact O-N 3.23Å; L734-S738 VanDerWaalsContact O-N 3.16Å; L734-S738 PolarHBondContact O-OG 3.48Å
735	D	87.2	Confident	85.7	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-41.9	174.3	-75.6	-9.8	0	0	0	110.7	I699 K702 Y727 W731 F732 S738 S739 R784 R787	I699-D735 HydrophobicContact CD1-CB 4.42Å; I699-D735 HydrophobicContact CG1-CB 4.24Å; K702-D735 IonicContact NZ-OD1 3.35Å; K702-D735 IonicContact NZ-OD2 2.85Å; K702-D735 PolarHBondContact NZ-OD2 3.04Å; Y727-D735 WeakPolarHBondContact CE2-OD2 3.41Å; Y727-D735 VanDerWaalsContact OH-CB 3.24Å; Y727-D735 WeakPolarHBondContact OH-CB 3.3Å; Y727-D735 PolarHBondContact OH-OD2 3.39Å; W731-D735 PolarHBondContact O-N 3.33Å; F732-D735 PolarHBondContact O-N 3.43Å; D735-S738 WeakPolarHBondContact CA-OG 3.37Å; D735-S738 PolarHBondContact O-N 3.08Å; D735-S738 PolarHBondContact O-OG 3.46Å; D735-S738 VanDerWaalsContact O-OG 3.07Å; D735-S739 WeakPolarHBondContact O-CB 3.42Å; D735-S739 PolarHBondContact O-N 2.9Å; D735-S739 VanDerWaalsContact O-N 3.09Å; D735-S739 PolarHBondContact O-OG 3.09Å; D735-R784 PolarHBondContact O-NH2 3.31Å; D735-R784 WeakPolarHBondContact OD1-CG 3.42Å; D735-R784 IonicContact OD1-CZ 3.55Å; D735-R784 IonicContact OD1-NE 3.46Å; D735-R784 PolarHBondContact OD1-NE 3.46Å; D735-R784 VanDerWaalsContact OD1-NE 3.14Å; D735-R787 IonicContact OD1-CZ 3.76Å; D735-R787 IonicContact OD1-NH1 3.98Å; D735-R787 IonicContact OD1-NH2 2.74Å; D735-R787 PolarHBondContact OD1-NH2 2.78Å; D735-R787 IonicContact OD2-NH1 2.61Å; D735-R787 IonicContact OD2-NH2 2.63Å
736	F	89.2	Confident	85	Confident	102 Å²	102	58.1 Å²	58.1	45%	0.447	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-54.8	178.4	-176.7	-115	0	0	0	112.4	F732 S738 S739 I740	F732-F736 HydrophobicContact CE1-CB 4.31Å; F732-F736 HydrophobicContact CE1-CG 4.41Å; F732-F736 HydrophobicContact CE2-CB 4.28Å; F732-F736 HydrophobicContact CE2-CD2 4.43Å; F732-F736 HydrophobicContact CZ-CB 4.09Å; F732-F736 HydrophobicContact CZ-CD2 4.04Å; F732-F736 HydrophobicContact CZ-CG 4.05Å; F732-F736 WeakPolarHBondContact O-CB 3.45Å; F732-F736 PolarHBondContact O-N 2.84Å; F736-S738 PolarHBondContact O-N 2.66Å; F736-S739 PolarHBondContact O-N 3.35Å; F736-I740 HydrophobicContact CD1-CD1 3.88Å; F736-I740 HydrophobicContact CD2-CD1 4.23Å; F736-I740 HydrophobicContact CE1-CD1 3.64Å; F736-I740 HydrophobicContact CE2-CD1 4Å; F736-I740 HydrophobicContact CE2-CG1 4.49Å; F736-I740 HydrophobicContact CG-CD1 4.17Å; F736-I740 HydrophobicContact CZ-CD1 3.71Å; F736-I740 WeakPolarHBondContact O-CG1 3.33Å; F736-I740 PolarHBondContact O-N 3.39Å
737	I	85.4	Confident	84.3	Confident	70 Å²	70	56.1 Å²	56.1	36%	0.359	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-37	178.6	-67.6	168.1	0	0	0	111.2	I733 S739 L780	I733-I737 HydrophobicContact CG2-CD1 3.8Å; I733-I737 WeakPolarHBondContact O-CB 3.34Å; I733-I737 VanDerWaalsContact O-CG1 3.28Å; I733-I737 WeakPolarHBondContact O-CG1 3.4Å; I733-I737 PolarHBondContact O-N 2.94Å; I737-S739 VanDerWaalsContact C-N 3.33Å; I737-S739 PolarHBondContact O-N 3.38Å; I737-L780 HydrophobicContact CG2-CD1 4.11Å
738	S	85.1	Confident	83.8	Confident	1 Å²	1	60 Å²	60	1%	0.007	29%	0.291	C	S	.	.	H	α-helix	trans	-79.4	-9.6	179.6	63.3	0	0	0	0	114.7	L734 D735 F736 R781 R784	L734-S738 VanDerWaalsContact O-CB 3.26Å; L734-S738 WeakPolarHBondContact O-CB 3.44Å; L734-S738 PolarHBondContact O-N 3.23Å; L734-S738 VanDerWaalsContact O-N 3.16Å; L734-S738 PolarHBondContact O-OG 3.48Å; D735-S738 WeakPolarHBondContact CA-OG 3.37Å; D735-S738 PolarHBondContact O-N 3.08Å; D735-S738 PolarHBondContact O-OG 3.46Å; D735-S738 VanDerWaalsContact O-OG 3.07Å; F736-S738 PolarHBondContact O-N 2.66Å; S738-R781 VanDerWaalsContact O-CZ 3.27Å; S738-R781 PolarHBondContact O-NE 3.3Å; S738-R781 PolarHBondContact O-NH2 3.29Å; S738-R784 PolarHBondContact OG-NH2 3.15Å
739	S	86.1	Confident	83.2	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	30%	0.295	C	S	.	.	H	α-helix	trans	-97.5	-13.8	176.4	-74	0	0	0	0	114.5	F695 I699 D735 F736 I737 R784	F695-S739 VanDerWaalsContact C-OG 3.27Å; F695-S739 PolarHBondContact O-OG 3.48Å; I699-S739 WeakPolarHBondContact CD1-OG 3.47Å; D735-S739 WeakPolarHBondContact O-CB 3.42Å; D735-S739 PolarHBondContact O-N 2.9Å; D735-S739 VanDerWaalsContact O-N 3.09Å; D735-S739 PolarHBondContact O-OG 3.09Å; F736-S739 PolarHBondContact O-N 3.35Å; I737-S739 VanDerWaalsContact C-N 3.33Å; I737-S739 PolarHBondContact O-N 3.38Å; S739-R784 PolarHBondContact OG-NH1 3.25Å; S739-R784 PolarHBondContact OG-NH2 3.26Å
740	I	84.3	Confident	82.2	Confident	44 Å²	44	54.9 Å²	54.9	23%	0.226	27%	0.268	C	S	.	.	S	Bend	trans	-87.4	129.8	-174.4	-62.8	159	0	0	0	110.9	F736 M742	F736-I740 HydrophobicContact CD1-CD1 3.88Å; F736-I740 HydrophobicContact CD2-CD1 4.23Å; F736-I740 HydrophobicContact CE1-CD1 3.64Å; F736-I740 HydrophobicContact CE2-CD1 4Å; F736-I740 HydrophobicContact CE2-CG1 4.49Å; F736-I740 HydrophobicContact CG-CD1 4.17Å; F736-I740 HydrophobicContact CZ-CD1 3.71Å; F736-I740 WeakPolarHBondContact O-CG1 3.33Å; F736-I740 PolarHBondContact O-N 3.39Å; I740-M742 HydrophobicContact CB-CG 4.38Å; I740-M742 HydrophobicContact CB-SD 4.38Å; I740-M742 HydrophobicContact CG2-CG 3.99Å; I740-M742 HydrophobicContact CG2-SD 3.58Å; I740-M742 VanDerWaalsContact CG2-SD 3.58Å; I740-M742 PolarHBondContact O-N 3.37Å
741	P	83.9	Confident	81.5	Confident	35 Å²	35	60.4 Å²	60.4	23%	0.227	29%	0.285	C	S	.	.			trans	-74.6	74.8	169.5	31.5	-34.9	0	0	0	111	D743 Y744 L745	P741-D743 VanDerWaalsContact C-OD1 3.26Å; P741-D743 WeakPolarHBondContact CA-OD1 3.34Å; P741-D743 PolarHBondContact O-N 2.97Å; P741-Y744 HydrophobicContact CB-CD2 3.66Å; P741-Y744 HydrophobicContact CB-CE2 4.47Å; P741-Y744 HydrophobicContact CB-CG 4.31Å; P741-Y744 PolarHBondContact O-N 3.18Å; P741-L745 WeakPolarHBondContact O-CB 3.42Å; P741-L745 PolarHBondContact O-N 3.1Å
742	M	76.2	Confident	80.3	Confident	63 Å²	63	62.7 Å²	62.7	31%	0.31	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-27.7	179.4	-72.3	-58.6	-56.9	0	0	112.7	I740 L745 Y746 L774 L777	I740-M742 HydrophobicContact CB-CG 4.38Å; I740-M742 HydrophobicContact CB-SD 4.38Å; I740-M742 HydrophobicContact CG2-CG 3.99Å; I740-M742 HydrophobicContact CG2-SD 3.58Å; I740-M742 VanDerWaalsContact CG2-SD 3.58Å; I740-M742 PolarHBondContact O-N 3.37Å; M742-L745 HydrophobicContact CE-CD2 4.48Å; M742-L745 HydrophobicContact SD-CD2 4.13Å; M742-Y746 WeakPolarHBondContact O-CB 3.49Å; M742-Y746 PolarHBondContact O-N 3.36Å; M742-L774 HydrophobicContact CB-CB 4.18Å; M742-L777 HydrophobicContact CG-CD1 4.27Å
743	D	77.3	Confident	78.8	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-62.8	-57.1	171.7	35.6	30.1	0	0	0	112.1	P741 L745 Y746 L747 S775 R778	P741-D743 VanDerWaalsContact C-OD1 3.26Å; P741-D743 WeakPolarHBondContact CA-OD1 3.34Å; P741-D743 PolarHBondContact O-N 2.97Å; D743-L745 VanDerWaalsContact C-N 3.34Å; D743-L745 PolarHBondContact O-N 3.14Å; D743-Y746 PolarHBondContact O-N 2.92Å; D743-L747 WeakPolarHBondContact O-CG 3.48Å; D743-L747 PolarHBondContact O-N 2.77Å; D743-S775 WeakPolarHBondContact CB-OG 3.16Å; D743-S775 WeakPolarHBondContact OD2-CA 3.31Å; D743-S775 WeakPolarHBondContact OD2-CB 3.18Å; D743-S775 PolarHBondContact OD2-OG 3.25Å; D743-R778 IonicContact OD1-CZ 3Å; D743-R778 IonicContact OD1-NE 2.65Å; D743-R778 IonicContact OD1-NH2 2.79Å; D743-R778 PolarHBondContact OD1-NH2 3.2Å; D743-R778 IonicContact OD2-CZ 3.22Å; D743-R778 IonicContact OD2-NE 2.72Å; D743-R778 PolarHBondContact OD2-NE 2.92Å; D743-R778 IonicContact OD2-NH2 2.88Å; D743-R778 PolarHBondContact OD2-NH2 3.31Å; D743-R778 VanDerWaalsContact OD2-NH2 3.12Å
744	Y	81.1	Confident	77.1	Confident	41 Å²	41	67.2 Å²	67.2	16%	0.161	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-37.1	177.7	-58	-39.6	0	0	0	112.2	I685 N688 P741 L747 I748	I685-Y744 HydrophobicContact CG1-CE1 4.34Å; N688-Y744 HydrophobicContact CB-CE2 4.03Å; N688-Y744 WeakPolarHBondContact CB-OH 3.48Å; N688-Y744 PolarHBondContact ND2-OH 3.07Å; P741-Y744 HydrophobicContact CB-CD2 3.66Å; P741-Y744 HydrophobicContact CB-CE2 4.47Å; P741-Y744 HydrophobicContact CB-CG 4.31Å; P741-Y744 PolarHBondContact O-N 3.18Å; Y744-L747 HydrophobicContact CD1-CD1 4.46Å; Y744-L747 PolarHBondContact O-N 3.26Å; Y744-I748 WeakPolarHBondContact O-CB 3.42Å; Y744-I748 WeakPolarHBondContact O-CD1 3.43Å; Y744-I748 VanDerWaalsContact O-CG1 3.22Å; Y744-I748 WeakPolarHBondContact O-CG1 3.45Å; Y744-I748 PolarHBondContact O-N 2.88Å
745	L	81.4	Confident	75.6	Confident	69 Å²	69	75.7 Å²	75.7	36%	0.361	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-45.4	176.4	-173.1	62.6	0	0	0	111.9	P741 M742 D743 I748 F749	P741-L745 WeakPolarHBondContact O-CB 3.42Å; P741-L745 PolarHBondContact O-N 3.1Å; M742-L745 HydrophobicContact CE-CD2 4.48Å; M742-L745 HydrophobicContact SD-CD2 4.13Å; D743-L745 VanDerWaalsContact C-N 3.34Å; D743-L745 PolarHBondContact O-N 3.14Å; L745-I748 PolarHBondContact O-N 3.16Å; L745-F749 HydrophobicContact CD1-CD2 4.08Å; L745-F749 HydrophobicContact CD1-CE2 3.49Å; L745-F749 VanDerWaalsContact CD1-CE2 3.49Å; L745-F749 HydrophobicContact CD1-CZ 4.2Å; L745-F749 HydrophobicContact CD2-CE2 4.32Å; L745-F749 HydrophobicContact CG-CD2 4Å; L745-F749 HydrophobicContact CG-CE2 3.67Å; L745-F749 WeakPolarHBondContact O-CD2 3.25Å; L745-F749 PolarHBondContact O-N 2.83Å; L745-F749 VanDerWaalsContact O-N 3.09Å
746	Y	76.7	Confident	73.6	Confident	60 Å²	60	81.7 Å²	81.7	24%	0.235	38%	0.384	C	S	.	.	H	α-helix	trans	-65.6	-39.8	177.4	-178.8	-119.9	0	0	0	112.5	M742 D743 N750 I767 L770 A771 L774	M742-Y746 WeakPolarHBondContact O-CB 3.49Å; M742-Y746 PolarHBondContact O-N 3.36Å; D743-Y746 PolarHBondContact O-N 2.92Å; Y746-N750 WeakPolarHBondContact CD2-ND2 3.27Å; Y746-N750 WeakPolarHBondContact CE1-ND2 3.33Å; Y746-N750 WeakPolarHBondContact CE2-ND2 3.41Å; Y746-N750 PolarHBondContact O-N 2.97Å; Y746-N750 VanDerWaalsContact O-N 3.11Å; Y746-N750 PolarHBondContact O-ND2 3.38Å; Y746-N750 PolarHBondContact OH-ND2 3.33Å; Y746-I767 HydrophobicContact CD1-CG2 4.5Å; Y746-I767 HydrophobicContact CE1-CB 4.46Å; Y746-I767 HydrophobicContact CE1-CG2 3.81Å; Y746-L770 HydrophobicContact CE1-CB 4.26Å; Y746-L770 HydrophobicContact CE1-CD2 4.17Å; Y746-L770 HydrophobicContact CE1-CG 4.29Å; Y746-A771 HydrophobicContact CD1-CB 4.4Å; Y746-L774 HydrophobicContact CD1-CD1 4.15Å; Y746-L774 HydrophobicContact CG-CD1 4.07Å
747	L	75.1	Confident	71.5	Confident	55 Å²	55	85.7 Å²	85.7	29%	0.288	40%	0.404	S	S	.	.	H	α-helix	trans	-64.2	-38.7	173.9	-72	168.5	0	0	0	112.4	D743 Y744 K751 L768	D743-L747 WeakPolarHBondContact O-CG 3.48Å; D743-L747 PolarHBondContact O-N 2.77Å; Y744-L747 HydrophobicContact CD1-CD1 4.46Å; Y744-L747 PolarHBondContact O-N 3.26Å; L747-K751 VanDerWaalsContact O-CB 3.25Å; L747-K751 WeakPolarHBondContact O-CB 3.47Å; L747-K751 PolarHBondContact O-N 2.85Å; L747-K751 VanDerWaalsContact O-N 3.12Å; L747-L768 HydrophobicContact CD2-CD2 4.47Å
748	I	79.3	Confident	69.6	Low	99 Å²	99	89.7 Å²	89.7	51%	0.508	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-42.8	178.3	-72	164.2	0	0	0	111.7	Y744 L745 K752	Y744-I748 WeakPolarHBondContact O-CB 3.42Å; Y744-I748 WeakPolarHBondContact O-CD1 3.43Å; Y744-I748 VanDerWaalsContact O-CG1 3.22Å; Y744-I748 WeakPolarHBondContact O-CG1 3.45Å; Y744-I748 PolarHBondContact O-N 2.88Å; L745-I748 PolarHBondContact O-N 3.16Å; I748-K752 PolarHBondContact O-N 3.32Å
749	F	78.8	Confident	67.7	Low	120 Å²	120	99.8 Å²	99.8	53%	0.526	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-55	177	-77	-59.8	0	0	0	111.7	L745 K751 K752 D753	L745-F749 HydrophobicContact CD1-CD2 4.08Å; L745-F749 HydrophobicContact CD1-CE2 3.49Å; L745-F749 VanDerWaalsContact CD1-CE2 3.49Å; L745-F749 HydrophobicContact CD1-CZ 4.2Å; L745-F749 HydrophobicContact CD2-CE2 4.32Å; L745-F749 HydrophobicContact CG-CD2 4Å; L745-F749 HydrophobicContact CG-CE2 3.67Å; L745-F749 WeakPolarHBondContact O-CD2 3.25Å; L745-F749 PolarHBondContact O-N 2.83Å; L745-F749 VanDerWaalsContact O-N 3.09Å; F749-K751 PolarHBondContact O-N 3.28Å; F749-K751 VanDerWaalsContact O-N 3.09Å; F749-K752 PolarHBondContact O-N 3.28Å; F749-D753 PolarHBondContact O-N 3.44Å
750	N	70.8	Confident	66.2	Low	46 Å²	46	102.4 Å²	102.4	25%	0.246	48%	0.482	C	S	.	.	H	α-helix	trans	-59.8	-26.8	180	-70.2	-35	0	0	0	113.5	Y746	Y746-N750 WeakPolarHBondContact CD2-ND2 3.27Å; Y746-N750 WeakPolarHBondContact CE1-ND2 3.33Å; Y746-N750 WeakPolarHBondContact CE2-ND2 3.41Å; Y746-N750 PolarHBondContact O-N 2.97Å; Y746-N750 VanDerWaalsContact O-N 3.11Å; Y746-N750 PolarHBondContact O-ND2 3.38Å; Y746-N750 PolarHBondContact OH-ND2 3.33Å
751	K	67.2	Low	64.9	Low	168 Å²	168	103.4 Å²	103.4	73%	0.73	50%	0.497	S	S	*	.	H	α-helix	trans	-73.9	-27.4	175.6	-173.4	171.8	-179.1	178.7	0	113.1	L747 F749	L747-K751 VanDerWaalsContact O-CB 3.25Å; L747-K751 WeakPolarHBondContact O-CB 3.47Å; L747-K751 PolarHBondContact O-N 2.85Å; L747-K751 VanDerWaalsContact O-N 3.12Å; F749-K751 PolarHBondContact O-N 3.28Å; F749-K751 VanDerWaalsContact O-N 3.09Å
752	K	60.3	Low	63.9	Low	156 Å²	156	103.6 Å²	103.6	68%	0.678	50%	0.504	S	S	*	.	H	α-helix	trans	-73.4	-39.3	177.1	-80.2	-175.5	166	-176	0	112.4	I748 F749 H754	I748-K752 PolarHBondContact O-N 3.32Å; F749-K752 PolarHBondContact O-N 3.28Å; K752-H754 PolarHBondContact O-N 3.25Å
753	D	56.4	Low	63.2	Low	130 Å²	130	107.7 Å²	107.7	70%	0.695	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-7.6	-173.8	-57.8	-25.7	0	0	0	113.6	F749	F749-D753 PolarHBondContact O-N 3.44Å
754	H	52.5	Low	62.6	Low	101 Å²	101	110.6 Å²	110.6	47%	0.468	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	33.3	-166.9	-113.2	-43.9	0	0	0	116.4	K752 N756	K752-H754 PolarHBondContact O-N 3.25Å; H754-N756 PolarHBondContact ND1-O 3.4Å; H754-N756 VanDerWaalsContact ND1-O 3.14Å; H754-N756 PolarHBondContact O-N 2.96Å
755	Y	52.4	Low	61.8	Low	220 Å²	220	112.8 Å²	112.8	86%	0.863	55%	0.549	S	S	*	.	S	Bend	trans	-59	-20.1	161.9	-103.9	-88.6	0	0	0	112.7
756	N	45.4	Very low	61.1	Low	127 Å²	127	118.2 Å²	118.2	68%	0.679	56%	0.564	S	S	*	*	S	Bend	trans	-98.2	99.7	177.6	-66.8	-14.7	0	0	0	113	H754 F758	H754-N756 PolarHBondContact ND1-O 3.4Å; H754-N756 VanDerWaalsContact ND1-O 3.14Å; H754-N756 PolarHBondContact O-N 2.96Å; N756-F758 PolarHBondContact O-N 3.35Å; N756-F758 VanDerWaalsContact O-N 3.11Å
757	Q	46.4	Very low	60.7	Low	186 Å²	186	117.5 Å²	117.5	87%	0.869	56%	0.564	S	S	*	*				56	29.2	126.1	-143.6	-175.7	12.7	0	0	121.8
758	F	45.7	Very low	60.4	Low	154 Å²	154	118.1 Å²	118.1	68%	0.675	57%	0.567	S	S	*	*			trans	-130.4	77.8	170.2	-80.7	-78.8	0	0	0	115.3	N756 S760	N756-F758 PolarHBondContact O-N 3.35Å; N756-F758 VanDerWaalsContact O-N 3.11Å; F758-S760 VanDerWaalsContact C-N 3.26Å; F758-S760 PolarHBondContact O-N 2.96Å
759	F	45.3	Very low	60	Low	212 Å²	212	116.3 Å²	116.3	93%	0.93	55%	0.554	S	S	*	*			trans	-68.3	80.1	161.9	-97.9	-90	0	0	0	111.2
760	S	54.2	Low	59.7	Low	57 Å²	57	114.3 Å²	114.3	40%	0.399	55%	0.549	S	S	.	.			trans	-104.7	98.1	160.5	-173.9	0	0	0	0	108.2	F758 G762 R763 T764	F758-S760 VanDerWaalsContact C-N 3.26Å; F758-S760 PolarHBondContact O-N 2.96Å; S760-G762 PolarHBondContact O-N 2.96Å; S760-G762 VanDerWaalsContact O-N 3.08Å; S760-R763 WeakPolarHBondContact O-CB 3.43Å; S760-R763 PolarHBondContact O-N 3.28Å; S760-T764 PolarHBondContact O-N 3.23Å
761	A	57.4	Low	59.8	Low	65 Å²	65	112.5 Å²	112.5	54%	0.537	54%	0.54	S	S	.	.	H	α-helix	trans	-53.4	-35.3	-172.9	0	0	0	0	0	113	R763 T764 L765	A761-R763 VanDerWaalsContact C-N 3.28Å; A761-R763 PolarHBondContact O-N 3.45Å; A761-T764 PolarHBondContact O-N 3.46Å; A761-L765 WeakPolarHBondContact O-CG 3.49Å; A761-L765 PolarHBondContact O-N 3.46Å
762	G	61.7	Low	60	Low	38 Å²	38	105.4 Å²	105.4	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-23.8	175	0	0	0	0	0	115.1	S760 R766	S760-G762 PolarHBondContact O-N 2.96Å; S760-G762 VanDerWaalsContact O-N 3.08Å; G762-R766 WeakPolarHBondContact O-CD 3.21Å; G762-R766 VanDerWaalsContact O-CG 3.24Å; G762-R766 WeakPolarHBondContact O-CG 3.44Å; G762-R766 PolarHBondContact O-N 3.32Å
763	R	62.3	Low	60.7	Low	150 Å²	150	102.1 Å²	102.1	57%	0.566	50%	0.498	S	S	*	.	H	α-helix	trans	-76.5	-47.1	169.7	-71.3	-173.7	177.3	172.2	-0	110.8	S760 A761 L765 R766 I767	S760-R763 WeakPolarHBondContact O-CB 3.43Å; S760-R763 PolarHBondContact O-N 3.28Å; A761-R763 VanDerWaalsContact C-N 3.28Å; A761-R763 PolarHBondContact O-N 3.45Å; R763-L765 VanDerWaalsContact C-N 3.32Å; R763-L765 PolarHBondContact O-N 2.95Å; R763-R766 WeakPolarHBondContact O-CB 3.33Å; R763-R766 PolarHBondContact O-N 2.97Å; R763-I767 WeakPolarHBondContact O-CG1 3.46Å; R763-I767 PolarHBondContact O-N 2.87Å
764	T	63.8	Low	61.6	Low	68 Å²	68	97.9 Å²	97.9	42%	0.417	48%	0.475	S	S	.	.	H	α-helix	trans	-57.9	-43.6	177.5	-46.1	0	0	0	0	111.7	S760 A761 R766 I767 L768	S760-T764 PolarHBondContact O-N 3.23Å; A761-T764 PolarHBondContact O-N 3.46Å; T764-R766 VanDerWaalsContact C-N 3.32Å; T764-R766 PolarHBondContact O-N 3.48Å; T764-I767 PolarHBondContact O-N 2.96Å; T764-L768 HydrophobicContact CG2-CD1 4.36Å; T764-L768 WeakPolarHBondContact O-CG 3.25Å; T764-L768 PolarHBondContact O-N 3.18Å
765	L	65.7	Low	62.6	Low	88 Å²	88	93.8 Å²	93.8	46%	0.461	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-30.7	175.7	-69.9	170.9	0	0	0	113.4	A761 R763 R769	A761-L765 WeakPolarHBondContact O-CG 3.49Å; A761-L765 PolarHBondContact O-N 3.46Å; R763-L765 VanDerWaalsContact C-N 3.32Å; R763-L765 PolarHBondContact O-N 2.95Å; L765-R769 WeakPolarHBondContact O-CB 3.45Å; L765-R769 VanDerWaalsContact O-CG 3.27Å; L765-R769 WeakPolarHBondContact O-CG 3.3Å; L765-R769 PolarHBondContact O-N 3.08Å; L765-R769 VanDerWaalsContact O-N 3.09Å; L765-R769 PolarHBondContact O-NE 2.85Å
766	R	66.8	Low	63.9	Low	183 Å²	183	85.9 Å²	85.9	69%	0.691	43%	0.43	S	S	*	.	H	α-helix	trans	-73.1	-39.7	172.2	-72	171.6	-166.5	-169.9	4.5	111.7	G762 R763 T764 R769 L770	G762-R766 WeakPolarHBondContact O-CD 3.21Å; G762-R766 VanDerWaalsContact O-CG 3.24Å; G762-R766 WeakPolarHBondContact O-CG 3.44Å; G762-R766 PolarHBondContact O-N 3.32Å; R763-R766 WeakPolarHBondContact O-CB 3.33Å; R763-R766 PolarHBondContact O-N 2.97Å; T764-R766 VanDerWaalsContact C-N 3.32Å; T764-R766 PolarHBondContact O-N 3.48Å; R766-R769 PolarHBondContact O-N 2.9Å; R766-L770 WeakPolarHBondContact O-CB 3.12Å; R766-L770 PolarHBondContact O-N 2.95Å
767	I	68.3	Low	65.5	Low	45 Å²	45	82.9 Å²	82.9	23%	0.231	41%	0.414	C	S	.	.	H	α-helix	trans	-61.9	-45	176.3	-70.6	166.1	0	0	0	110.3	Y746 R763 T764 L770 A771	Y746-I767 HydrophobicContact CD1-CG2 4.5Å; Y746-I767 HydrophobicContact CE1-CB 4.46Å; Y746-I767 HydrophobicContact CE1-CG2 3.81Å; R763-I767 WeakPolarHBondContact O-CG1 3.46Å; R763-I767 PolarHBondContact O-N 2.87Å; T764-I767 PolarHBondContact O-N 2.96Å; I767-L770 PolarHBondContact O-N 3.25Å; I767-A771 WeakPolarHBondContact O-CB 3.33Å; I767-A771 PolarHBondContact O-N 3.26Å
768	L	68.8	Low	67.2	Low	68 Å²	68	74.3 Å²	74.3	36%	0.356	37%	0.373	S	S	.	.	H	α-helix	trans	-65.4	-42.4	175.6	-68.7	171.1	0	0	0	112.4	L747 T764 L770 A771 K772	L747-L768 HydrophobicContact CD2-CD2 4.47Å; T764-L768 HydrophobicContact CG2-CD1 4.36Å; T764-L768 WeakPolarHBondContact O-CG 3.25Å; T764-L768 PolarHBondContact O-N 3.18Å; L768-L770 VanDerWaalsContact C-N 3.33Å; L768-L770 PolarHBondContact O-N 3.12Å; L768-A771 PolarHBondContact O-N 2.57Å; L768-K772 PolarHBondContact O-N 3.25Å
769	R	71	Confident	68.9	Low	61 Å²	61	67.9 Å²	67.9	23%	0.23	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-41.3	173.1	-79.5	-173.8	-94.6	-161.4	-21.2	112.4	L765 R766 L773 L829 D831	L765-R769 WeakPolarHBondContact O-CB 3.45Å; L765-R769 VanDerWaalsContact O-CG 3.27Å; L765-R769 WeakPolarHBondContact O-CG 3.3Å; L765-R769 PolarHBondContact O-N 3.08Å; L765-R769 VanDerWaalsContact O-N 3.09Å; L765-R769 PolarHBondContact O-NE 2.85Å; R766-R769 PolarHBondContact O-N 2.9Å; R769-L773 WeakPolarHBondContact O-CG 3.47Å; R769-L773 PolarHBondContact O-N 2.93Å; R769-L773 VanDerWaalsContact O-N 3.13Å; R769-L829 HydrophobicContact CB-CD2 3.92Å; R769-L829 WeakPolarHBondContact CD-O 3.34Å; R769-L829 HydrophobicContact CG-CD2 3.64Å; R769-L829 PolarHBondContact NH1-O 3.19Å; R769-D831 IonicContact CZ-OD1 3.97Å; R769-D831 VanDerWaalsContact CZ-OD1 3.29Å; R769-D831 IonicContact CZ-OD2 2.62Å; R769-D831 VanDerWaalsContact NH1-CG 3.31Å; R769-D831 IonicContact NH1-OD1 3.43Å; R769-D831 PolarHBondContact NH1-OD1 3.47Å; R769-D831 IonicContact NH1-OD2 2.73Å; R769-D831 PolarHBondContact NH1-OD2 3.09Å; R769-D831 VanDerWaalsContact NH2-CG 3.32Å; R769-D831 IonicContact NH2-OD1 3.44Å; R769-D831 PolarHBondContact NH2-OD1 3.32Å; R769-D831 IonicContact NH2-OD2 3.8Å; R769-D831 PolarHBondContact NH2-OD2 3.32Å
770	L	71.8	Confident	70.6	Confident	78 Å²	78	61 Å²	61	41%	0.408	32%	0.318	S	S	.	.	H	α-helix	trans	-70	-36.4	176.2	-174.3	57.9	0	0	0	112.2	Y746 R766 I767 L768 L773 L774	Y746-L770 HydrophobicContact CE1-CB 4.26Å; Y746-L770 HydrophobicContact CE1-CD2 4.17Å; Y746-L770 HydrophobicContact CE1-CG 4.29Å; R766-L770 WeakPolarHBondContact O-CB 3.12Å; R766-L770 PolarHBondContact O-N 2.95Å; I767-L770 PolarHBondContact O-N 3.25Å; L768-L770 VanDerWaalsContact C-N 3.33Å; L768-L770 PolarHBondContact O-N 3.12Å; L770-L773 PolarHBondContact O-N 3.47Å; L770-L774 HydrophobicContact CG-CD1 4.45Å; L770-L774 WeakPolarHBondContact O-CG 3.46Å; L770-L774 PolarHBondContact O-N 2.91Å
771	A	72.3	Confident	71.9	Confident	7 Å²	7	58.3 Å²	58.3	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-48.4	173.1	0	0	0	0	0	111.5	Y746 I767 L768 L773 L774 S775	Y746-A771 HydrophobicContact CD1-CB 4.4Å; I767-A771 WeakPolarHBondContact O-CB 3.33Å; I767-A771 PolarHBondContact O-N 3.26Å; L768-A771 PolarHBondContact O-N 2.57Å; A771-L773 VanDerWaalsContact C-N 3.28Å; A771-L773 PolarHBondContact O-N 3.34Å; A771-L774 WeakPolarHBondContact O-CB 3.46Å; A771-L774 PolarHBondContact O-N 3.07Å; A771-S775 PolarHBondContact O-N 3.01Å; A771-S775 PolarHBondContact O-OG 2.9Å
772	K	70.8	Confident	72.9	Confident	20 Å²	20	57 Å²	57	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-39.2	173.2	-81.3	179.8	175.6	-77	0	112.6	I673 F676 D679 L768 S775 M776 M828	I673-K772 HydrophobicContact CG2-CB 4.09Å; I673-K772 HydrophobicContact CG2-CG 4.39Å; I673-K772 PolarHBondContact O-NZ 3.13Å; F676-K772 PolarHBondContact O-NZ 3.29Å; D679-K772 VanDerWaalsContact OD2-CE 3.24Å; D679-K772 WeakPolarHBondContact OD2-CE 3.4Å; D679-K772 IonicContact OD2-NZ 3.8Å; D679-K772 PolarHBondContact OD2-NZ 3.26Å; L768-K772 PolarHBondContact O-N 3.25Å; K772-S775 WeakPolarHBondContact O-CB 3.39Å; K772-S775 PolarHBondContact O-N 3.06Å; K772-M776 PolarHBondContact O-N 3.5Å; K772-M828 HydrophobicContact CD-CE 3.77Å
773	L	75.3	Confident	73.8	Confident	87 Å²	87	57.1 Å²	57.1	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-69.9	-35.9	174.9	-71.3	171.4	0	0	0	113	R769 L770 A771 M776 L829	R769-L773 WeakPolarHBondContact O-CG 3.47Å; R769-L773 PolarHBondContact O-N 2.93Å; R769-L773 VanDerWaalsContact O-N 3.13Å; L770-L773 PolarHBondContact O-N 3.47Å; A771-L773 VanDerWaalsContact C-N 3.28Å; A771-L773 PolarHBondContact O-N 3.34Å; L773-M776 WeakPolarHBondContact O-CB 3.41Å; L773-M776 PolarHBondContact O-N 3.05Å; L773-L829 HydrophobicContact CD2-CD1 3.89Å; L773-L829 HydrophobicContact CG-CD1 4.35Å
774	L	76.4	Confident	74.8	Confident	40 Å²	40	50 Å²	50	21%	0.209	25%	0.25	C	C	.	.	H	α-helix	trans	-67.8	-35.1	173.3	-71.2	171.4	0	0	0	111.8	M742 Y746 L770 A771 M776 L777	M742-L774 HydrophobicContact CB-CB 4.18Å; Y746-L774 HydrophobicContact CD1-CD1 4.15Å; Y746-L774 HydrophobicContact CG-CD1 4.07Å; L770-L774 HydrophobicContact CG-CD1 4.45Å; L770-L774 WeakPolarHBondContact O-CG 3.46Å; L770-L774 PolarHBondContact O-N 2.91Å; A771-L774 WeakPolarHBondContact O-CB 3.46Å; A771-L774 PolarHBondContact O-N 3.07Å; L774-M776 PolarHBondContact O-N 3.21Å; L774-L777 HydrophobicContact CD2-CD1 4.03Å; L774-L777 VanDerWaalsContact O-CB 3.26Å; L774-L777 WeakPolarHBondContact O-CB 3.47Å; L774-L777 WeakPolarHBondContact O-CG 3.42Å; L774-L777 PolarHBondContact O-N 2.98Å
775	S	73.6	Confident	75.6	Confident	16 Å²	16	48.1 Å²	48.1	11%	0.112	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-29.9	172.1	-55.9	0	0	0	0	112.7	D743 A771 K772 L777 R778	D743-S775 WeakPolarHBondContact CB-OG 3.16Å; D743-S775 WeakPolarHBondContact OD2-CA 3.31Å; D743-S775 WeakPolarHBondContact OD2-CB 3.18Å; D743-S775 PolarHBondContact OD2-OG 3.25Å; A771-S775 PolarHBondContact O-N 3.01Å; A771-S775 PolarHBondContact O-OG 2.9Å; K772-S775 WeakPolarHBondContact O-CB 3.39Å; K772-S775 PolarHBondContact O-N 3.06Å; S775-L777 PolarHBondContact O-N 3.27Å; S775-R778 WeakPolarHBondContact O-CB 3.35Å; S775-R778 VanDerWaalsContact O-CD 3.23Å; S775-R778 WeakPolarHBondContact O-CD 3.32Å; S775-R778 WeakPolarHBondContact O-CG 3.29Å; S775-R778 PolarHBondContact O-N 3.15Å
776	M	78.9	Confident	76.2	Confident	54 Å²	54	48.3 Å²	48.3	27%	0.266	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-65.3	-17.8	177.1	-64.8	-71.4	-80.6	0	0	113.4	I673 K772 L773 L774 R778 L779 L825	I673-M776 HydrophobicContact CD1-CG 4.32Å; I673-M776 HydrophobicContact CD1-SD 3.81Å; I673-M776 HydrophobicContact CG2-CG 4.38Å; I673-M776 HydrophobicContact CG2-SD 4.12Å; K772-M776 PolarHBondContact O-N 3.5Å; L773-M776 WeakPolarHBondContact O-CB 3.41Å; L773-M776 PolarHBondContact O-N 3.05Å; L774-M776 PolarHBondContact O-N 3.21Å; M776-R778 PolarHBondContact O-N 3.34Å; M776-L779 HydrophobicContact CE-CD1 3.57Å; M776-L779 WeakPolarHBondContact O-CB 3.27Å; M776-L779 PolarHBondContact O-N 2.82Å; M776-L779 HydrophobicContact SD-CD1 3.82Å; M776-L825 HydrophobicContact CE-CD2 4.41Å
777	L	79.9	Confident	76.8	Confident	64 Å²	64	42.7 Å²	42.7	34%	0.335	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-60.6	-24.9	171	-63.1	172.8	0	0	0	112.2	M742 L774 S775 L779 L780	M742-L777 HydrophobicContact CG-CD1 4.27Å; L774-L777 HydrophobicContact CD2-CD1 4.03Å; L774-L777 VanDerWaalsContact O-CB 3.26Å; L774-L777 WeakPolarHBondContact O-CB 3.47Å; L774-L777 WeakPolarHBondContact O-CG 3.42Å; L774-L777 PolarHBondContact O-N 2.98Å; S775-L777 PolarHBondContact O-N 3.27Å; L777-L779 PolarHBondContact O-N 2.89Å; L777-L780 HydrophobicContact CD2-CD1 4.36Å; L777-L780 VanDerWaalsContact O-CB 3.32Å; L777-L780 WeakPolarHBondContact O-CB 3.42Å; L777-L780 WeakPolarHBondContact O-CG 3.24Å; L777-L780 PolarHBondContact O-N 3.3Å; L777-L780 VanDerWaalsContact O-N 3.14Å
778	R	82.1	Confident	77.2	Confident	5 Å²	5	40.9 Å²	40.9	2%	0.019	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-58.8	-26.8	173.1	-59.6	163.3	176.5	-89.9	-9.6	111.7	L669 D692 D743 S775 M776 L780 R781	L669-R778 HydrophobicContact CD1-CB 3.76Å; L669-R778 HydrophobicContact CD1-CG 4.42Å; D692-R778 IonicContact OD1-CZ 2.83Å; D692-R778 IonicContact OD1-NH1 3.94Å; D692-R778 PolarHBondContact OD1-NH1 2.8Å; D692-R778 IonicContact OD2-CZ 2.7Å; D692-R778 IonicContact OD2-NH1 3.46Å; D692-R778 PolarHBondContact OD2-NH1 3.35Å; D692-R778 IonicContact OD2-NH2 3.25Å; D692-R778 PolarHBondContact OD2-NH2 3Å; D743-R778 IonicContact OD1-CZ 3Å; D743-R778 IonicContact OD1-NE 2.65Å; D743-R778 IonicContact OD1-NH2 2.79Å; D743-R778 PolarHBondContact OD1-NH2 3.2Å; D743-R778 IonicContact OD2-CZ 3.22Å; D743-R778 IonicContact OD2-NE 2.72Å; D743-R778 PolarHBondContact OD2-NE 2.92Å; D743-R778 IonicContact OD2-NH2 2.88Å; D743-R778 PolarHBondContact OD2-NH2 3.31Å; D743-R778 VanDerWaalsContact OD2-NH2 3.12Å; S775-R778 WeakPolarHBondContact O-CB 3.35Å; S775-R778 VanDerWaalsContact O-CD 3.23Å; S775-R778 WeakPolarHBondContact O-CD 3.32Å; S775-R778 WeakPolarHBondContact O-CG 3.29Å; S775-R778 PolarHBondContact O-N 3.15Å; M776-R778 PolarHBondContact O-N 3.34Å; R778-L780 PolarHBondContact O-N 3.3Å; R778-R781 VanDerWaalsContact O-CB 3.24Å; R778-R781 WeakPolarHBondContact O-CB 3.45Å; R778-R781 VanDerWaalsContact O-CD 3.28Å; R778-R781 WeakPolarHBondContact O-CD 3.35Å; R778-R781 WeakPolarHBondContact O-CG 3.32Å; R778-R781 PolarHBondContact O-N 3.39Å; R778-R781 VanDerWaalsContact O-N 3.14Å
779	L	79.8	Confident	77.5	Confident	20 Å²	20	39.7 Å²	39.7	11%	0.105	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-69.7	-15.9	178.7	-58	-176.7	0	0	0	113.8	P670 M776 L777 R781 L782 W818	P670-L779 HydrophobicContact CG-CD2 3.99Å; M776-L779 HydrophobicContact CE-CD1 3.57Å; M776-L779 WeakPolarHBondContact O-CB 3.27Å; M776-L779 PolarHBondContact O-N 2.82Å; M776-L779 HydrophobicContact SD-CD1 3.82Å; L777-L779 PolarHBondContact O-N 2.89Å; L779-R781 PolarHBondContact O-N 3.37Å; L779-L782 WeakPolarHBondContact O-CB 3.33Å; L779-L782 PolarHBondContact O-N 3.3Å; L779-W818 HydrophobicContact CB-CH2 3.95Å; L779-W818 HydrophobicContact CB-CZ2 4.14Å; L779-W818 HydrophobicContact CD1-CD2 4.46Å; L779-W818 HydrophobicContact CD1-CZ2 4.38Å; L779-W818 HydrophobicContact CD2-CZ2 3.91Å; L779-W818 HydrophobicContact CG-CZ2 4.37Å
780	L	81.6	Confident	77.7	Confident	67 Å²	67	39.8 Å²	39.8	35%	0.351	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-60.6	-14.5	169.9	-63.8	173.5	0	0	0	112.5	I737 L777 R778 L782 T783	I737-L780 HydrophobicContact CG2-CD1 4.11Å; L777-L780 HydrophobicContact CD2-CD1 4.36Å; L777-L780 VanDerWaalsContact O-CB 3.32Å; L777-L780 WeakPolarHBondContact O-CB 3.42Å; L777-L780 WeakPolarHBondContact O-CG 3.24Å; L777-L780 PolarHBondContact O-N 3.3Å; L777-L780 VanDerWaalsContact O-N 3.14Å; R778-L780 PolarHBondContact O-N 3.3Å; L780-L782 PolarHBondContact O-N 2.97Å; L780-L782 VanDerWaalsContact O-N 3.14Å; L780-T783 WeakPolarHBondContact O-CB 3.48Å; L780-T783 WeakPolarHBondContact O-CG2 3.18Å; L780-T783 PolarHBondContact O-N 3.41Å; L780-T783 VanDerWaalsContact O-N 3.08Å; L780-T783 PolarHBondContact O-OG1 2.91Å
781	R	81.2	Confident	77.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-54.3	-22.8	167	-70	169	-163.8	-175.9	1.5	112.9	L662 N665 L666 S691 D692 F695 S738 R778 L779 T783 R784 L785	L662-R781 HydrophobicContact CD1-CB 4.41Å; L662-R781 WeakPolarHBondContact CD1-O 3.47Å; L662-R781 HydrophobicContact CG-CB 4.43Å; N665-R781 PolarHBondContact OD1-NH1 2.92Å; L666-R781 HydrophobicContact CD1-CB 3.95Å; S691-R781 PolarHBondContact OG-NH1 3.38Å; D692-R781 IonicContact OD1-CZ 3.86Å; D692-R781 IonicContact OD1-NH1 3.78Å; D692-R781 PolarHBondContact OD1-NH1 3.02Å; D692-R781 VanDerWaalsContact OD1-NH1 3.09Å; D692-R781 IonicContact OD1-NH2 2.72Å; D692-R781 PolarHBondContact OD1-NH2 2.9Å; F695-R781 VanDerWaalsContact CD2-CZ 3.49Å; S738-R781 VanDerWaalsContact O-CZ 3.27Å; S738-R781 PolarHBondContact O-NE 3.3Å; S738-R781 PolarHBondContact O-NH2 3.29Å; R778-R781 VanDerWaalsContact O-CB 3.24Å; R778-R781 WeakPolarHBondContact O-CB 3.45Å; R778-R781 VanDerWaalsContact O-CD 3.28Å; R778-R781 WeakPolarHBondContact O-CD 3.35Å; R778-R781 WeakPolarHBondContact O-CG 3.32Å; R778-R781 PolarHBondContact O-N 3.39Å; R778-R781 VanDerWaalsContact O-N 3.14Å; L779-R781 PolarHBondContact O-N 3.37Å; R781-T783 PolarHBondContact O-N 3.36Å; R781-T783 VanDerWaalsContact O-N 3.1Å; R781-R784 WeakPolarHBondContact O-CA 3.16Å; R781-R784 WeakPolarHBondContact O-CB 3.41Å; R781-R784 PolarHBondContact O-N 3.42Å; R781-L785 PolarHBondContact O-N 3.4Å
782	L	79.9	Confident	77.7	Confident	37 Å²	37	40.9 Å²	40.9	19%	0.194	22%	0.216	C	C	.	.	H	α-helix	trans	-52.5	-31.5	171.7	180	64.2	0	0	0	112.9	L666 L779 L780 R784 L785 V786 L814 W818	L666-L782 HydrophobicContact CD2-CB 4.15Å; L666-L782 HydrophobicContact CD2-CD1 4.02Å; L779-L782 WeakPolarHBondContact O-CB 3.33Å; L779-L782 PolarHBondContact O-N 3.3Å; L780-L782 PolarHBondContact O-N 2.97Å; L780-L782 VanDerWaalsContact O-N 3.14Å; L782-R784 PolarHBondContact O-N 2.96Å; L782-L785 HydrophobicContact CD1-CB 4.26Å; L782-L785 HydrophobicContact CD1-CD2 3.96Å; L782-L785 WeakPolarHBondContact O-CB 3.38Å; L782-L785 PolarHBondContact O-N 3Å; L782-L785 VanDerWaalsContact O-N 3.1Å; L782-V786 HydrophobicContact CD1-CG2 4.47Å; L782-V786 PolarHBondContact O-N 3.46Å; L782-V786 VanDerWaalsContact O-N 3.12Å; L782-L814 HydrophobicContact CD1-CD2 4.02Å; L782-W818 HydrophobicContact CB-CH2 3.97Å; L782-W818 HydrophobicContact CD2-CH2 3.68Å; L782-W818 HydrophobicContact CD2-CZ3 3.86Å; L782-W818 HydrophobicContact CG-CH2 4.31Å
783	T	80.6	Confident	77.7	Confident	42 Å²	42	43.2 Å²	43.2	26%	0.258	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-21	174.4	64.2	0	0	0	0	113.6	L780 R781 R787	L780-T783 WeakPolarHBondContact O-CB 3.48Å; L780-T783 WeakPolarHBondContact O-CG2 3.18Å; L780-T783 PolarHBondContact O-N 3.41Å; L780-T783 VanDerWaalsContact O-N 3.08Å; L780-T783 PolarHBondContact O-OG1 2.91Å; R781-T783 PolarHBondContact O-N 3.36Å; R781-T783 VanDerWaalsContact O-N 3.1Å; T783-R787 PolarHBondContact O-NE 2.62Å; T783-R787 PolarHBondContact O-NH2 2.93Å
784	R	82.3	Confident	77.4	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-81	-41.7	169.5	-57.6	-179.1	-158.8	-172.7	24.9	110.6	L662 F695 D698 D735 S738 S739 R781 L782 V786 R787 Y788	L662-R784 HydrophobicContact CD1-CB 3.73Å; F695-R784 PolarHBondContact O-NH1 2.68Å; D698-R784 IonicContact OD2-CZ 2.71Å; D698-R784 IonicContact OD2-NE 3.96Å; D698-R784 IonicContact OD2-NH1 3.53Å; D698-R784 PolarHBondContact OD2-NH1 2.88Å; D735-R784 PolarHBondContact O-NH2 3.31Å; D735-R784 WeakPolarHBondContact OD1-CG 3.42Å; D735-R784 IonicContact OD1-CZ 3.55Å; D735-R784 IonicContact OD1-NE 3.46Å; D735-R784 PolarHBondContact OD1-NE 3.46Å; D735-R784 VanDerWaalsContact OD1-NE 3.14Å; S738-R784 PolarHBondContact OG-NH2 3.15Å; S739-R784 PolarHBondContact OG-NH1 3.25Å; S739-R784 PolarHBondContact OG-NH2 3.26Å; R781-R784 WeakPolarHBondContact O-CA 3.16Å; R781-R784 WeakPolarHBondContact O-CB 3.41Å; R781-R784 PolarHBondContact O-N 3.42Å; L782-R784 PolarHBondContact O-N 2.96Å; R784-V786 PolarHBondContact O-N 3.05Å; R784-R787 PolarHBondContact O-N 2.98Å; R784-Y788 HydrophobicContact CB-CD2 4.33Å; R784-Y788 HydrophobicContact CB-CE2 4.05Å; R784-Y788 VanDerWaalsContact O-CD2 3.26Å; R784-Y788 WeakPolarHBondContact O-CD2 3.36Å; R784-Y788 PolarHBondContact O-N 3.32Å
785	L	80.9	Confident	76.8	Confident	27 Å²	27	45.9 Å²	45.9	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-55.7	-50.9	178.3	-176.3	56.2	0	0	0	112.1	L659 L662 I663 L666 R781 L782 R787 Y788 V789	L659-L785 HydrophobicContact CD1-CD1 3.38Å; L662-L785 HydrophobicContact CD1-CB 4.36Å; L662-L785 HydrophobicContact CD2-CB 3.66Å; L662-L785 HydrophobicContact CD2-CD1 4.14Å; L662-L785 HydrophobicContact CD2-CD2 4.15Å; L662-L785 HydrophobicContact CD2-CG 4.19Å; I663-L785 HydrophobicContact CG1-CD1 4.43Å; L666-L785 HydrophobicContact CD2-CD2 4.16Å; R781-L785 PolarHBondContact O-N 3.4Å; L782-L785 HydrophobicContact CD1-CB 4.26Å; L782-L785 HydrophobicContact CD1-CD2 3.96Å; L782-L785 WeakPolarHBondContact O-CB 3.38Å; L782-L785 PolarHBondContact O-N 3Å; L782-L785 VanDerWaalsContact O-N 3.1Å; L785-R787 VanDerWaalsContact C-N 3.28Å; L785-R787 PolarHBondContact O-N 2.92Å; L785-Y788 PolarHBondContact O-N 2.94Å; L785-Y788 VanDerWaalsContact O-N 3.17Å; L785-V789 HydrophobicContact CD1-CG2 3.8Å; L785-V789 HydrophobicContact CG-CG2 4.19Å; L785-V789 WeakPolarHBondContact O-CB 3.32Å; L785-V789 WeakPolarHBondContact O-CG2 3.47Å; L785-V789 PolarHBondContact O-N 3.5Å
786	V	77.8	Confident	76.4	Confident	93 Å²	93	48.1 Å²	48.1	56%	0.564	25%	0.246	S	C	*	.	H	α-helix	trans	-60.8	-38.6	-178.7	177.5	0	0	0	0	111.4	L782 R784 S790	L782-V786 HydrophobicContact CD1-CG2 4.47Å; L782-V786 PolarHBondContact O-N 3.46Å; L782-V786 VanDerWaalsContact O-N 3.12Å; R784-V786 PolarHBondContact O-N 3.05Å; V786-S790 WeakPolarHBondContact O-CB 3.04Å; V786-S790 PolarHBondContact O-N 3.4Å
787	R	79	Confident	75.5	Confident	64 Å²	64	51 Å²	51	24%	0.242	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-46.6	174.6	-77.1	-179	-77.1	161.8	-3.8	111.8	D735 T783 R784 L785 S790 Q791	D735-R787 IonicContact OD1-CZ 3.76Å; D735-R787 IonicContact OD1-NH1 3.98Å; D735-R787 IonicContact OD1-NH2 2.74Å; D735-R787 PolarHBondContact OD1-NH2 2.78Å; D735-R787 IonicContact OD2-NH1 2.61Å; D735-R787 IonicContact OD2-NH2 2.63Å; T783-R787 PolarHBondContact O-NE 2.62Å; T783-R787 PolarHBondContact O-NH2 2.93Å; R784-R787 PolarHBondContact O-N 2.98Å; L785-R787 VanDerWaalsContact C-N 3.28Å; L785-R787 PolarHBondContact O-N 2.92Å; R787-S790 PolarHBondContact O-N 2.73Å; R787-Q791 WeakPolarHBondContact O-CB 3.34Å; R787-Q791 PolarHBondContact O-N 3.22Å
788	Y	77.9	Confident	74.4	Confident	8 Å²	8	53.1 Å²	53.1	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-48.1	177.2	-69	-46.6	0	0	0	112	D655 M658 D698 R784 L785 S790 Q791 W792	D655-Y788 HydrophobicContact CB-CD1 4.25Å; D655-Y788 HydrophobicContact CB-CE1 4.01Å; D655-Y788 VanDerWaalsContact CG-CE1 3.44Å; D655-Y788 WeakPolarHBondContact OD1-CE1 3.15Å; D655-Y788 PolarHBondContact OD1-OH 2.79Å; M658-Y788 HydrophobicContact CB-CE2 4.11Å; D698-Y788 PolarHBondContact OD1-OH 2.92Å; R784-Y788 HydrophobicContact CB-CD2 4.33Å; R784-Y788 HydrophobicContact CB-CE2 4.05Å; R784-Y788 VanDerWaalsContact O-CD2 3.26Å; R784-Y788 WeakPolarHBondContact O-CD2 3.36Å; R784-Y788 PolarHBondContact O-N 3.32Å; L785-Y788 PolarHBondContact O-N 2.94Å; L785-Y788 VanDerWaalsContact O-N 3.17Å; Y788-S790 VanDerWaalsContact C-N 3.32Å; Y788-S790 PolarHBondContact O-N 3.1Å; Y788-Q791 PolarHBondContact O-N 3.32Å; Y788-W792 PolarHBondContact O-N 3.18Å
789	V	75.6	Confident	73.5	Confident	43 Å²	43	55.7 Å²	55.7	26%	0.261	30%	0.295	S	S	.	.	H	α-helix	trans	-58.8	-42.7	178.3	172.2	0	0	0	0	111.4	L785 W792 E793 N807	L785-V789 HydrophobicContact CD1-CG2 3.8Å; L785-V789 HydrophobicContact CG-CG2 4.19Å; L785-V789 WeakPolarHBondContact O-CB 3.32Å; L785-V789 WeakPolarHBondContact O-CG2 3.47Å; L785-V789 PolarHBondContact O-N 3.5Å; V789-W792 PolarHBondContact O-N 2.96Å; V789-E793 PolarHBondContact O-N 2.84Å; V789-N807 HydrophobicContact CG1-CB 4.37Å; V789-N807 VanDerWaalsContact CG1-ND2 3.32Å; V789-N807 WeakPolarHBondContact CG1-ND2 3.5Å
790	S	74.3	Confident	73	Confident	63 Å²	63	58 Å²	58	44%	0.441	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-46.9	175.2	-168.5	0	0	0	0	112.4	V786 R787 Y788 W792 E793 E794	V786-S790 WeakPolarHBondContact O-CB 3.04Å; V786-S790 PolarHBondContact O-N 3.4Å; R787-S790 PolarHBondContact O-N 2.73Å; Y788-S790 VanDerWaalsContact C-N 3.32Å; Y788-S790 PolarHBondContact O-N 3.1Å; S790-W792 VanDerWaalsContact C-N 3.31Å; S790-W792 PolarHBondContact O-N 3.46Å; S790-E793 PolarHBondContact O-N 3.32Å; S790-E794 PolarHBondContact O-N 3.5Å
791	Q	72.1	Confident	72.4	Confident	60 Å²	60	60.1 Å²	60.1	28%	0.28	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-33.9	179.3	-170.5	-176.5	-9.3	0	0	112.2	R787 Y788 F795	R787-Q791 WeakPolarHBondContact O-CB 3.34Å; R787-Q791 PolarHBondContact O-N 3.22Å; Y788-Q791 PolarHBondContact O-N 3.32Å; Q791-F795 HydrophobicContact CG-CE2 3.89Å; Q791-F795 HydrophobicContact CG-CZ 3.95Å; Q791-F795 WeakPolarHBondContact O-CD2 3.13Å; Q791-F795 WeakPolarHBondContact O-CG 3.3Å
792	W	71.6	Confident	72.3	Confident	48 Å²	48	64.4 Å²	64.4	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-76	-28.1	175.1	-80.9	73.3	0	0	0	113	F652 L656 Y788 V789 S790 E794 F795 L796	F652-W792 HydrophobicContact CD2-CH2 4.13Å; F652-W792 HydrophobicContact CD2-CZ2 4.11Å; F652-W792 HydrophobicContact CE1-CH2 4.33Å; F652-W792 AromaticContact CE2-CH2 3.28Å; F652-W792 HydrophobicContact CE2-CH2 3.28Å; F652-W792 AromaticContact CE2-CZ2 3.7Å; F652-W792 HydrophobicContact CE2-CZ2 3.7Å; F652-W792 AromaticContact CE2-CZ3 3.81Å; F652-W792 HydrophobicContact CE2-CZ3 3.81Å; F652-W792 AromaticContact CZ-CH2 3.4Å; F652-W792 HydrophobicContact CZ-CH2 3.4Å; F652-W792 VanDerWaalsContact CZ-CH2 3.4Å; F652-W792 HydrophobicContact CZ-CZ2 4.16Å; F652-W792 HydrophobicContact CZ-CZ3 4Å; L656-W792 HydrophobicContact CB-CZ2 4.3Å; L656-W792 HydrophobicContact CD1-CH2 4.23Å; L656-W792 HydrophobicContact CD1-CZ2 4.42Å; Y788-W792 PolarHBondContact O-N 3.18Å; V789-W792 PolarHBondContact O-N 2.96Å; S790-W792 VanDerWaalsContact C-N 3.31Å; S790-W792 PolarHBondContact O-N 3.46Å; W792-E794 VanDerWaalsContact C-N 3.29Å; W792-E794 PolarHBondContact O-N 2.93Å; W792-F795 PolarHBondContact O-N 2.86Å; W792-L796 WeakPolarHBondContact O-CB 3.33Å; W792-L796 WeakPolarHBondContact O-CG 3.4Å; W792-L796 PolarHBondContact O-N 3.27Å
793	E	71.8	Confident	72.3	Confident	68 Å²	68	64.5 Å²	64.5	32%	0.318	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-33.6	172.5	-167.7	177.2	140.7	0	0	111.9	V789 S790 M803 N807	V789-E793 PolarHBondContact O-N 2.84Å; S790-E793 PolarHBondContact O-N 3.32Å; E793-M803 HydrophobicContact CG-CB 4.2Å; E793-N807 PolarHBondContact OE2-ND2 3.38Å
794	E	67.6	Low	72.4	Confident	123 Å²	123	63.2 Å²	63.2	58%	0.575	33%	0.333	S	S	*	.	H	α-helix	trans	-69.9	-33.1	174.3	-67.5	167.1	-167.4	0	0	113	S790 W792 N797	S790-E794 PolarHBondContact O-N 3.5Å; W792-E794 VanDerWaalsContact C-N 3.29Å; W792-E794 PolarHBondContact O-N 2.93Å; E794-N797 PolarHBondContact O-ND2 2.98Å
795	F	64.2	Low	72.6	Confident	61 Å²	61	64.6 Å²	64.6	27%	0.268	34%	0.34	S	S	.	.	H	α-helix	trans	-78.9	-40	177.2	-60.2	-26.1	0	0	0	112.2	L618 Q791 W792 N797	L618-F795 HydrophobicContact CD1-CD1 3.56Å; L618-F795 HydrophobicContact CD1-CE1 3.89Å; L618-F795 HydrophobicContact CD2-CD1 3.59Å; L618-F795 HydrophobicContact CD2-CD2 4.44Å; L618-F795 HydrophobicContact CD2-CE1 3.62Å; L618-F795 HydrophobicContact CD2-CE2 4.46Å; L618-F795 HydrophobicContact CD2-CG 4.02Å; L618-F795 HydrophobicContact CD2-CZ 4.07Å; L618-F795 HydrophobicContact CG-CD1 4.22Å; L618-F795 HydrophobicContact CG-CE1 4.32Å; Q791-F795 HydrophobicContact CG-CE2 3.89Å; Q791-F795 HydrophobicContact CG-CZ 3.95Å; Q791-F795 WeakPolarHBondContact O-CD2 3.13Å; Q791-F795 WeakPolarHBondContact O-CG 3.3Å; W792-F795 PolarHBondContact O-N 2.86Å; F795-N797 PolarHBondContact O-N 3.35Å; F795-N797 PolarHBondContact O-ND2 3.21Å
796	L	65.3	Low	72.9	Confident	63 Å²	63	68.8 Å²	68.8	33%	0.33	36%	0.358	S	S	.	.			trans	-79.7	84.8	175.3	-64.8	176.3	0	0	0	109.9	W792 I798 M803	W792-L796 WeakPolarHBondContact O-CB 3.33Å; W792-L796 WeakPolarHBondContact O-CG 3.4Å; W792-L796 PolarHBondContact O-N 3.27Å; L796-I798 HydrophobicContact CD2-CD1 4.46Å; L796-I798 PolarHBondContact O-N 3.46Å; L796-M803 HydrophobicContact CD1-CE 3.86Å
797	N	60.8	Low	73.2	Confident	114 Å²	114	66.1 Å²	66.1	61%	0.61	34%	0.34	S	S	*	.			trans	-66.3	15.3	178	-69.8	-113.5	0	0	0	113.4	K621 E794 F795	K621-N797 PolarHBondContact NZ-OD1 2.94Å; E794-N797 PolarHBondContact O-ND2 2.98Å; F795-N797 PolarHBondContact O-N 3.35Å; F795-N797 PolarHBondContact O-ND2 3.21Å
798	I	56.3	Low	73.6	Confident	109 Å²	109	64 Å²	64	56%	0.559	33%	0.334	S	S	*	.	S	Bend	trans	-77	126.1	174.3	-60.8	165.7	0	0	0	107.1	L796 S800	L796-I798 HydrophobicContact CD2-CD1 4.46Å; L796-I798 PolarHBondContact O-N 3.46Å; I798-S800 PolarHBondContact O-N 3.07Å
799	A	62.7	Low	74.3	Confident	59 Å²	59	66.2 Å²	66.2	49%	0.488	35%	0.348	S	S	.	.			trans	-27.4	98.5	-168.5	0	0	0	0	0	115	K801 F802	A799-K801 PolarHBondContact O-N 3.27Å; A799-F802 HydrophobicContact CB-CD2 3.77Å; A799-F802 HydrophobicContact CB-CE2 4.22Å; A799-F802 WeakPolarHBondContact O-CB 3.03Å; A799-F802 PolarHBondContact O-N 2.98Å
800	S	68.3	Low	74.9	Confident	69 Å²	69	68.1 Å²	68.1	48%	0.483	36%	0.356	S	S	.	.	H	α-helix	trans	-53.7	-28.3	-164.5	54.1	0	0	0	0	115.5	I798 F802 M803 G804	I798-S800 PolarHBondContact O-N 3.07Å; S800-F802 PolarHBondContact O-N 3.02Å; S800-M803 PolarHBondContact O-N 2.87Å; S800-G804 PolarHBondContact O-N 2.95Å
801	K	71	Confident	75.6	Confident	110 Å²	110	68.3 Å²	68.3	48%	0.478	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-32.6	173.4	-66.3	-171.1	168.9	-161.8	0	113.7	A799 I805 A902 L903 S906	A799-K801 PolarHBondContact O-N 3.27Å; K801-I805 PolarHBondContact O-N 2.73Å; K801-A902 PolarHBondContact NZ-O 2.75Å; K801-L903 HydrophobicContact CB-CD1 3.88Å; K801-S906 VanDerWaalsContact CD-CB 3.48Å; K801-S906 WeakPolarHBondContact CD-OG 3.27Å
802	F	78.4	Confident	76.5	Confident	91 Å²	91	66.2 Å²	66.2	40%	0.399	34%	0.342	S	S	.	.	H	α-helix	trans	-73.8	-43.8	174.2	-72.6	-96.2	0	0	0	111.7	A799 S800 G804 I805 F806 L903 F907	A799-F802 HydrophobicContact CB-CD2 3.77Å; A799-F802 HydrophobicContact CB-CE2 4.22Å; A799-F802 WeakPolarHBondContact O-CB 3.03Å; A799-F802 PolarHBondContact O-N 2.98Å; S800-F802 PolarHBondContact O-N 3.02Å; F802-G804 VanDerWaalsContact C-N 3.29Å; F802-G804 PolarHBondContact O-N 2.8Å; F802-I805 VanDerWaalsContact O-CG2 3.23Å; F802-I805 WeakPolarHBondContact O-CG2 3.38Å; F802-I805 PolarHBondContact O-N 3.31Å; F802-F806 WeakPolarHBondContact O-CB 3.23Å; F802-F806 PolarHBondContact O-N 3.05Å; F802-L903 HydrophobicContact CD1-CD1 4.27Å; F802-L903 HydrophobicContact CD2-CD1 3.96Å; F802-L903 HydrophobicContact CE1-CD1 4.3Å; F802-L903 HydrophobicContact CE2-CD1 4Å; F802-L903 HydrophobicContact CG-CD1 4.12Å; F802-L903 HydrophobicContact CZ-CD1 4.18Å; F802-F907 HydrophobicContact CE1-CE1 4.37Å; F802-F907 AromaticContact CE1-CZ 3.74Å; F802-F907 HydrophobicContact CE1-CZ 3.74Å; F802-F907 AromaticContact CZ-CE1 3.68Å; F802-F907 HydrophobicContact CZ-CE1 3.68Å; F802-F907 HydrophobicContact CZ-CE2 4.24Å; F802-F907 AromaticContact CZ-CZ 3.42Å; F802-F907 HydrophobicContact CZ-CZ 3.42Å; F802-F907 VanDerWaalsContact CZ-CZ 3.42Å
803	M	79.6	Confident	77.6	Confident	38 Å²	38	68.7 Å²	68.7	19%	0.187	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-42.7	173.9	-65.3	-57.1	-61.2	0	0	110.7	E793 L796 S800 I805 F806 N807	E793-M803 HydrophobicContact CG-CB 4.2Å; L796-M803 HydrophobicContact CD1-CE 3.86Å; S800-M803 PolarHBondContact O-N 2.87Å; M803-I805 PolarHBondContact O-N 3Å; M803-F806 PolarHBondContact O-N 2.88Å; M803-N807 VanDerWaalsContact O-CB 3.25Å; M803-N807 WeakPolarHBondContact O-CB 3.48Å; M803-N807 PolarHBondContact O-N 3.43Å; M803-N807 PolarHBondContact O-ND2 2.83Å
804	G	82.5	Confident	78.5	Confident	16 Å²	16	66.5 Å²	66.5	17%	0.165	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-44.2	177	0	0	0	0	0	114.5	S800 F802 L808	S800-G804 PolarHBondContact O-N 2.95Å; F802-G804 VanDerWaalsContact C-N 3.29Å; F802-G804 PolarHBondContact O-N 2.8Å; G804-L808 WeakPolarHBondContact O-CB 3.49Å; G804-L808 PolarHBondContact O-N 3.37Å; G804-L808 VanDerWaalsContact O-N 3.1Å
805	I	87	Confident	79.6	Confident	29 Å²	29	63.4 Å²	63.4	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-71.7	-36.7	176.3	-168.2	167.4	0	0	0	112	K801 F802 M803 L808 V809 F896 A900 L903	K801-I805 PolarHBondContact O-N 2.73Å; F802-I805 VanDerWaalsContact O-CG2 3.23Å; F802-I805 WeakPolarHBondContact O-CG2 3.38Å; F802-I805 PolarHBondContact O-N 3.31Å; M803-I805 PolarHBondContact O-N 3Å; I805-L808 PolarHBondContact O-N 3.03Å; I805-V809 WeakPolarHBondContact O-CG2 3.25Å; I805-V809 PolarHBondContact O-N 3.22Å; I805-F896 HydrophobicContact CD1-CE2 4.28Å; I805-F896 HydrophobicContact CG1-CE2 4.39Å; I805-A900 HydrophobicContact CD1-CB 4.2Å; I805-L903 HydrophobicContact CD1-CD2 4.27Å; I805-L903 HydrophobicContact CG2-CD2 4.05Å
806	F	85.9	Confident	81.1	Confident	116 Å²	116	60.5 Å²	60.5	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-63.7	-48.7	176.3	178.8	-98.7	0	0	0	111.4	F802 M803 L808 V809 L810	F802-F806 WeakPolarHBondContact O-CB 3.23Å; F802-F806 PolarHBondContact O-N 3.05Å; M803-F806 PolarHBondContact O-N 2.88Å; F806-L808 VanDerWaalsContact C-N 3.26Å; F806-L808 PolarHBondContact O-N 2.78Å; F806-V809 PolarHBondContact O-N 2.77Å; F806-V809 VanDerWaalsContact O-N 3.16Å; F806-L810 HydrophobicContact CD1-CD1 4.17Å; F806-L810 HydrophobicContact CD1-CD2 4.44Å; F806-L810 HydrophobicContact CD2-CD1 4.07Å; F806-L810 HydrophobicContact CE1-CD1 3.81Å; F806-L810 HydrophobicContact CE1-CD2 3.72Å; F806-L810 HydrophobicContact CE1-CG 4.43Å; F806-L810 HydrophobicContact CE2-CD1 3.7Å; F806-L810 HydrophobicContact CG-CD1 4.3Å; F806-L810 HydrophobicContact CZ-CD1 3.56Å; F806-L810 HydrophobicContact CZ-CD2 4Å; F806-L810 HydrophobicContact CZ-CG 4.46Å; F806-L810 WeakPolarHBondContact O-CD1 3.28Å; F806-L810 PolarHBondContact O-N 3.37Å
807	N	84.9	Confident	82.5	Confident	37 Å²	37	58 Å²	58	20%	0.198	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-39.2	175	-69.7	-19.3	0	0	0	111.5	V789 E793 M803 L811	V789-N807 HydrophobicContact CG1-CB 4.37Å; V789-N807 VanDerWaalsContact CG1-ND2 3.32Å; V789-N807 WeakPolarHBondContact CG1-ND2 3.5Å; E793-N807 PolarHBondContact OE2-ND2 3.38Å; M803-N807 VanDerWaalsContact O-CB 3.25Å; M803-N807 WeakPolarHBondContact O-CB 3.48Å; M803-N807 PolarHBondContact O-N 3.43Å; M803-N807 PolarHBondContact O-ND2 2.83Å; N807-L811 WeakPolarHBondContact O-CB 3.48Å; N807-L811 PolarHBondContact O-N 3.41Å
808	L	88.6	Confident	84.1	Confident	20 Å²	20	54.9 Å²	54.9	11%	0.105	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-40.7	176.2	-178.3	58.9	0	0	0	112.8	G804 I805 F806 L811 M812 L895 F896 H899	G804-L808 WeakPolarHBondContact O-CB 3.49Å; G804-L808 PolarHBondContact O-N 3.37Å; G804-L808 VanDerWaalsContact O-N 3.1Å; I805-L808 PolarHBondContact O-N 3.03Å; F806-L808 VanDerWaalsContact C-N 3.26Å; F806-L808 PolarHBondContact O-N 2.78Å; L808-L811 PolarHBondContact O-N 2.9Å; L808-M812 WeakPolarHBondContact O-CG 3.42Å; L808-M812 PolarHBondContact O-N 2.98Å; L808-L895 HydrophobicContact CD2-CB 4.37Å; L808-F896 HydrophobicContact CD2-CB 4.4Å; L808-H899 HydrophobicContact CD2-CB 3.83Å
809	V	91.4	Very high	85.9	Confident	54 Å²	54	50.6 Å²	50.6	33%	0.327	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-43.5	175.2	170.1	0	0	0	0	111	I805 F806 L811 M812 L813 F896	I805-V809 WeakPolarHBondContact O-CG2 3.25Å; I805-V809 PolarHBondContact O-N 3.22Å; F806-V809 PolarHBondContact O-N 2.77Å; F806-V809 VanDerWaalsContact O-N 3.16Å; V809-L811 VanDerWaalsContact C-N 3.33Å; V809-L811 PolarHBondContact O-N 2.85Å; V809-M812 PolarHBondContact O-N 3.28Å; V809-L813 HydrophobicContact CG1-CD1 4.29Å; V809-L813 WeakPolarHBondContact O-CG 3.36Å; V809-L813 PolarHBondContact O-N 2.87Å; V809-F896 HydrophobicContact CG2-CD2 4.14Å; V809-F896 HydrophobicContact CG2-CE2 3.81Å
810	L	89.4	Confident	87.4	Confident	82 Å²	82	47.8 Å²	47.8	43%	0.429	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-40.7	174.1	-92.8	65.3	0	0	0	111.8	F806 L813 L814	F806-L810 HydrophobicContact CD1-CD1 4.17Å; F806-L810 HydrophobicContact CD1-CD2 4.44Å; F806-L810 HydrophobicContact CD2-CD1 4.07Å; F806-L810 HydrophobicContact CE1-CD1 3.81Å; F806-L810 HydrophobicContact CE1-CD2 3.72Å; F806-L810 HydrophobicContact CE1-CG 4.43Å; F806-L810 HydrophobicContact CE2-CD1 3.7Å; F806-L810 HydrophobicContact CG-CD1 4.3Å; F806-L810 HydrophobicContact CZ-CD1 3.56Å; F806-L810 HydrophobicContact CZ-CD2 4Å; F806-L810 HydrophobicContact CZ-CG 4.46Å; F806-L810 WeakPolarHBondContact O-CD1 3.28Å; F806-L810 PolarHBondContact O-N 3.37Å; L810-L813 PolarHBondContact O-N 3.32Å; L810-L814 WeakPolarHBondContact O-CB 3.31Å; L810-L814 PolarHBondContact O-N 3.02Å
811	L	88	Confident	88.6	Confident	67 Å²	67	44.7 Å²	44.7	35%	0.351	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-40.3	175	-179.1	61.7	0	0	0	112.1	N807 L808 V809 L814 L815	N807-L811 WeakPolarHBondContact O-CB 3.48Å; N807-L811 PolarHBondContact O-N 3.41Å; L808-L811 PolarHBondContact O-N 2.9Å; V809-L811 VanDerWaalsContact C-N 3.33Å; V809-L811 PolarHBondContact O-N 2.85Å; L811-L814 PolarHBondContact O-N 3.49Å; L811-L815 HydrophobicContact CD1-CD1 4.07Å; L811-L815 HydrophobicContact CD1-CG 4.12Å; L811-L815 HydrophobicContact CG-CD1 3.94Å; L811-L815 HydrophobicContact CG-CG 4.4Å; L811-L815 WeakPolarHBondContact O-CB 3.38Å; L811-L815 VanDerWaalsContact O-CG 3.27Å; L811-L815 WeakPolarHBondContact O-CG 3.39Å; L811-L815 PolarHBondContact O-N 3.18Å
812	M	91.9	Very high	89.6	Confident	16 Å²	16	42.7 Å²	42.7	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-44	174.7	-74.6	-175.2	71.7	0	0	112.1	L808 V809 L814 L815 G816 M863 C892 F896	L808-M812 WeakPolarHBondContact O-CG 3.42Å; L808-M812 PolarHBondContact O-N 2.98Å; V809-M812 PolarHBondContact O-N 3.28Å; M812-L814 PolarHBondContact O-N 3.29Å; M812-L815 PolarHBondContact O-N 3.1Å; M812-G816 PolarHBondContact O-N 3.04Å; M812-M863 HydrophobicContact CB-CE 4.15Å; M812-M863 HydrophobicContact CB-SD 4.16Å; M812-M863 HydrophobicContact CE-CE 4.17Å; M812-M863 HydrophobicContact CE-CG 4.1Å; M812-M863 HydrophobicContact CE-SD 4.04Å; M812-M863 WeakPolarHBondContact O-CE 3.43Å; M812-C892 HydrophobicContact CE-CB 4.22Å; M812-C892 HydrophobicContact CG-CB 4.12Å; M812-F896 HydrophobicContact SD-CB 3.7Å; M812-F896 HydrophobicContact SD-CD2 4.27Å; M812-F896 HydrophobicContact SD-CG 4.17Å
813	L	93.1	Very high	90.3	Very high	100 Å²	100	38.6 Å²	38.6	52%	0.524	20%	0.199	S	C	.	.	H	α-helix	trans	-61.8	-43.6	176.2	-68.9	170.8	0	0	0	111.5	V809 L810 G816 H817	V809-L813 HydrophobicContact CG1-CD1 4.29Å; V809-L813 WeakPolarHBondContact O-CG 3.36Å; V809-L813 PolarHBondContact O-N 2.87Å; L810-L813 PolarHBondContact O-N 3.32Å; L813-G816 PolarHBondContact O-N 2.95Å; L813-H817 VanDerWaalsContact O-CB 3.23Å; L813-H817 WeakPolarHBondContact O-CB 3.29Å; L813-H817 PolarHBondContact O-N 3.46Å
814	L	91.3	Very high	90.9	Very high	23 Å²	23	37 Å²	37	12%	0.12	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-44.2	175.9	-179.7	66.2	0	0	0	112.5	L666 L782 L810 L811 M812 H817 W818	L666-L814 HydrophobicContact CB-CD1 4.27Å; L666-L814 HydrophobicContact CD2-CD2 4.19Å; L782-L814 HydrophobicContact CD1-CD2 4.02Å; L810-L814 WeakPolarHBondContact O-CB 3.31Å; L810-L814 PolarHBondContact O-N 3.02Å; L811-L814 PolarHBondContact O-N 3.49Å; M812-L814 PolarHBondContact O-N 3.29Å; L814-H817 WeakPolarHBondContact O-CB 3.47Å; L814-H817 PolarHBondContact O-N 3.35Å; L814-W818 HydrophobicContact CD1-CZ2 4.46Å; L814-W818 HydrophobicContact CD2-CZ2 4.47Å; L814-W818 PolarHBondContact O-N 2.72Å
815	L	92	Very high	91.3	Very high	57 Å²	57	36.5 Å²	36.5	30%	0.298	19%	0.185	S	C	.	.	H	α-helix	trans	-68.6	-39.9	178.3	-71.7	173.4	0	0	0	111.9	L811 M812 H817 W818 N819	L811-L815 HydrophobicContact CD1-CD1 4.07Å; L811-L815 HydrophobicContact CD1-CG 4.12Å; L811-L815 HydrophobicContact CG-CD1 3.94Å; L811-L815 HydrophobicContact CG-CG 4.4Å; L811-L815 WeakPolarHBondContact O-CB 3.38Å; L811-L815 VanDerWaalsContact O-CG 3.27Å; L811-L815 WeakPolarHBondContact O-CG 3.39Å; L811-L815 PolarHBondContact O-N 3.18Å; M812-L815 PolarHBondContact O-N 3.1Å; L815-H817 VanDerWaalsContact C-N 3.33Å; L815-W818 HydrophobicContact CD2-CE3 4.38Å; L815-W818 PolarHBondContact O-N 3.32Å; L815-N819 WeakPolarHBondContact O-CB 3.1Å; L815-N819 PolarHBondContact O-N 3.27Å
816	G	94.3	Very high	91.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-42.2	172.2	0	0	0	0	0	112.2	M812 L813 N819 A820 A859	M812-G816 PolarHBondContact O-N 3.04Å; L813-G816 PolarHBondContact O-N 2.95Å; G816-N819 PolarHBondContact O-N 3.2Å; G816-A820 WeakPolarHBondContact O-CB 3.41Å; G816-A820 PolarHBondContact O-N 3.17Å; G816-A859 WeakPolarHBondContact O-CB 3.32Å
817	H	95.2	Very high	91.5	Very high	11 Å²	11	31.9 Å²	31.9	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-45.3	174.7	166.1	78.4	0	0	0	113.3	I667 L813 L814 L815 A820 C821 Y852	I667-H817 PolarHBondContact O-CE1 3.49Å; I667-H817 PolarHBondContact O-NE2 2.89Å; I667-H817 VanDerWaalsContact O-NE2 3.09Å; L813-H817 VanDerWaalsContact O-CB 3.23Å; L813-H817 WeakPolarHBondContact O-CB 3.29Å; L813-H817 PolarHBondContact O-N 3.46Å; L814-H817 WeakPolarHBondContact O-CB 3.47Å; L814-H817 PolarHBondContact O-N 3.35Å; L815-H817 VanDerWaalsContact C-N 3.33Å; H817-A820 WeakPolarHBondContact O-CB 3.45Å; H817-A820 PolarHBondContact O-N 2.82Å; H817-C821 PolarHBondContact O-N 3.02Å; H817-C821 VanDerWaalsContact O-N 3.07Å; H817-C821 PolarHBondContact O-SG 3.41Å; H817-Y852 AromaticContact ND1-CE2 3.57Å; H817-Y852 AromaticContact ND1-CZ 3.62Å; H817-Y852 PolarHBondContact ND1-OH 2.99Å
818	W	93.8	Very high	91.6	Very high	49 Å²	49	30.9 Å²	30.9	19%	0.186	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-40.5	174.2	-73.7	2.9	0	0	0	112.6	L666 L779 L782 L814 L815 A820 C821 L822	L666-W818 HydrophobicContact CD2-CZ2 4.05Å; L666-W818 HydrophobicContact CG-CZ2 3.98Å; L666-W818 PolarHBondContact O-NE1 2.97Å; L779-W818 HydrophobicContact CB-CH2 3.95Å; L779-W818 HydrophobicContact CB-CZ2 4.14Å; L779-W818 HydrophobicContact CD1-CD2 4.46Å; L779-W818 HydrophobicContact CD1-CZ2 4.38Å; L779-W818 HydrophobicContact CD2-CZ2 3.91Å; L779-W818 HydrophobicContact CG-CZ2 4.37Å; L782-W818 HydrophobicContact CB-CH2 3.97Å; L782-W818 HydrophobicContact CD2-CH2 3.68Å; L782-W818 HydrophobicContact CD2-CZ3 3.86Å; L782-W818 HydrophobicContact CG-CH2 4.31Å; L814-W818 HydrophobicContact CD1-CZ2 4.46Å; L814-W818 HydrophobicContact CD2-CZ2 4.47Å; L814-W818 PolarHBondContact O-N 2.72Å; L815-W818 HydrophobicContact CD2-CE3 4.38Å; L815-W818 PolarHBondContact O-N 3.32Å; W818-A820 VanDerWaalsContact C-N 3.3Å; W818-A820 PolarHBondContact O-N 3.38Å; W818-C821 PolarHBondContact O-N 3.26Å; W818-L822 VanDerWaalsContact O-CB 3.31Å; W818-L822 WeakPolarHBondContact O-CB 3.43Å; W818-L822 PolarHBondContact O-N 3.4Å
819	N	94	Very high	91.4	Very high	18 Å²	18	31.3 Å²	31.3	10%	0.096	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-35.4	176.7	-176.4	-9.4	0	0	0	111.4	L815 G816 Q823 A859 S885	L815-N819 WeakPolarHBondContact O-CB 3.1Å; L815-N819 PolarHBondContact O-N 3.27Å; G816-N819 PolarHBondContact O-N 3.2Å; N819-Q823 WeakPolarHBondContact O-CB 3.38Å; N819-Q823 WeakPolarHBondContact O-CG 3.45Å; N819-Q823 PolarHBondContact O-N 3.19Å; N819-Q823 PolarHBondContact OD1-NE2 3.27Å; N819-A859 HydrophobicContact CB-CB 4.01Å; N819-S885 PolarHBondContact ND2-OG 3.43Å; N819-S885 WeakPolarHBondContact OD1-CB 3.11Å; N819-S885 PolarHBondContact OD1-OG 2.73Å
820	A	95.1	Very high	91.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-54.7	170.8	0	0	0	0	0	111.8	G816 H817 W818 L822 Q823 Y824 A855 L856 A859	G816-A820 WeakPolarHBondContact O-CB 3.41Å; G816-A820 PolarHBondContact O-N 3.17Å; H817-A820 WeakPolarHBondContact O-CB 3.45Å; H817-A820 PolarHBondContact O-N 2.82Å; W818-A820 VanDerWaalsContact C-N 3.3Å; W818-A820 PolarHBondContact O-N 3.38Å; A820-L822 VanDerWaalsContact C-N 3.29Å; A820-L822 PolarHBondContact O-N 3.24Å; A820-Q823 PolarHBondContact O-N 3.26Å; A820-Q823 VanDerWaalsContact O-N 3.15Å; A820-Y824 PolarHBondContact O-N 2.86Å; A820-A855 HydrophobicContact CB-CB 4.29Å; A820-L856 HydrophobicContact CB-CB 4.03Å; A820-L856 HydrophobicContact CB-CD1 3.99Å; A820-A859 HydrophobicContact CB-CB 3.96Å
821	C	94	Very high	91	Very high	4 Å²	4	34.6 Å²	34.6	3%	0.027	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-42.4	179.5	-60.7	0	0	0	0	111	P670 S674 H817 W818 Q823 Y824 L825	P670-C821 HydrophobicContact CB-CB 3.81Å; S674-C821 WeakPolarHBondContact CB-O 3.44Å; S674-C821 WeakPolarHBondContact OG-CB 3.3Å; H817-C821 PolarHBondContact O-N 3.02Å; H817-C821 VanDerWaalsContact O-N 3.07Å; H817-C821 PolarHBondContact O-SG 3.41Å; W818-C821 PolarHBondContact O-N 3.26Å; C821-Q823 PolarHBondContact O-N 2.88Å; C821-Y824 PolarHBondContact O-N 2.82Å; C821-L825 WeakPolarHBondContact O-CB 3.35Å; C821-L825 PolarHBondContact O-N 3.38Å
822	L	91.7	Very high	91	Very high	69 Å²	69	32.8 Å²	32.8	36%	0.361	17%	0.165	S	C	.	.	H	α-helix	trans	-63.2	-40.1	176.6	-174.1	64.3	0	0	0	113.2	W818 A820 Y824 L825 I826	W818-L822 VanDerWaalsContact O-CB 3.31Å; W818-L822 WeakPolarHBondContact O-CB 3.43Å; W818-L822 PolarHBondContact O-N 3.4Å; A820-L822 VanDerWaalsContact C-N 3.29Å; A820-L822 PolarHBondContact O-N 3.24Å; L822-Y824 VanDerWaalsContact C-N 3.29Å; L822-Y824 PolarHBondContact O-N 3.49Å; L822-L825 PolarHBondContact O-N 2.84Å; L822-I826 HydrophobicContact CD1-CD1 3.76Å; L822-I826 HydrophobicContact CD1-CG1 4.13Å; L822-I826 HydrophobicContact CG-CD1 4.01Å; L822-I826 PolarHBondContact O-N 2.95Å
823	Q	93	Very high	90.8	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-69.6	-22.4	179.2	-83.6	-172.7	81.8	0	0	114	N819 A820 C821 P827 W837 H862 I881 S885	N819-Q823 WeakPolarHBondContact O-CB 3.38Å; N819-Q823 WeakPolarHBondContact O-CG 3.45Å; N819-Q823 PolarHBondContact O-N 3.19Å; N819-Q823 PolarHBondContact OD1-NE2 3.27Å; A820-Q823 PolarHBondContact O-N 3.26Å; A820-Q823 VanDerWaalsContact O-N 3.15Å; C821-Q823 PolarHBondContact O-N 2.88Å; Q823-P827 VanDerWaalsContact O-CD 3.24Å; Q823-P827 WeakPolarHBondContact O-CD 3.34Å; Q823-P827 WeakPolarHBondContact O-CG 3.34Å; Q823-W837 PolarHBondContact O-NE1 3.06Å; Q823-H862 PolarHBondContact NE2-ND1 3.3Å; Q823-H862 PolarHBondContact OE1-CE1 3.22Å; Q823-I881 HydrophobicContact CG-CG2 3.64Å; Q823-S885 PolarHBondContact NE2-OG 2.92Å
824	Y	92.7	Very high	90.6	Very high	5 Å²	5	34 Å²	34	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-90.2	-40.1	170.1	-173.1	-95	0	0	0	112.4	S674 F675 A820 C821 L822 I826 P827 M828 F832 W837 V838 Q851	S674-Y824 WeakPolarHBondContact O-CD1 3.48Å; S674-Y824 WeakPolarHBondContact O-CE1 3.33Å; F675-Y824 AromaticContact CD1-CD1 3.46Å; F675-Y824 HydrophobicContact CD1-CD1 3.46Å; F675-Y824 VanDerWaalsContact CD1-CD1 3.46Å; F675-Y824 HydrophobicContact CD1-CD2 4.44Å; F675-Y824 AromaticContact CD1-CE1 3.57Å; F675-Y824 HydrophobicContact CD1-CE1 3.57Å; F675-Y824 AromaticContact CD1-CG 3.93Å; F675-Y824 HydrophobicContact CD1-CG 3.93Å; F675-Y824 AromaticContact CE1-CD1 3.33Å; F675-Y824 HydrophobicContact CE1-CD1 3.33Å; F675-Y824 AromaticContact CE1-CD2 3.81Å; F675-Y824 HydrophobicContact CE1-CD2 3.81Å; F675-Y824 AromaticContact CE1-CE1 3.86Å; F675-Y824 HydrophobicContact CE1-CE1 3.86Å; F675-Y824 HydrophobicContact CE1-CE2 4.29Å; F675-Y824 AromaticContact CE1-CG 3.3Å; F675-Y824 HydrophobicContact CE1-CG 3.3Å; F675-Y824 HydrophobicContact CG-CD1 4.29Å; F675-Y824 HydrophobicContact CG-CE1 4.44Å; F675-Y824 HydrophobicContact CZ-CD1 4.05Å; F675-Y824 AromaticContact CZ-CG 3.92Å; F675-Y824 HydrophobicContact CZ-CG 3.92Å; A820-Y824 PolarHBondContact O-N 2.86Å; C821-Y824 PolarHBondContact O-N 2.82Å; L822-Y824 VanDerWaalsContact C-N 3.29Å; L822-Y824 PolarHBondContact O-N 3.49Å; Y824-I826 VanDerWaalsContact C-N 3.34Å; Y824-I826 PolarHBondContact O-N 3.47Å; Y824-P827 WeakPolarHBondContact O-CD 3.4Å; Y824-M828 PolarHBondContact O-N 3.28Å; Y824-F832 HydrophobicContact CE1-CZ 4.29Å; Y824-F832 HydrophobicContact CE2-CE1 4.27Å; Y824-F832 AromaticContact CZ-CZ 3.87Å; Y824-F832 WeakPolarHBondContact OH-CZ 3.44Å; Y824-W837 HydrophobicContact CD2-CH2 4.17Å; Y824-W837 HydrophobicContact CD2-CZ2 4.07Å; Y824-V838 HydrophobicContact CD2-CG1 4.49Å; Y824-V838 HydrophobicContact CD2-CG2 3.75Å; Y824-V838 HydrophobicContact CE2-CG1 3.77Å; Y824-V838 HydrophobicContact CE2-CG2 3.86Å; Y824-Q851 HydrophobicContact CD2-CB 4.43Å; Y824-Q851 HydrophobicContact CE2-CB 3.99Å; Y824-Q851 HydrophobicContact CE2-CG 4.07Å; Y824-Q851 PolarHBondContact OH-NE2 3.46Å; Y824-Q851 VanDerWaalsContact OH-NE2 3.09Å; Y824-Q851 PolarHBondContact OH-OE1 3.23Å; Y824-Q851 VanDerWaalsContact OH-OE1 3.05Å
825	L	89.7	Confident	90.5	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-55.5	-42.4	-179.9	178	61.6	0	0	0	112.8	I673 M776 C821 L822 M828 L829	I673-L825 HydrophobicContact CG2-CD1 4.18Å; I673-L825 HydrophobicContact CG2-CD2 4.37Å; M776-L825 HydrophobicContact CE-CD2 4.41Å; C821-L825 WeakPolarHBondContact O-CB 3.35Å; C821-L825 PolarHBondContact O-N 3.38Å; L822-L825 PolarHBondContact O-N 2.84Å; L825-M828 HydrophobicContact CD1-CE 3.68Å; L825-M828 WeakPolarHBondContact O-CB 3.49Å; L825-M828 PolarHBondContact O-N 3.24Å; L825-L829 HydrophobicContact CD1-CD1 4.08Å; L825-L829 HydrophobicContact CD1-CD2 4.37Å; L825-L829 HydrophobicContact CD1-CG 3.94Å; L825-L829 HydrophobicContact CG-CD1 3.9Å; L825-L829 HydrophobicContact CG-CG 4.18Å; L825-L829 WeakPolarHBondContact O-CB 3.38Å; L825-L829 VanDerWaalsContact O-CG 3.26Å; L825-L829 WeakPolarHBondContact O-CG 3.39Å; L825-L829 PolarHBondContact O-N 3.18Å
826	I	89.1	Confident	90.4	Very high	41 Å²	41	33 Å²	33	21%	0.21	18%	0.175	C	C	.	.	H	α-helix	trans	-71.5	-45.7	-174.9	-61.3	165.7	0	0	0	112.5	L822 Y824 M828 L829 M830 I881	L822-I826 HydrophobicContact CD1-CD1 3.76Å; L822-I826 HydrophobicContact CD1-CG1 4.13Å; L822-I826 HydrophobicContact CG-CD1 4.01Å; L822-I826 PolarHBondContact O-N 2.95Å; Y824-I826 VanDerWaalsContact C-N 3.34Å; Y824-I826 PolarHBondContact O-N 3.47Å; I826-M828 VanDerWaalsContact C-N 3.26Å; I826-M828 PolarHBondContact O-N 3.05Å; I826-L829 PolarHBondContact O-N 3.07Å; I826-M830 HydrophobicContact CG2-CE 4.2Å; I826-M830 HydrophobicContact CG2-SD 4.24Å; I826-M830 WeakPolarHBondContact O-CG 3.37Å; I826-M830 PolarHBondContact O-N 3.28Å; I826-I881 HydrophobicContact CB-CD1 3.73Å; I826-I881 HydrophobicContact CD1-CD1 3.52Å; I826-I881 HydrophobicContact CD1-CG1 3.65Å; I826-I881 HydrophobicContact CG1-CD1 4.22Å; I826-I881 HydrophobicContact CG2-CD1 3.7Å
827	P	89.4	Confident	90.3	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-52.5	-40.6	166.7	-30.1	35.7	0	0	0	114	Q823 Y824 M830 D831 F832 V838	Q823-P827 VanDerWaalsContact O-CD 3.24Å; Q823-P827 WeakPolarHBondContact O-CD 3.34Å; Q823-P827 WeakPolarHBondContact O-CG 3.34Å; Y824-P827 WeakPolarHBondContact O-CD 3.4Å; P827-M830 CarbonylContact O-C 3.57Å; P827-M830 PolarHBondContact O-N 2.84Å; P827-D831 PolarHBondContact O-N 3.21Å; P827-F832 HydrophobicContact CB-CD1 4.08Å; P827-F832 HydrophobicContact CB-CE1 4.32Å; P827-F832 WeakPolarHBondContact O-CA 3.06Å; P827-F832 PolarHBondContact O-N 3.36Å; P827-V838 HydrophobicContact CB-CG2 4Å; P827-V838 HydrophobicContact CG-CG2 4.27Å
828	M	87.2	Confident	90.2	Very high	17 Å²	17	33.2 Å²	33.2	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-44.6	175.1	-173.5	-156.7	80.2	0	0	112.1	K772 Y824 L825 I826 M830 D831 F832	K772-M828 HydrophobicContact CD-CE 3.77Å; Y824-M828 PolarHBondContact O-N 3.28Å; L825-M828 HydrophobicContact CD1-CE 3.68Å; L825-M828 WeakPolarHBondContact O-CB 3.49Å; L825-M828 PolarHBondContact O-N 3.24Å; I826-M828 VanDerWaalsContact C-N 3.26Å; I826-M828 PolarHBondContact O-N 3.05Å; M828-M830 PolarHBondContact O-N 3.14Å; M828-D831 PolarHBondContact O-N 2.84Å; M828-D831 VanDerWaalsContact O-N 3.08Å; M828-F832 HydrophobicContact CB-CE1 3.85Å; M828-F832 HydrophobicContact CB-CE2 4.43Å; M828-F832 HydrophobicContact CB-CZ 3.66Å; M828-F832 HydrophobicContact CG-CE1 4.48Å; M828-F832 HydrophobicContact CG-CE2 4.22Å; M828-F832 HydrophobicContact CG-CZ 3.79Å
829	L	84.1	Confident	90	Very high	28 Å²	28	34.2 Å²	34.2	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-19.7	175.8	-71.5	177.2	0	0	0	113.3	R769 L773 L825 I826	R769-L829 HydrophobicContact CB-CD2 3.92Å; R769-L829 WeakPolarHBondContact CD-O 3.34Å; R769-L829 HydrophobicContact CG-CD2 3.64Å; R769-L829 PolarHBondContact NH1-O 3.19Å; L773-L829 HydrophobicContact CD2-CD1 3.89Å; L773-L829 HydrophobicContact CG-CD1 4.35Å; L825-L829 HydrophobicContact CD1-CD1 4.08Å; L825-L829 HydrophobicContact CD1-CD2 4.37Å; L825-L829 HydrophobicContact CD1-CG 3.94Å; L825-L829 HydrophobicContact CG-CD1 3.9Å; L825-L829 HydrophobicContact CG-CG 4.18Å; L825-L829 WeakPolarHBondContact O-CB 3.38Å; L825-L829 VanDerWaalsContact O-CG 3.26Å; L825-L829 WeakPolarHBondContact O-CG 3.39Å; L825-L829 PolarHBondContact O-N 3.18Å; I826-L829 PolarHBondContact O-N 3.07Å
830	M	85.9	Confident	89.8	Confident	107 Å²	107	37.3 Å²	37.3	53%	0.527	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	14.5	174.7	-69.2	-175.6	168	0	0	113.5	I826 P827 M828 F832 P833	I826-M830 HydrophobicContact CG2-CE 4.2Å; I826-M830 HydrophobicContact CG2-SD 4.24Å; I826-M830 WeakPolarHBondContact O-CG 3.37Å; I826-M830 PolarHBondContact O-N 3.28Å; P827-M830 CarbonylContact O-C 3.57Å; P827-M830 PolarHBondContact O-N 2.84Å; M828-M830 PolarHBondContact O-N 3.14Å; M830-F832 VanDerWaalsContact C-N 3.28Å; M830-F832 PolarHBondContact O-N 2.95Å; M830-P833 HydrophobicContact CB-CG 4.36Å
831	D	84.9	Confident	89.5	Confident	99 Å²	99	38.7 Å²	38.7	53%	0.529	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	36.2	179	-51.2	-57.1	0	0	0	113.2	R769 P827 M828	R769-D831 IonicContact CZ-OD1 3.97Å; R769-D831 VanDerWaalsContact CZ-OD1 3.29Å; R769-D831 IonicContact CZ-OD2 2.62Å; R769-D831 VanDerWaalsContact NH1-CG 3.31Å; R769-D831 IonicContact NH1-OD1 3.43Å; R769-D831 PolarHBondContact NH1-OD1 3.47Å; R769-D831 IonicContact NH1-OD2 2.73Å; R769-D831 PolarHBondContact NH1-OD2 3.09Å; R769-D831 VanDerWaalsContact NH2-CG 3.32Å; R769-D831 IonicContact NH2-OD1 3.44Å; R769-D831 PolarHBondContact NH2-OD1 3.32Å; R769-D831 IonicContact NH2-OD2 3.8Å; R769-D831 PolarHBondContact NH2-OD2 3.32Å; P827-D831 PolarHBondContact O-N 3.21Å; M828-D831 PolarHBondContact O-N 2.84Å; M828-D831 VanDerWaalsContact O-N 3.08Å
832	F	88.4	Confident	89.4	Confident	28 Å²	28	47.3 Å²	47.3	12%	0.123	24%	0.238	C	C	.	.			trans	48.7	76	178.8	-60.8	-62.5	0	0	0	115	Y824 P827 M828 M830 V838 K839 E844	Y824-F832 HydrophobicContact CE1-CZ 4.29Å; Y824-F832 HydrophobicContact CE2-CE1 4.27Å; Y824-F832 AromaticContact CZ-CZ 3.87Å; Y824-F832 WeakPolarHBondContact OH-CZ 3.44Å; P827-F832 HydrophobicContact CB-CD1 4.08Å; P827-F832 HydrophobicContact CB-CE1 4.32Å; P827-F832 WeakPolarHBondContact O-CA 3.06Å; P827-F832 PolarHBondContact O-N 3.36Å; M828-F832 HydrophobicContact CB-CE1 3.85Å; M828-F832 HydrophobicContact CB-CE2 4.43Å; M828-F832 HydrophobicContact CB-CZ 3.66Å; M828-F832 HydrophobicContact CG-CE1 4.48Å; M828-F832 HydrophobicContact CG-CE2 4.22Å; M828-F832 HydrophobicContact CG-CZ 3.79Å; M830-F832 VanDerWaalsContact C-N 3.28Å; M830-F832 PolarHBondContact O-N 2.95Å; F832-V838 HydrophobicContact CD1-CB 4.26Å; F832-V838 HydrophobicContact CD1-CG1 4.06Å; F832-V838 HydrophobicContact CE1-CB 4.41Å; F832-V838 HydrophobicContact CE1-CG1 3.96Å; F832-V838 HydrophobicContact CE1-CG2 4.44Å; F832-K839 HydrophobicContact CB-CD 4.18Å; F832-K839 WeakPolarHBondContact O-CD 3.41Å; F832-K839 WeakPolarHBondContact O-CE 3.23Å; F832-K839 PolarHBondContact O-NZ 3.27Å; F832-E844 HydrophobicContact CD2-CG 4Å; F832-E844 HydrophobicContact CE2-CG 4.43Å; F832-E844 HydrophobicContact CG-CG 4.35Å
833	P	89	Confident	89.3	Confident	32 Å²	32	44.3 Å²	44.3	21%	0.208	22%	0.223	C	C	.	.			trans	-69.1	153.2	-179.9	30.8	-35.4	0	0	0	111.9	M830 D835 S836	M830-P833 HydrophobicContact CB-CG 4.36Å; P833-D835 VanDerWaalsContact C-N 3.28Å; P833-D835 WeakPolarHBondContact CB-OD1 3.41Å; P833-D835 PolarHBondContact O-N 3.27Å; P833-S836 VanDerWaalsContact O-CB 3.27Å; P833-S836 WeakPolarHBondContact O-CB 3.24Å; P833-S836 PolarHBondContact O-N 3.11Å; P833-S836 PolarHBondContact O-OG 3.16Å
834	P	88.3	Confident	89.1	Confident	109 Å²	109	47.2 Å²	47.2	71%	0.708	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.2	-166.3	28	-36.3	0	0	0	114.3	S836	P834-S836 VanDerWaalsContact C-N 3.32Å
835	D	88.7	Confident	88.9	Confident	58 Å²	58	54.5 Å²	54.5	31%	0.31	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.3	175	62.9	-29.5	0	0	0	113.4	P833 R840 T874 S875	P833-D835 VanDerWaalsContact C-N 3.28Å; P833-D835 WeakPolarHBondContact CB-OD1 3.41Å; P833-D835 PolarHBondContact O-N 3.27Å; D835-R840 VanDerWaalsContact O-CD 3.27Å; D835-R840 WeakPolarHBondContact O-CD 3.48Å; D835-T874 PolarHBondContact O-OG1 2.85Å; D835-S875 WeakPolarHBondContact OD2-CA 3.41Å; D835-S875 WeakPolarHBondContact OD2-CB 3.5Å; D835-S875 PolarHBondContact OD2-OG 3.46Å
836	S	90.2	Very high	88.9	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.007	28%	0.282	C	S	.	.	S	Bend	trans	-74.5	151	-175.4	67	0	0	0	0	114.6	P833 P834 V838 K839 R840 E878	P833-S836 VanDerWaalsContact O-CB 3.27Å; P833-S836 WeakPolarHBondContact O-CB 3.24Å; P833-S836 PolarHBondContact O-N 3.11Å; P833-S836 PolarHBondContact O-OG 3.16Å; P834-S836 VanDerWaalsContact C-N 3.32Å; S836-V838 PolarHBondContact O-N 3.24Å; S836-K839 PolarHBondContact O-N 3.28Å; S836-K839 WeakPolarHBondContact OG-CB 3.46Å; S836-K839 PolarHBondContact OG-N 3.44Å; S836-R840 WeakPolarHBondContact O-CB 3.44Å; S836-R840 VanDerWaalsContact O-CG 3.24Å; S836-R840 WeakPolarHBondContact O-CG 3.47Å; S836-R840 PolarHBondContact O-N 3.07Å; S836-E878 WeakPolarHBondContact CA-OE1 3.26Å; S836-E878 WeakPolarHBondContact CB-OE1 3.06Å
837	W	92.1	Very high	89	Confident	17 Å²	17	57.6 Å²	57.6	6%	0.064	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-35.2	177.7	79.1	-97	0	0	0	112.4	Q823 Y824 C841 W854 A855 K858 E878	Q823-W837 PolarHBondContact O-NE1 3.06Å; Y824-W837 HydrophobicContact CD2-CH2 4.17Å; Y824-W837 HydrophobicContact CD2-CZ2 4.07Å; W837-C841 VanDerWaalsContact O-CB 3.24Å; W837-C841 WeakPolarHBondContact O-CB 3.07Å; W837-C841 PolarHBondContact O-N 2.9Å; W837-C841 PolarHBondContact O-SG 3.42Å; W837-W854 HydrophobicContact CZ3-CB 4.3Å; W837-A855 HydrophobicContact CH2-CB 3.83Å; W837-A855 HydrophobicContact CZ2-CB 4.07Å; W837-K858 HydrophobicContact CD2-CD 4.17Å; W837-K858 HydrophobicContact CG-CD 4.31Å; W837-E878 PolarHBondContact N-OE1 3.31Å
838	V	92.5	Very high	89.1	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-49.6	176.7	-178.1	0	0	0	0	110.5	Y824 P827 F832 S836 C841 K842 L843	Y824-V838 HydrophobicContact CD2-CG1 4.49Å; Y824-V838 HydrophobicContact CD2-CG2 3.75Å; Y824-V838 HydrophobicContact CE2-CG1 3.77Å; Y824-V838 HydrophobicContact CE2-CG2 3.86Å; P827-V838 HydrophobicContact CB-CG2 4Å; P827-V838 HydrophobicContact CG-CG2 4.27Å; F832-V838 HydrophobicContact CD1-CB 4.26Å; F832-V838 HydrophobicContact CD1-CG1 4.06Å; F832-V838 HydrophobicContact CE1-CB 4.41Å; F832-V838 HydrophobicContact CE1-CG1 3.96Å; F832-V838 HydrophobicContact CE1-CG2 4.44Å; S836-V838 PolarHBondContact O-N 3.24Å; V838-C841 PolarHBondContact O-N 3.13Å; V838-K842 PolarHBondContact O-N 3.12Å; V838-K842 VanDerWaalsContact O-N 3.14Å; V838-L843 HydrophobicContact CG1-CB 4.11Å; V838-L843 PolarHBondContact O-N 3.47Å
839	K	90.1	Very high	89.4	Confident	70 Å²	70	66.8 Å²	66.8	30%	0.304	33%	0.332	S	S	.	.	H	α-helix	trans	-69.6	-45.2	-178.1	-150	125	-175.3	158.2	0	111.7	F832 S836 C841 K842 E844	F832-K839 HydrophobicContact CB-CD 4.18Å; F832-K839 WeakPolarHBondContact O-CD 3.41Å; F832-K839 WeakPolarHBondContact O-CE 3.23Å; F832-K839 PolarHBondContact O-NZ 3.27Å; S836-K839 PolarHBondContact O-N 3.28Å; S836-K839 WeakPolarHBondContact OG-CB 3.46Å; S836-K839 PolarHBondContact OG-N 3.44Å; K839-C841 VanDerWaalsContact C-N 3.27Å; K839-C841 PolarHBondContact O-N 3.06Å; K839-K842 PolarHBondContact O-N 3.18Å; K839-E844 VanDerWaalsContact CD-OE2 3.25Å; K839-E844 WeakPolarHBondContact CD-OE2 3.48Å; K839-E844 WeakPolarHBondContact CE-OE2 3.45Å; K839-E844 IonicContact NZ-OE1 3.37Å; K839-E844 PolarHBondContact NZ-OE1 3.25Å; K839-E844 IonicContact NZ-OE2 3.49Å; K839-E844 PolarHBondContact NZ-OE2 3.04Å
840	R	89.1	Confident	89.9	Confident	82 Å²	82	70 Å²	70	31%	0.309	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-31.4	177	-70	175.4	65.6	-149.7	-3	113.1	D835 S836 F871 P872 T874	D835-R840 VanDerWaalsContact O-CD 3.27Å; D835-R840 WeakPolarHBondContact O-CD 3.48Å; S836-R840 WeakPolarHBondContact O-CB 3.44Å; S836-R840 VanDerWaalsContact O-CG 3.24Å; S836-R840 WeakPolarHBondContact O-CG 3.47Å; S836-R840 PolarHBondContact O-N 3.07Å; R840-F871 HydrophobicContact CB-CD2 4.16Å; R840-F871 HydrophobicContact CB-CE2 4.17Å; R840-P872 PolarHBondContact NH1-O 3.25Å; R840-P872 VanDerWaalsContact NH1-O 3.11Å; R840-T874 WeakPolarHBondContact CD-OG1 3.36Å; R840-T874 VanDerWaalsContact NH1-CG2 3.32Å; R840-T874 PolarHBondContact NH1-OG1 3.44Å
841	C	90.1	Very high	90.3	Very high	30 Å²	30	65.4 Å²	65.4	20%	0.203	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3	173.2	-65.3	0	0	0	0	114	W837 V838 K839 L843 F871	W837-C841 VanDerWaalsContact O-CB 3.24Å; W837-C841 WeakPolarHBondContact O-CB 3.07Å; W837-C841 PolarHBondContact O-N 2.9Å; W837-C841 PolarHBondContact O-SG 3.42Å; V838-C841 PolarHBondContact O-N 3.13Å; K839-C841 VanDerWaalsContact C-N 3.27Å; K839-C841 PolarHBondContact O-N 3.06Å; C841-L843 HydrophobicContact CB-CD1 3.27Å; C841-F871 VanDerWaalsContact SG-CD2 3.58Å
842	K	90.3	Very high	90.8	Very high	185 Å²	185	62.6 Å²	62.6	80%	0.804	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	34.5	-176	-54.5	-176.4	178.1	-176	0	115.2	V838 K839	V838-K842 PolarHBondContact O-N 3.12Å; V838-K842 VanDerWaalsContact O-N 3.14Å; K839-K842 PolarHBondContact O-N 3.18Å
843	L	90.8	Very high	91.2	Very high	5 Å²	5	64.1 Å²	64.1	3%	0.026	32%	0.317	C	S	.	.			trans	-88.6	-7.1	179.9	-84.5	98.2	0	0	0	115.5	V838 C841 N845 A846 Q850 Q851 W854	V838-L843 HydrophobicContact CG1-CB 4.11Å; V838-L843 PolarHBondContact O-N 3.47Å; C841-L843 HydrophobicContact CB-CD1 3.27Å; L843-N845 PolarHBondContact O-N 3.38Å; L843-N845 VanDerWaalsContact O-N 3.15Å; L843-A846 HydrophobicContact CB-CB 4.35Å; L843-A846 HydrophobicContact CG-CB 4.29Å; L843-A846 WeakPolarHBondContact O-CB 3.2Å; L843-A846 PolarHBondContact O-N 3.24Å; L843-Q850 HydrophobicContact CD2-CG 4.2Å; L843-Q851 HydrophobicContact CB-CG 4.4Å; L843-Q851 HydrophobicContact CD2-CG 4.34Å; L843-Q851 WeakPolarHBondContact O-CG 3.29Å; L843-Q851 PolarHBondContact O-NE2 2.87Å; L843-W854 HydrophobicContact CD2-CB 3.83Å; L843-W854 HydrophobicContact CD2-CG 4Å
844	E	88.7	Confident	91.5	Very high	65 Å²	65	67.4 Å²	67.4	30%	0.304	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-39.6	-177.8	-172.1	169.5	-169.8	0	0	113.3	F832 K839 Q851	F832-E844 HydrophobicContact CD2-CG 4Å; F832-E844 HydrophobicContact CE2-CG 4.43Å; F832-E844 HydrophobicContact CG-CG 4.35Å; K839-E844 VanDerWaalsContact CD-OE2 3.25Å; K839-E844 WeakPolarHBondContact CD-OE2 3.48Å; K839-E844 WeakPolarHBondContact CE-OE2 3.45Å; K839-E844 IonicContact NZ-OE1 3.37Å; K839-E844 PolarHBondContact NZ-OE1 3.25Å; K839-E844 IonicContact NZ-OE2 3.49Å; K839-E844 PolarHBondContact NZ-OE2 3.04Å; E844-Q851 PolarHBondContact O-NE2 2.9Å
845	N	87.6	Confident	91.8	Very high	159 Å²	159	62.2 Å²	62.2	85%	0.85	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	14.9	178.2	-59	-19.2	0	0	0	113.3	L843	L843-N845 PolarHBondContact O-N 3.38Å; L843-N845 VanDerWaalsContact O-N 3.15Å
846	A	90.5	Very high	92.1	Very high	21 Å²	21	61.7 Å²	61.7	17%	0.174	29%	0.289	C	S	.	.	S	Bend	trans	-80.5	161.8	174.5	0	0	0	0	0	111	L843 Q850 Q851	L843-A846 HydrophobicContact CB-CB 4.35Å; L843-A846 HydrophobicContact CG-CB 4.29Å; L843-A846 WeakPolarHBondContact O-CB 3.2Å; L843-A846 PolarHBondContact O-N 3.24Å; A846-Q850 HydrophobicContact CB-CB 4.39Å; A846-Q850 HydrophobicContact CB-CG 4.3Å; A846-Q851 HydrophobicContact CB-CG 4.37Å; A846-Q851 PolarHBondContact O-NE2 3.09Å; A846-Q851 VanDerWaalsContact O-NE2 3.07Å
847	D	92.1	Very high	92.4	Very high	90 Å²	90	66.8 Å²	66.8	48%	0.481	31%	0.311	S	S	.	.			trans	-60.6	147.9	174.8	177.3	61.8	0	0	0	112.1	F849 Q850 Q851	D847-F849 PolarHBondContact O-N 3.48Å; D847-F849 WeakPolarHBondContact OD2-CB 3.4Å; D847-F849 PolarHBondContact OD2-N 3.36Å; D847-Q850 WeakPolarHBondContact O-CA 3.18Å; D847-Q850 WeakPolarHBondContact O-CB 3.5Å; D847-Q850 PolarHBondContact O-N 3.43Å; D847-Q851 WeakPolarHBondContact O-CG 3.42Å; D847-Q851 PolarHBondContact O-N 2.92Å
848	W	90.9	Very high	92.5	Very high	98 Å²	98	66.3 Å²	66.3	37%	0.371	31%	0.31	S	S	.	.	H	α-helix	trans	-57	-34.1	-177.5	75	-85.5	0	0	0	112.4	V671 F675 F676 Q851 Y852	V671-W848 HydrophobicContact CG1-CE3 4.08Å; V671-W848 HydrophobicContact CG1-CZ3 3.88Å; F675-W848 HydrophobicContact CB-CB 4.14Å; F676-W848 HydrophobicContact CE1-CB 4.08Å; F676-W848 AromaticContact CE1-CD1 3.95Å; F676-W848 AromaticContact CE1-CD2 3.96Å; F676-W848 HydrophobicContact CE1-CD2 3.96Å; F676-W848 AromaticContact CE1-CG 3.68Å; F676-W848 HydrophobicContact CE1-CG 3.68Å; F676-W848 AromaticContact CZ-CD2 3.88Å; F676-W848 HydrophobicContact CZ-CD2 3.88Å; F676-W848 HydrophobicContact CZ-CE3 4.2Å; F676-W848 HydrophobicContact CZ-CG 4.12Å; W848-Q851 PolarHBondContact O-N 3.34Å; W848-Y852 WeakPolarHBondContact O-CB 3.48Å; W848-Y852 PolarHBondContact O-N 3.19Å
849	F	93.8	Very high	92.6	Very high	118 Å²	118	66.3 Å²	66.3	52%	0.518	31%	0.31	S	S	.	.	H	α-helix	trans	-70.6	-35.7	177.7	-177	-99.9	0	0	0	111.4	D847 T853	D847-F849 PolarHBondContact O-N 3.48Å; D847-F849 WeakPolarHBondContact OD2-CB 3.4Å; D847-F849 PolarHBondContact OD2-N 3.36Å; F849-T853 VanDerWaalsContact O-CB 3.27Å; F849-T853 WeakPolarHBondContact O-CB 3.3Å; F849-T853 PolarHBondContact O-N 3.14Å; F849-T853 PolarHBondContact O-OG1 2.83Å
850	Q	94.2	Very high	92.9	Very high	95 Å²	95	65.2 Å²	65.2	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-68.2	-43.2	172.8	-176.6	176.7	-12.2	0	0	111	L843 A846 D847 T853 W854	L843-Q850 HydrophobicContact CD2-CG 4.2Å; A846-Q850 HydrophobicContact CB-CB 4.39Å; A846-Q850 HydrophobicContact CB-CG 4.3Å; D847-Q850 WeakPolarHBondContact O-CA 3.18Å; D847-Q850 WeakPolarHBondContact O-CB 3.5Å; D847-Q850 PolarHBondContact O-N 3.43Å; Q850-T853 PolarHBondContact O-N 3.05Å; Q850-W854 VanDerWaalsContact O-CD1 3.31Å; Q850-W854 PolarHBondContact O-N 2.95Å; Q850-W854 VanDerWaalsContact O-N 3.08Å
851	Q	94.1	Very high	93.2	Very high	12 Å²	12	61.6 Å²	61.6	6%	0.056	29%	0.293	C	S	.	.	H	α-helix	trans	-57	-50	173.6	-66.3	173.5	-11	0	0	111.5	F675 Y824 L843 E844 A846 D847 W848 A855	F675-Q851 HydrophobicContact CD1-CB 3.65Å; F675-Q851 HydrophobicContact CE1-CB 3.67Å; Y824-Q851 HydrophobicContact CD2-CB 4.43Å; Y824-Q851 HydrophobicContact CE2-CB 3.99Å; Y824-Q851 HydrophobicContact CE2-CG 4.07Å; Y824-Q851 PolarHBondContact OH-NE2 3.46Å; Y824-Q851 VanDerWaalsContact OH-NE2 3.09Å; Y824-Q851 PolarHBondContact OH-OE1 3.23Å; Y824-Q851 VanDerWaalsContact OH-OE1 3.05Å; L843-Q851 HydrophobicContact CB-CG 4.4Å; L843-Q851 HydrophobicContact CD2-CG 4.34Å; L843-Q851 WeakPolarHBondContact O-CG 3.29Å; L843-Q851 PolarHBondContact O-NE2 2.87Å; E844-Q851 PolarHBondContact O-NE2 2.9Å; A846-Q851 HydrophobicContact CB-CG 4.37Å; A846-Q851 PolarHBondContact O-NE2 3.09Å; A846-Q851 VanDerWaalsContact O-NE2 3.07Å; D847-Q851 WeakPolarHBondContact O-CG 3.42Å; D847-Q851 PolarHBondContact O-N 2.92Å; W848-Q851 PolarHBondContact O-N 3.34Å; Q851-A855 WeakPolarHBondContact O-CB 3.35Å; Q851-A855 PolarHBondContact O-N 2.88Å
852	Y	95.7	Very high	93.4	Very high	40 Å²	40	60.5 Å²	60.5	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-45	176.1	173.7	-108.8	0	0	0	112.6	V671 F675 H817 W848 W854 A855 L856	V671-Y852 HydrophobicContact CG2-CE2 4.49Å; F675-Y852 AromaticContact CE2-CD2 3.69Å; F675-Y852 HydrophobicContact CE2-CD2 3.69Å; F675-Y852 HydrophobicContact CE2-CG 4.29Å; F675-Y852 VanDerWaalsContact CZ-CA 3.5Å; F675-Y852 HydrophobicContact CZ-CD2 4.01Å; F675-Y852 HydrophobicContact CZ-CG 4.46Å; H817-Y852 AromaticContact ND1-CE2 3.57Å; H817-Y852 AromaticContact ND1-CZ 3.62Å; H817-Y852 PolarHBondContact ND1-OH 2.99Å; W848-Y852 WeakPolarHBondContact O-CB 3.48Å; W848-Y852 PolarHBondContact O-N 3.19Å; Y852-W854 PolarHBondContact O-N 2.96Å; Y852-A855 PolarHBondContact O-N 3.4Å; Y852-L856 HydrophobicContact CE1-CD2 4.1Å; Y852-L856 VanDerWaalsContact O-CB 3.28Å; Y852-L856 WeakPolarHBondContact O-CB 3.35Å; Y852-L856 PolarHBondContact O-N 2.97Å
853	T	95.6	Very high	93.6	Very high	60 Å²	60	52 Å²	52	37%	0.368	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-44.8	-179.2	-63.4	0	0	0	0	112	F849 Q850 L856 F857	F849-T853 VanDerWaalsContact O-CB 3.27Å; F849-T853 WeakPolarHBondContact O-CB 3.3Å; F849-T853 PolarHBondContact O-N 3.14Å; F849-T853 PolarHBondContact O-OG1 2.83Å; Q850-T853 PolarHBondContact O-N 3.05Å; T853-L856 PolarHBondContact O-N 3.45Å; T853-F857 WeakPolarHBondContact O-CB 3.45Å; T853-F857 PolarHBondContact O-N 2.97Å
854	W	95	Very high	93.8	Very high	100 Å²	100	54.9 Å²	54.9	38%	0.379	26%	0.264	S	S	.	.	H	α-helix	trans	-72.9	-33.8	177.6	-77.3	98.5	0	0	0	113	W837 L843 Q850 Y852 F857 K858	W837-W854 HydrophobicContact CZ3-CB 4.3Å; L843-W854 HydrophobicContact CD2-CB 3.83Å; L843-W854 HydrophobicContact CD2-CG 4Å; Q850-W854 VanDerWaalsContact O-CD1 3.31Å; Q850-W854 PolarHBondContact O-N 2.95Å; Q850-W854 VanDerWaalsContact O-N 3.08Å; Y852-W854 PolarHBondContact O-N 2.96Å; W854-F857 HydrophobicContact CE3-CD1 4.07Å; W854-F857 HydrophobicContact CZ3-CD1 4.05Å; W854-F857 HydrophobicContact CZ3-CE1 4.3Å; W854-K858 WeakPolarHBondContact O-CB 3.4Å; W854-K858 PolarHBondContact O-N 3.16Å
855	A	95.2	Very high	94.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-41.7	171.6	0	0	0	0	0	111.8	F675 A820 W837 Q851 Y852 K858 A859	F675-A855 HydrophobicContact CZ-CB 4.2Å; A820-A855 HydrophobicContact CB-CB 4.29Å; W837-A855 HydrophobicContact CH2-CB 3.83Å; W837-A855 HydrophobicContact CZ2-CB 4.07Å; Q851-A855 WeakPolarHBondContact O-CB 3.35Å; Q851-A855 PolarHBondContact O-N 2.88Å; Y852-A855 PolarHBondContact O-N 3.4Å; A855-K858 PolarHBondContact O-N 3.45Å; A855-A859 PolarHBondContact O-N 2.87Å
856	L	95.5	Very high	94.4	Very high	47 Å²	47	54.7 Å²	54.7	25%	0.246	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-45	177.1	-175.8	67.2	0	0	0	111.2	A820 Y852 T853 K858 A859 M860	A820-L856 HydrophobicContact CB-CB 4.03Å; A820-L856 HydrophobicContact CB-CD1 3.99Å; Y852-L856 HydrophobicContact CE1-CD2 4.1Å; Y852-L856 VanDerWaalsContact O-CB 3.28Å; Y852-L856 WeakPolarHBondContact O-CB 3.35Å; Y852-L856 PolarHBondContact O-N 2.97Å; T853-L856 PolarHBondContact O-N 3.45Å; L856-K858 VanDerWaalsContact C-N 3.27Å; L856-K858 PolarHBondContact O-N 3.33Å; L856-A859 PolarHBondContact O-N 3.3Å; L856-M860 HydrophobicContact CD1-CG 4Å; L856-M860 HydrophobicContact CD1-SD 4.46Å; L856-M860 HydrophobicContact CG-CG 4.08Å; L856-M860 VanDerWaalsContact O-CB 3.31Å; L856-M860 WeakPolarHBondContact O-CB 3.25Å; L856-M860 WeakPolarHBondContact O-CG 3.48Å; L856-M860 PolarHBondContact O-N 2.84Å
857	F	95.3	Very high	94.4	Very high	108 Å²	108	55 Å²	55	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-55	-43.7	172.7	177.8	-106.1	0	0	0	111.7	T853 W854 S861	T853-F857 WeakPolarHBondContact O-CB 3.45Å; T853-F857 PolarHBondContact O-N 2.97Å; W854-F857 HydrophobicContact CE3-CD1 4.07Å; W854-F857 HydrophobicContact CZ3-CD1 4.05Å; W854-F857 HydrophobicContact CZ3-CE1 4.3Å; F857-S861 VanDerWaalsContact O-CB 3.26Å; F857-S861 WeakPolarHBondContact O-CB 3.38Å; F857-S861 PolarHBondContact O-N 3.48Å; F857-S861 PolarHBondContact O-OG 3.5Å
858	K	94.8	Very high	94.3	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-46.5	176.9	-165.7	175.9	-173.4	-56	0	112.4	W837 W854 A855 L856 S861 H862 Y868 T882	W837-K858 HydrophobicContact CD2-CD 4.17Å; W837-K858 HydrophobicContact CG-CD 4.31Å; W854-K858 WeakPolarHBondContact O-CB 3.4Å; W854-K858 PolarHBondContact O-N 3.16Å; A855-K858 PolarHBondContact O-N 3.45Å; L856-K858 VanDerWaalsContact C-N 3.27Å; L856-K858 PolarHBondContact O-N 3.33Å; K858-S861 PolarHBondContact O-N 3.37Å; K858-H862 PolarHBondContact NZ-CE1 3.22Å; K858-H862 PolarHBondContact NZ-NE2 3.42Å; K858-H862 PolarHBondContact O-N 3.4Å; K858-Y868 WeakPolarHBondContact CE-O 3.38Å; K858-Y868 WeakPolarHBondContact CG-O 3.4Å; K858-T882 PolarHBondContact NZ-OG1 3.11Å
859	A	95.8	Very high	94.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.1	-43.3	178.3	0	0	0	0	0	113.3	G816 N819 A820 A855 L856 S861 H862 M863	G816-A859 WeakPolarHBondContact O-CB 3.32Å; N819-A859 HydrophobicContact CB-CB 4.01Å; A820-A859 HydrophobicContact CB-CB 3.96Å; A855-A859 PolarHBondContact O-N 2.87Å; L856-A859 PolarHBondContact O-N 3.3Å; A859-S861 VanDerWaalsContact C-N 3.32Å; A859-S861 PolarHBondContact O-N 2.9Å; A859-H862 PolarHBondContact O-N 3.41Å; A859-M863 PolarHBondContact O-N 3.46Å
860	M	94.7	Very high	93.9	Very high	46 Å²	46	55 Å²	55	23%	0.227	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-37.4	175	-68.3	-61.6	-63.4	0	0	111.5	L856 H862 M863 L864	L856-M860 HydrophobicContact CD1-CG 4Å; L856-M860 HydrophobicContact CD1-SD 4.46Å; L856-M860 HydrophobicContact CG-CG 4.08Å; L856-M860 VanDerWaalsContact O-CB 3.31Å; L856-M860 WeakPolarHBondContact O-CB 3.25Å; L856-M860 WeakPolarHBondContact O-CG 3.48Å; L856-M860 PolarHBondContact O-N 2.84Å; M860-H862 VanDerWaalsContact C-N 3.34Å; M860-H862 PolarHBondContact O-N 2.98Å; M860-M863 HydrophobicContact CE-CE 3.63Å; M860-M863 PolarHBondContact O-N 2.92Å; M860-M863 HydrophobicContact SD-CE 3.47Å; M860-M863 WeakPolarHBondContact SD-CE 3.41Å; M860-L864 HydrophobicContact CE-CD1 4.16Å; M860-L864 WeakPolarHBondContact O-CB 3.27Å; M860-L864 PolarHBondContact O-N 3.16Å
861	S	95.5	Very high	93.5	Very high	6 Å²	6	53.7 Å²	53.7	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-35.3	176.6	-60.9	0	0	0	0	112.6	F857 K858 A859 S865 I866 G867	F857-S861 VanDerWaalsContact O-CB 3.26Å; F857-S861 WeakPolarHBondContact O-CB 3.38Å; F857-S861 PolarHBondContact O-N 3.48Å; F857-S861 PolarHBondContact O-OG 3.5Å; K858-S861 PolarHBondContact O-N 3.37Å; A859-S861 VanDerWaalsContact C-N 3.32Å; A859-S861 PolarHBondContact O-N 2.9Å; S861-S865 PolarHBondContact O-N 3.34Å; S861-I866 PolarHBondContact O-N 2.86Å; S861-G867 CarbonylContact C-O 3.55Å; S861-G867 VanDerWaalsContact C-O 3.31Å; S861-G867 WeakPolarHBondContact CB-O 3.39Å; S861-G867 PolarHBondContact O-N 2.71Å
862	H	95.4	Very high	93.3	Very high	8 Å²	8	56.9 Å²	56.9	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-70.9	-41.6	169.7	-55.9	163.5	0	0	0	111.9	Q823 K858 A859 M860 S865 G867 S885 M886	Q823-H862 PolarHBondContact NE2-ND1 3.3Å; Q823-H862 PolarHBondContact OE1-CE1 3.22Å; K858-H862 PolarHBondContact NZ-CE1 3.22Å; K858-H862 PolarHBondContact NZ-NE2 3.42Å; K858-H862 PolarHBondContact O-N 3.4Å; A859-H862 PolarHBondContact O-N 3.41Å; M860-H862 VanDerWaalsContact C-N 3.34Å; M860-H862 PolarHBondContact O-N 2.98Å; H862-S865 PolarHBondContact O-N 3.24Å; H862-G867 PolarHBondContact CD2-O 2.99Å; H862-G867 VanDerWaalsContact CD2-O 3.27Å; H862-S885 VanDerWaalsContact ND1-CB 3.33Å; H862-S885 WeakPolarHBondContact ND1-CB 3.33Å; H862-S885 PolarHBondContact ND1-OG 3.37Å; H862-M886 HydrophobicContact CB-CG 4.07Å
863	M	95.2	Very high	93.1	Very high	6 Å²	6	56.8 Å²	56.8	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-67.1	-37.4	-176.8	-174.8	169.8	72.4	0	0	113.7	M812 A859 M860 S865	M812-M863 HydrophobicContact CB-CE 4.15Å; M812-M863 HydrophobicContact CB-SD 4.16Å; M812-M863 HydrophobicContact CE-CE 4.17Å; M812-M863 HydrophobicContact CE-CG 4.1Å; M812-M863 HydrophobicContact CE-SD 4.04Å; M812-M863 WeakPolarHBondContact O-CE 3.43Å; A859-M863 PolarHBondContact O-N 3.46Å; M860-M863 HydrophobicContact CE-CE 3.63Å; M860-M863 PolarHBondContact O-N 2.92Å; M860-M863 HydrophobicContact SD-CE 3.47Å; M860-M863 WeakPolarHBondContact SD-CE 3.41Å; M863-S865 VanDerWaalsContact C-N 3.33Å
864	L	94.5	Very high	92.8	Very high	66 Å²	66	57.6 Å²	57.6	35%	0.346	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	9.7	177.3	-59.2	178.1	0	0	0	112.7	M860 I866 Y893	M860-L864 HydrophobicContact CE-CD1 4.16Å; M860-L864 WeakPolarHBondContact O-CB 3.27Å; M860-L864 PolarHBondContact O-N 3.16Å; L864-I866 VanDerWaalsContact C-N 3.27Å; L864-I866 HydrophobicContact CB-CD1 3.82Å; L864-I866 HydrophobicContact CB-CG1 3.91Å; L864-I866 HydrophobicContact CD1-CD1 4.26Å; L864-I866 PolarHBondContact O-N 3.03Å; L864-Y893 HydrophobicContact CD2-CD2 4.45Å
865	S	94.1	Very high	92.5	Very high	91 Å²	91	53.8 Å²	53.8	64%	0.636	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	33	-179.6	56.1	0	0	0	0	115.5	S861 H862 M863	S861-S865 PolarHBondContact O-N 3.34Å; H862-S865 PolarHBondContact O-N 3.24Å; M863-S865 VanDerWaalsContact C-N 3.33Å
866	I	94.8	Very high	92.2	Very high	128 Å²	128	59.8 Å²	59.8	66%	0.656	32%	0.318	S	S	*	.			trans	-87.1	-43.8	-177.5	-58	173.2	0	0	0	111.9	S861 L864	S861-I866 PolarHBondContact O-N 2.86Å; L864-I866 VanDerWaalsContact C-N 3.27Å; L864-I866 HydrophobicContact CB-CD1 3.82Å; L864-I866 HydrophobicContact CB-CG1 3.91Å; L864-I866 HydrophobicContact CD1-CD1 4.26Å; L864-I866 PolarHBondContact O-N 3.03Å
867	G	90.5	Very high	91.8	Very high	27 Å²	27	58.5 Å²	58.5	28%	0.278	32%	0.316	S	S	.	.			trans	162.8	-169.4	-175.3	0	0	0	0	0	115.2	S861 H862	S861-G867 CarbonylContact C-O 3.55Å; S861-G867 VanDerWaalsContact C-O 3.31Å; S861-G867 WeakPolarHBondContact CB-O 3.39Å; S861-G867 PolarHBondContact O-N 2.71Å; H862-G867 PolarHBondContact CD2-O 2.99Å; H862-G867 VanDerWaalsContact CD2-O 3.27Å
868	Y	90.2	Very high	91.6	Very high	105 Å²	105	54 Å²	54	41%	0.412	30%	0.296	S	S	.	.			trans	-96.8	4.5	-166.9	-57.8	-74.1	0	0	0	115.8	K858 T882 M886	K858-Y868 WeakPolarHBondContact CE-O 3.38Å; K858-Y868 WeakPolarHBondContact CG-O 3.4Å; Y868-T882 HydrophobicContact CD1-CG2 3.79Å; Y868-T882 HydrophobicContact CE1-CG2 3.94Å; Y868-M886 HydrophobicContact CD1-SD 4.47Å; Y868-M886 HydrophobicContact CE1-CE 4.13Å; Y868-M886 HydrophobicContact CE1-SD 3.67Å
869	G	87.7	Confident	91.5	Very high	27 Å²	27	55 Å²	55	28%	0.278	31%	0.306	S	S	.	.	S	Bend	trans	83.2	-153.9	-164.2	0	0	0	0	0	112.1	F871	G869-F871 VanDerWaalsContact C-N 3.3Å; G869-F871 PolarHBondContact O-N 2.8Å
870	R	87.1	Confident	91.4	Very high	175 Å²	175	62.8 Å²	62.8	66%	0.66	34%	0.336	S	S	*	.	S	Bend	trans	-64.8	-29.4	-174.5	-173.3	176.1	-179.1	88.4	1.8	114.1
871	F	86.5	Confident	91.3	Very high	67 Å²	67	61.9 Å²	61.9	29%	0.294	33%	0.331	S	S	.	.	S	Bend	trans	-142.1	147.9	-178.6	-59.9	-62.1	0	0	0	110.5	R840 C841 G869	R840-F871 HydrophobicContact CB-CD2 4.16Å; R840-F871 HydrophobicContact CB-CE2 4.17Å; C841-F871 VanDerWaalsContact SG-CD2 3.58Å; G869-F871 VanDerWaalsContact C-N 3.3Å; G869-F871 PolarHBondContact O-N 2.8Å
872	P	90.2	Very high	91.2	Very high	80 Å²	80	61.8 Å²	61.8	52%	0.519	33%	0.331	S	S	.	.			trans	-65	153.8	167.1	30.1	-35.3	0	0	0	110.7	R840 T874	R840-P872 PolarHBondContact NH1-O 3.25Å; R840-P872 VanDerWaalsContact NH1-O 3.11Å; P872-T874 PolarHBondContact O-N 2.63Å
873	P	91.1	Very high	91.2	Very high	37 Å²	37	65 Å²	65	24%	0.24	35%	0.347	C	S	.	.			trans	-60.3	130.3	177.2	26.7	-34.9	0	0	0	110.4	E878 T882	P873-E878 HydrophobicContact CB-CB 3.75Å; P873-T882 HydrophobicContact CG-CG2 4.17Å
874	T	90	Very high	91.1	Very high	77 Å²	77	69 Å²	69	47%	0.472	37%	0.372	S	S	.	.			trans	-104.7	-30.1	179	23.7	0	0	0	0	112.6	D835 R840 P872 E878	D835-T874 PolarHBondContact O-OG1 2.85Å; R840-T874 WeakPolarHBondContact CD-OG1 3.36Å; R840-T874 VanDerWaalsContact NH1-CG2 3.32Å; R840-T874 PolarHBondContact NH1-OG1 3.44Å; P872-T874 PolarHBondContact O-N 2.63Å; T874-E878 PolarHBondContact N-OE2 3.41Å
875	S	88.3	Confident	91.2	Very high	21 Å²	21	66 Å²	66	15%	0.147	36%	0.356	C	S	.	.	S	Bend	trans	-85.8	148.8	177.3	-153.1	0	0	0	0	112.3	D835 G877 E878 A879	D835-S875 WeakPolarHBondContact OD2-CA 3.41Å; D835-S875 WeakPolarHBondContact OD2-CB 3.5Å; D835-S875 PolarHBondContact OD2-OG 3.46Å; S875-G877 VanDerWaalsContact C-N 3.27Å; S875-G877 PolarHBondContact O-N 3.17Å; S875-E878 PolarHBondContact O-N 2.81Å; S875-E878 VanDerWaalsContact O-N 3.16Å; S875-A879 PolarHBondContact O-N 3.28Å
876	I	89	Confident	91.2	Very high	126 Å²	126	65.1 Å²	65.1	65%	0.646	34%	0.343	S	S	*	.	H	α-helix	trans	-61.6	-35.2	175	-174.1	58.2	0	0	0	112.2	A879 W880	I876-A879 PolarHBondContact O-N 3.15Å; I876-W880 VanDerWaalsContact O-CD1 3.28Å; I876-W880 PolarHBondContact O-N 2.96Å
877	G	87.2	Confident	91.2	Very high	20 Å²	20	65 Å²	65	21%	0.206	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-45.7	173.6	0	0	0	0	0	111.8	S875 A879 W880 I881	S875-G877 VanDerWaalsContact C-N 3.27Å; S875-G877 PolarHBondContact O-N 3.17Å; G877-A879 VanDerWaalsContact C-N 3.32Å; G877-A879 PolarHBondContact O-N 2.68Å; G877-W880 PolarHBondContact O-N 3.24Å; G877-I881 WeakPolarHBondContact O-CD1 3.43Å; G877-I881 WeakPolarHBondContact O-CG1 3.18Å; G877-I881 PolarHBondContact O-N 2.9Å
878	E	91	Very high	91.4	Very high	12 Å²	12	66.3 Å²	66.3	6%	0.056	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-34.7	177.5	-64.8	-172.8	150.9	0	0	113.2	S836 W837 P873 T874 S875 T882	S836-E878 WeakPolarHBondContact CA-OE1 3.26Å; S836-E878 WeakPolarHBondContact CB-OE1 3.06Å; W837-E878 PolarHBondContact N-OE1 3.31Å; P873-E878 HydrophobicContact CB-CB 3.75Å; T874-E878 PolarHBondContact N-OE2 3.41Å; S875-E878 PolarHBondContact O-N 2.81Å; S875-E878 VanDerWaalsContact O-N 3.16Å; E878-T882 WeakPolarHBondContact O-CB 3.43Å; E878-T882 PolarHBondContact O-N 3.39Å; E878-T882 PolarHBondContact O-OG1 3.48Å
879	A	92.2	Very high	91.6	Very high	30 Å²	30	61.3 Å²	61.3	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-49.7	174.3	0	0	0	0	0	110.8	S875 I876 G877 I881 T882 I883	S875-A879 PolarHBondContact O-N 3.28Å; I876-A879 PolarHBondContact O-N 3.15Å; G877-A879 VanDerWaalsContact C-N 3.32Å; G877-A879 PolarHBondContact O-N 2.68Å; A879-I881 PolarHBondContact O-N 3.39Å; A879-T882 PolarHBondContact O-N 2.94Å; A879-I883 VanDerWaalsContact O-CG1 3.26Å; A879-I883 WeakPolarHBondContact O-CG1 3.34Å; A879-I883 PolarHBondContact O-N 3.33Å
880	W	94.2	Very high	91.9	Very high	164 Å²	164	62.7 Å²	62.7	62%	0.621	34%	0.335	S	S	*	.	H	α-helix	trans	-62	-43.7	177	-80.5	112.4	0	0	0	113.3	I876 G877 T882 I883 V884	I876-W880 VanDerWaalsContact O-CD1 3.28Å; I876-W880 PolarHBondContact O-N 2.96Å; G877-W880 PolarHBondContact O-N 3.24Å; W880-T882 VanDerWaalsContact C-N 3.31Å; W880-T882 PolarHBondContact O-N 2.66Å; W880-I883 HydrophobicContact CE3-CD1 4.4Å; W880-I883 PolarHBondContact O-N 2.76Å; W880-V884 WeakPolarHBondContact O-CG2 3.13Å; W880-V884 PolarHBondContact O-N 3.33Å
881	I	92.2	Very high	92.3	Very high	26 Å²	26	58.4 Å²	58.4	13%	0.133	33%	0.329	C	S	.	.	H	α-helix	trans	-62.2	-42.5	176.1	-59	156.8	0	0	0	110.3	Q823 I826 G877 A879 V884 S885	Q823-I881 HydrophobicContact CG-CG2 3.64Å; I826-I881 HydrophobicContact CB-CD1 3.73Å; I826-I881 HydrophobicContact CD1-CD1 3.52Å; I826-I881 HydrophobicContact CD1-CG1 3.65Å; I826-I881 HydrophobicContact CG1-CD1 4.22Å; I826-I881 HydrophobicContact CG2-CD1 3.7Å; G877-I881 WeakPolarHBondContact O-CD1 3.43Å; G877-I881 WeakPolarHBondContact O-CG1 3.18Å; G877-I881 PolarHBondContact O-N 2.9Å; A879-I881 PolarHBondContact O-N 3.39Å; I881-V884 PolarHBondContact O-N 3.16Å; I881-S885 WeakPolarHBondContact O-CB 3.44Å; I881-S885 PolarHBondContact O-N 2.81Å
882	T	94.2	Very high	92.6	Very high	4 Å²	4	56 Å²	56	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-42.1	178	-63.3	0	0	0	0	111.3	K858 Y868 P873 E878 A879 W880 S885 M886	K858-T882 PolarHBondContact NZ-OG1 3.11Å; Y868-T882 HydrophobicContact CD1-CG2 3.79Å; Y868-T882 HydrophobicContact CE1-CG2 3.94Å; P873-T882 HydrophobicContact CG-CG2 4.17Å; E878-T882 WeakPolarHBondContact O-CB 3.43Å; E878-T882 PolarHBondContact O-N 3.39Å; E878-T882 PolarHBondContact O-OG1 3.48Å; A879-T882 PolarHBondContact O-N 2.94Å; W880-T882 VanDerWaalsContact C-N 3.31Å; W880-T882 PolarHBondContact O-N 2.66Å; T882-S885 WeakPolarHBondContact O-CB 3.41Å; T882-S885 PolarHBondContact O-N 2.86Å; T882-M886 HydrophobicContact CG2-CG 4.38Å; T882-M886 HydrophobicContact CG2-SD 3.77Å; T882-M886 WeakPolarHBondContact O-CB 3.46Å; T882-M886 VanDerWaalsContact O-CG 3.24Å; T882-M886 WeakPolarHBondContact O-CG 3.47Å; T882-M886 PolarHBondContact O-N 3.46Å
883	I	94.8	Very high	92.8	Very high	76 Å²	76	57 Å²	57	39%	0.39	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-50.4	174.5	-70.1	161.7	0	0	0	111	A879 W880 S885 M886 M887	A879-I883 VanDerWaalsContact O-CG1 3.26Å; A879-I883 WeakPolarHBondContact O-CG1 3.34Å; A879-I883 PolarHBondContact O-N 3.33Å; W880-I883 HydrophobicContact CE3-CD1 4.4Å; W880-I883 PolarHBondContact O-N 2.76Å; I883-S885 VanDerWaalsContact C-N 3.29Å; I883-S885 PolarHBondContact O-N 3.5Å; I883-M886 PolarHBondContact O-N 3.31Å; I883-M887 HydrophobicContact CG2-CG 4.45Å; I883-M887 HydrophobicContact CG2-SD 3.96Å; I883-M887 WeakPolarHBondContact O-CG 3.22Å; I883-M887 PolarHBondContact O-N 3.29Å
884	V	93.8	Very high	93	Very high	89 Å²	89	58.3 Å²	58.3	54%	0.539	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-39.6	177.9	172.5	0	0	0	0	111.4	W880 I881 M887 S888	W880-V884 WeakPolarHBondContact O-CG2 3.13Å; W880-V884 PolarHBondContact O-N 3.33Å; I881-V884 PolarHBondContact O-N 3.16Å; V884-M887 PolarHBondContact O-N 2.91Å; V884-S888 WeakPolarHBondContact O-CB 3.21Å; V884-S888 PolarHBondContact O-N 3.09Å; V884-S888 PolarHBondContact O-OG 3.33Å
885	S	95.3	Very high	93.1	Very high	3 Å²	3	59 Å²	59	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-65.2	-39.6	177.4	-172.3	0	0	0	0	112.6	N819 Q823 H862 I881 T882 I883 S888 G889	N819-S885 PolarHBondContact ND2-OG 3.43Å; N819-S885 WeakPolarHBondContact OD1-CB 3.11Å; N819-S885 PolarHBondContact OD1-OG 2.73Å; Q823-S885 PolarHBondContact NE2-OG 2.92Å; H862-S885 VanDerWaalsContact ND1-CB 3.33Å; H862-S885 WeakPolarHBondContact ND1-CB 3.33Å; H862-S885 PolarHBondContact ND1-OG 3.37Å; I881-S885 WeakPolarHBondContact O-CB 3.44Å; I881-S885 PolarHBondContact O-N 2.81Å; T882-S885 WeakPolarHBondContact O-CB 3.41Å; T882-S885 PolarHBondContact O-N 2.86Å; I883-S885 VanDerWaalsContact C-N 3.29Å; I883-S885 PolarHBondContact O-N 3.5Å; S885-S888 PolarHBondContact O-OG 3.37Å; S885-G889 PolarHBondContact O-N 3.39Å
886	M	95.5	Very high	93.4	Very high	74 Å²	74	61.1 Å²	61.1	37%	0.365	34%	0.335	S	S	.	.	H	α-helix	trans	-72.1	-41.2	174.5	-70	168.8	73.7	0	0	112.5	H862 Y868 T882 I883 G889 A890	H862-M886 HydrophobicContact CB-CG 4.07Å; Y868-M886 HydrophobicContact CD1-SD 4.47Å; Y868-M886 HydrophobicContact CE1-CE 4.13Å; Y868-M886 HydrophobicContact CE1-SD 3.67Å; T882-M886 HydrophobicContact CG2-CG 4.38Å; T882-M886 HydrophobicContact CG2-SD 3.77Å; T882-M886 WeakPolarHBondContact O-CB 3.46Å; T882-M886 VanDerWaalsContact O-CG 3.24Å; T882-M886 WeakPolarHBondContact O-CG 3.47Å; T882-M886 PolarHBondContact O-N 3.46Å; I883-M886 PolarHBondContact O-N 3.31Å; M886-G889 PolarHBondContact O-N 3Å; M886-A890 WeakPolarHBondContact O-CB 3.33Å; M886-A890 PolarHBondContact O-N 2.83Å
887	M	95.2	Very high	93.6	Very high	126 Å²	126	58.6 Å²	58.6	62%	0.621	33%	0.325	S	S	*	.	H	α-helix	trans	-65	-46.2	178.5	-72.6	179.1	71.2	0	0	112	I883 V884 T891	I883-M887 HydrophobicContact CG2-CG 4.45Å; I883-M887 HydrophobicContact CG2-SD 3.96Å; I883-M887 WeakPolarHBondContact O-CG 3.22Å; I883-M887 PolarHBondContact O-N 3.29Å; V884-M887 PolarHBondContact O-N 2.91Å; M887-T891 WeakPolarHBondContact O-CB 3.45Å; M887-T891 PolarHBondContact O-N 2.7Å; M887-T891 PolarHBondContact O-OG1 2.9Å
888	S	92.9	Very high	93.9	Very high	53 Å²	53	59.6 Å²	59.6	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174.7	53.3	0	0	0	0	111.4	V884 S885 T891 C892	V884-S888 WeakPolarHBondContact O-CB 3.21Å; V884-S888 PolarHBondContact O-N 3.09Å; V884-S888 PolarHBondContact O-OG 3.33Å; S885-S888 PolarHBondContact O-OG 3.37Å; S888-T891 PolarHBondContact O-N 3.25Å; S888-C892 PolarHBondContact O-N 3.14Å; S888-C892 PolarHBondContact O-SG 3.23Å
889	G	94.7	Very high	93.8	Very high	1 Å²	1	63 Å²	63	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-55.6	-59.2	174.6	0	0	0	0	0	114.2	S885 M886 T891 C892 Y893	S885-G889 PolarHBondContact O-N 3.39Å; M886-G889 PolarHBondContact O-N 3Å; G889-T891 PolarHBondContact O-N 3.46Å; G889-C892 WeakPolarHBondContact O-CB 3.32Å; G889-C892 PolarHBondContact O-N 2.94Å; G889-Y893 PolarHBondContact O-N 2.85Å
890	A	94.8	Very high	93.8	Very high	55 Å²	55	62.7 Å²	62.7	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-58.4	-35.9	178.7	0	0	0	0	0	112.5	M886 A894	M886-A890 WeakPolarHBondContact O-CB 3.33Å; M886-A890 PolarHBondContact O-N 2.83Å; A890-A894 VanDerWaalsContact O-CB 3.31Å; A890-A894 WeakPolarHBondContact O-CB 3.46Å; A890-A894 PolarHBondContact O-N 2.82Å
891	T	94.4	Very high	93.6	Very high	85 Å²	85	56.9 Å²	56.9	52%	0.521	34%	0.336	S	S	.	.	H	α-helix	trans	-63.9	-45.8	174.7	-56.6	0	0	0	0	111.4	M887 S888 G889 A894 L895	M887-T891 WeakPolarHBondContact O-CB 3.45Å; M887-T891 PolarHBondContact O-N 2.7Å; M887-T891 PolarHBondContact O-OG1 2.9Å; S888-T891 PolarHBondContact O-N 3.25Å; G889-T891 PolarHBondContact O-N 3.46Å; T891-A894 PolarHBondContact O-N 3.44Å; T891-L895 HydrophobicContact CG2-CD1 4.49Å; T891-L895 WeakPolarHBondContact O-CG 3.4Å; T891-L895 PolarHBondContact O-N 3.22Å; T891-L895 VanDerWaalsContact O-N 3.1Å
892	C	93.1	Very high	93.4	Very high	18 Å²	18	57.8 Å²	57.8	12%	0.122	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-42.4	177.7	-64.8	0	0	0	0	112.1	M812 S888 G889 L895 F896	M812-C892 HydrophobicContact CE-CB 4.22Å; M812-C892 HydrophobicContact CG-CB 4.12Å; S888-C892 PolarHBondContact O-N 3.14Å; S888-C892 PolarHBondContact O-SG 3.23Å; G889-C892 WeakPolarHBondContact O-CB 3.32Å; G889-C892 PolarHBondContact O-N 2.94Å; C892-L895 PolarHBondContact O-N 3.29Å; C892-F896 PolarHBondContact O-N 3.47Å
893	Y	94.1	Very high	93.1	Very high	100 Å²	100	58.5 Å²	58.5	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-40.6	177.4	-174.6	-109.2	0	0	0	112.5	L864 G889 L895 F896 V897	L864-Y893 HydrophobicContact CD2-CD2 4.45Å; G889-Y893 PolarHBondContact O-N 2.85Å; Y893-L895 PolarHBondContact O-N 3.4Å; Y893-F896 WeakPolarHBondContact O-CB 3.26Å; Y893-F896 PolarHBondContact O-N 2.91Å; Y893-V897 HydrophobicContact CD1-CG2 4.43Å; Y893-V897 HydrophobicContact CE1-CG2 4.04Å; Y893-V897 HydrophobicContact CE2-CG2 4.4Å; Y893-V897 WeakPolarHBondContact O-CG2 3.31Å; Y893-V897 PolarHBondContact O-N 3.32Å
894	A	95.7	Very high	92.7	Very high	64 Å²	64	60.7 Å²	60.7	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-61.9	-40.8	174.5	0	0	0	0	0	112.4	A890 T891 V897 G898	A890-A894 VanDerWaalsContact O-CB 3.31Å; A890-A894 WeakPolarHBondContact O-CB 3.46Å; A890-A894 PolarHBondContact O-N 2.82Å; T891-A894 PolarHBondContact O-N 3.44Å; A894-V897 PolarHBondContact O-N 3.47Å; A894-G898 PolarHBondContact O-N 3.2Å
895	L	93.5	Very high	92.2	Very high	92 Å²	92	62.7 Å²	62.7	48%	0.482	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-43.5	173	-70.8	170.4	0	0	0	111.6	L808 T891 C892 Y893 V897 G898 H899	L808-L895 HydrophobicContact CD2-CB 4.37Å; T891-L895 HydrophobicContact CG2-CD1 4.49Å; T891-L895 WeakPolarHBondContact O-CG 3.4Å; T891-L895 PolarHBondContact O-N 3.22Å; T891-L895 VanDerWaalsContact O-N 3.1Å; C892-L895 PolarHBondContact O-N 3.29Å; Y893-L895 PolarHBondContact O-N 3.4Å; L895-V897 PolarHBondContact O-N 3.49Å; L895-G898 PolarHBondContact O-N 3.2Å; L895-H899 PolarHBondContact O-CD2 2.92Å; L895-H899 VanDerWaalsContact O-CD2 3.32Å; L895-H899 PolarHBondContact O-N 2.69Å
896	F	94.1	Very high	91.6	Very high	66 Å²	66	64 Å²	64	29%	0.289	38%	0.375	S	S	.	.	H	α-helix	trans	-58.9	-47.9	176.9	173.9	-98.6	0	0	0	112.3	I805 L808 V809 M812 C892 Y893 G898 H899 A900	I805-F896 HydrophobicContact CD1-CE2 4.28Å; I805-F896 HydrophobicContact CG1-CE2 4.39Å; L808-F896 HydrophobicContact CD2-CB 4.4Å; V809-F896 HydrophobicContact CG2-CD2 4.14Å; V809-F896 HydrophobicContact CG2-CE2 3.81Å; M812-F896 HydrophobicContact SD-CB 3.7Å; M812-F896 HydrophobicContact SD-CD2 4.27Å; M812-F896 HydrophobicContact SD-CG 4.17Å; C892-F896 PolarHBondContact O-N 3.47Å; Y893-F896 WeakPolarHBondContact O-CB 3.26Å; Y893-F896 PolarHBondContact O-N 2.91Å; F896-G898 VanDerWaalsContact C-N 3.31Å; F896-G898 PolarHBondContact O-N 3.45Å; F896-H899 PolarHBondContact O-N 3.45Å; F896-A900 WeakPolarHBondContact O-CB 3.4Å; F896-A900 PolarHBondContact O-N 3.35Å
897	V	93.8	Very high	90.9	Very high	72 Å²	72	66.2 Å²	66.2	44%	0.436	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-40.7	176.1	173.9	0	0	0	0	111.3	Y893 A894 L895 A901	Y893-V897 HydrophobicContact CD1-CG2 4.43Å; Y893-V897 HydrophobicContact CE1-CG2 4.04Å; Y893-V897 HydrophobicContact CE2-CG2 4.4Å; Y893-V897 WeakPolarHBondContact O-CG2 3.31Å; Y893-V897 PolarHBondContact O-N 3.32Å; A894-V897 PolarHBondContact O-N 3.47Å; L895-V897 PolarHBondContact O-N 3.49Å; V897-A901 WeakPolarHBondContact O-CB 3.41Å; V897-A901 PolarHBondContact O-N 3.1Å
898	G	92.3	Very high	90.2	Very high	41 Å²	41	62.8 Å²	62.8	42%	0.423	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.2	0	0	0	0	0	113.5	A894 L895 F896 A901 A902	A894-G898 PolarHBondContact O-N 3.2Å; L895-G898 PolarHBondContact O-N 3.2Å; F896-G898 VanDerWaalsContact C-N 3.31Å; F896-G898 PolarHBondContact O-N 3.45Å; G898-A901 PolarHBondContact O-N 2.91Å; G898-A902 WeakPolarHBondContact O-CB 3.31Å; G898-A902 PolarHBondContact O-N 3.41Å
899	H	89.3	Confident	89.8	Confident	85 Å²	85	63.2 Å²	63.2	39%	0.394	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-40.5	177.2	-85.1	-104.3	0	0	0	112.4	L808 L895 F896 A902 L903	L808-H899 HydrophobicContact CD2-CB 3.83Å; L895-H899 PolarHBondContact O-CD2 2.92Å; L895-H899 VanDerWaalsContact O-CD2 3.32Å; L895-H899 PolarHBondContact O-N 2.69Å; F896-H899 PolarHBondContact O-N 3.45Å; H899-A902 PolarHBondContact O-N 2.81Å; H899-L903 WeakPolarHBondContact O-CB 3.34Å; H899-L903 PolarHBondContact O-N 3.3Å
900	A	91.1	Very high	89.5	Confident	22 Å²	22	63.9 Å²	63.9	18%	0.182	37%	0.371	C	S	.	.	H	α-helix	trans	-60.5	-46.1	174.4	0	0	0	0	0	111.5	I805 F896 A902 L903 I904	I805-A900 HydrophobicContact CD1-CB 4.2Å; F896-A900 WeakPolarHBondContact O-CB 3.4Å; F896-A900 PolarHBondContact O-N 3.35Å; A900-A902 PolarHBondContact O-N 3.47Å; A900-L903 PolarHBondContact O-N 3.14Å; A900-I904 VanDerWaalsContact O-CG1 3.29Å; A900-I904 WeakPolarHBondContact O-CG1 3.46Å; A900-I904 PolarHBondContact O-N 3Å
901	A	91	Very high	89.2	Confident	43 Å²	43	66.2 Å²	66.2	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-42.2	175.2	0	0	0	0	0	112.5	V897 G898 L903 I904 Q905	V897-A901 WeakPolarHBondContact O-CB 3.41Å; V897-A901 PolarHBondContact O-N 3.1Å; G898-A901 PolarHBondContact O-N 2.91Å; A901-L903 VanDerWaalsContact C-N 3.3Å; A901-L903 PolarHBondContact O-N 2.87Å; A901-I904 PolarHBondContact O-N 2.78Å; A901-Q905 WeakPolarHBondContact O-CB 3.18Å; A901-Q905 VanDerWaalsContact O-CG 3.32Å; A901-Q905 WeakPolarHBondContact O-CG 3.49Å; A901-Q905 PolarHBondContact O-N 3.08Å
902	A	87.8	Confident	88.9	Confident	44 Å²	44	66.5 Å²	66.5	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-68.6	-25.6	178.1	0	0	0	0	0	114	K801 G898 H899 A900	K801-A902 PolarHBondContact NZ-O 2.75Å; G898-A902 WeakPolarHBondContact O-CB 3.31Å; G898-A902 PolarHBondContact O-N 3.41Å; H899-A902 PolarHBondContact O-N 2.81Å; A900-A902 PolarHBondContact O-N 3.47Å
903	L	86.9	Confident	88.8	Confident	20 Å²	20	69.2 Å²	69.2	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-75.5	-49.7	170.5	-175.2	70.6	0	0	0	110.8	K801 F802 I805 H899 A900 A901 Q905 S906 F907	K801-L903 HydrophobicContact CB-CD1 3.88Å; F802-L903 HydrophobicContact CD1-CD1 4.27Å; F802-L903 HydrophobicContact CD2-CD1 3.96Å; F802-L903 HydrophobicContact CE1-CD1 4.3Å; F802-L903 HydrophobicContact CE2-CD1 4Å; F802-L903 HydrophobicContact CG-CD1 4.12Å; F802-L903 HydrophobicContact CZ-CD1 4.18Å; I805-L903 HydrophobicContact CD1-CD2 4.27Å; I805-L903 HydrophobicContact CG2-CD2 4.05Å; H899-L903 WeakPolarHBondContact O-CB 3.34Å; H899-L903 PolarHBondContact O-N 3.3Å; A900-L903 PolarHBondContact O-N 3.14Å; A901-L903 VanDerWaalsContact C-N 3.3Å; A901-L903 PolarHBondContact O-N 2.87Å; L903-Q905 VanDerWaalsContact C-N 3.29Å; L903-Q905 PolarHBondContact O-N 3.25Å; L903-S906 WeakPolarHBondContact O-CA 3.41Å; L903-S906 WeakPolarHBondContact O-CB 3.44Å; L903-S906 PolarHBondContact O-N 2.83Å; L903-S906 PolarHBondContact O-OG 3.12Å; L903-F907 HydrophobicContact CD1-CE2 4.39Å; L903-F907 HydrophobicContact CD2-CE2 4.14Å; L903-F907 HydrophobicContact CG-CD2 4.32Å; L903-F907 HydrophobicContact CG-CE2 3.8Å; L903-F907 WeakPolarHBondContact O-CD2 3.45Å; L903-F907 PolarHBondContact O-N 2.78Å; L903-F907 VanDerWaalsContact O-N 3.15Å
904	I	86.8	Confident	88.8	Confident	121 Å²	121	66.2 Å²	66.2	62%	0.621	36%	0.364	S	S	*	.	H	α-helix	trans	-54.2	-44.6	176	-69.2	164.9	0	0	0	111.1	A900 A901 S906 F907	A900-I904 VanDerWaalsContact O-CG1 3.29Å; A900-I904 WeakPolarHBondContact O-CG1 3.46Å; A900-I904 PolarHBondContact O-N 3Å; A901-I904 PolarHBondContact O-N 2.78Å; I904-S906 PolarHBondContact O-N 3.1Å; I904-F907 PolarHBondContact O-N 3.1Å
905	Q	84.3	Confident	88.6	Confident	132 Å²	132	70.2 Å²	70.2	62%	0.617	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-14	176.2	-71.2	177.6	8.4	0	0	114.8	A901 L903 R912	A901-Q905 WeakPolarHBondContact O-CB 3.18Å; A901-Q905 VanDerWaalsContact O-CG 3.32Å; A901-Q905 WeakPolarHBondContact O-CG 3.49Å; A901-Q905 PolarHBondContact O-N 3.08Å; L903-Q905 VanDerWaalsContact C-N 3.29Å; L903-Q905 PolarHBondContact O-N 3.25Å; Q905-R912 PolarHBondContact O-NH1 3.34Å
906	S	82.1	Confident	88.6	Confident	31 Å²	31	69.8 Å²	69.8	22%	0.217	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-27.9	178.1	78.4	0	0	0	0	113.4	K801 L903 I904 D908 T909	K801-S906 VanDerWaalsContact CD-CB 3.48Å; K801-S906 WeakPolarHBondContact CD-OG 3.27Å; L903-S906 WeakPolarHBondContact O-CA 3.41Å; L903-S906 WeakPolarHBondContact O-CB 3.44Å; L903-S906 PolarHBondContact O-N 2.83Å; L903-S906 PolarHBondContact O-OG 3.12Å; I904-S906 PolarHBondContact O-N 3.1Å; S906-D908 PolarHBondContact O-N 3.17Å; S906-T909 PolarHBondContact O-OG1 3.22Å
907	F	80.8	Confident	88.6	Confident	120 Å²	120	70.4 Å²	70.4	53%	0.526	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	136.8	168.6	-78	-75.6	0	0	0	110.4	F802 L903 I904 T909	F802-F907 HydrophobicContact CE1-CE1 4.37Å; F802-F907 AromaticContact CE1-CZ 3.74Å; F802-F907 HydrophobicContact CE1-CZ 3.74Å; F802-F907 AromaticContact CZ-CE1 3.68Å; F802-F907 HydrophobicContact CZ-CE1 3.68Å; F802-F907 HydrophobicContact CZ-CE2 4.24Å; F802-F907 AromaticContact CZ-CZ 3.42Å; F802-F907 HydrophobicContact CZ-CZ 3.42Å; F802-F907 VanDerWaalsContact CZ-CZ 3.42Å; L903-F907 HydrophobicContact CD1-CE2 4.39Å; L903-F907 HydrophobicContact CD2-CE2 4.14Å; L903-F907 HydrophobicContact CG-CD2 4.32Å; L903-F907 HydrophobicContact CG-CE2 3.8Å; L903-F907 WeakPolarHBondContact O-CD2 3.45Å; L903-F907 PolarHBondContact O-N 2.78Å; L903-F907 VanDerWaalsContact O-N 3.15Å; I904-F907 PolarHBondContact O-N 3.1Å; F907-T909 PolarHBondContact O-N 3.33Å
908	D	80.4	Confident	88.7	Confident	54 Å²	54	68.7 Å²	68.7	29%	0.289	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.6	52.6	178.3	-148	-13.1	0	0	0	117.3	S906 S910 K911 R912 K1206	S906-D908 PolarHBondContact O-N 3.17Å; D908-S910 PolarHBondContact O-N 2.94Å; D908-S910 VanDerWaalsContact O-N 3.12Å; D908-S910 PolarHBondContact OD1-OG 2.83Å; D908-K911 PolarHBondContact O-N 3Å; D908-K911 PolarHBondContact OD1-N 3.41Å; D908-K911 WeakPolarHBondContact OD2-CD 3.44Å; D908-K911 WeakPolarHBondContact OD2-CE 3.3Å; D908-K911 WeakPolarHBondContact OD2-CG 3.36Å; D908-K911 IonicContact OD2-NZ 2.74Å; D908-R912 PolarHBondContact O-N 3.22Å; D908-K1206 IonicContact OD1-NZ 2.9Å
909	T	85.9	Confident	88.8	Confident	62 Å²	62	71.4 Å²	71.4	38%	0.38	35%	0.35	S	S	.	.	H	α-helix	trans	-51.2	-32.7	167.9	-62.1	0	0	0	0	112	S906 F907 R912 L913	S906-T909 PolarHBondContact O-OG1 3.22Å; F907-T909 PolarHBondContact O-N 3.33Å; T909-R912 PolarHBondContact O-N 3.44Å; T909-L913 HydrophobicContact CG2-CD1 4.02Å; T909-L913 HydrophobicContact CG2-CG 4.33Å; T909-L913 WeakPolarHBondContact O-CG 3.1Å; T909-L913 PolarHBondContact O-N 2.88Å
910	S	87	Confident	89.2	Confident	14 Å²	14	72.4 Å²	72.4	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-53.9	177	29.2	0	0	0	0	114.1	D908 R912 Y914 M950 K1206	D908-S910 PolarHBondContact O-N 2.94Å; D908-S910 VanDerWaalsContact O-N 3.12Å; D908-S910 PolarHBondContact OD1-OG 2.83Å; S910-R912 VanDerWaalsContact C-N 3.31Å; S910-Y914 PolarHBondContact O-N 2.92Å; S910-M950 PolarHBondContact O-N 3.43Å; S910-K1206 PolarHBondContact OG-NZ 3.39Å
911	K	88.9	Confident	89.4	Confident	104 Å²	104	72.2 Å²	72.2	45%	0.452	35%	0.351	S	S	.	.	H	α-helix	trans	-70.6	-28.8	174.9	-67.8	-173.2	-160.8	-179.6	0	111.7	D908 Y914 R915	D908-K911 PolarHBondContact O-N 3Å; D908-K911 PolarHBondContact OD1-N 3.41Å; D908-K911 WeakPolarHBondContact OD2-CD 3.44Å; D908-K911 WeakPolarHBondContact OD2-CE 3.3Å; D908-K911 WeakPolarHBondContact OD2-CG 3.36Å; D908-K911 IonicContact OD2-NZ 2.74Å; K911-Y914 PolarHBondContact O-N 3.22Å; K911-R915 WeakPolarHBondContact O-CG 3.43Å; K911-R915 PolarHBondContact O-N 3.32Å
912	R	88.5	Confident	89.7	Confident	92 Å²	92	74.3 Å²	74.3	35%	0.347	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-47.3	176.6	-152.1	-169	82.2	-146.6	-1.4	111.6	Q905 D908 T909 S910 Y914 R915 E916	Q905-R912 PolarHBondContact O-NH1 3.34Å; D908-R912 PolarHBondContact O-N 3.22Å; T909-R912 PolarHBondContact O-N 3.44Å; S910-R912 VanDerWaalsContact C-N 3.31Å; R912-Y914 VanDerWaalsContact C-N 3.35Å; R912-Y914 PolarHBondContact O-N 3.07Å; R912-R915 PolarHBondContact O-N 3.38Å; R912-E916 IonicContact CZ-OE1 3.34Å; R912-E916 IonicContact NE-OE1 2.72Å; R912-E916 PolarHBondContact NE-OE1 3.15Å; R912-E916 IonicContact NE-OE2 3.29Å; R912-E916 IonicContact NH2-OE1 3.21Å; R912-E916 PolarHBondContact NH2-OE1 3.48Å; R912-E916 IonicContact NH2-OE2 3.17Å; R912-E916 WeakPolarHBondContact O-CB 3.47Å; R912-E916 VanDerWaalsContact O-CG 3.3Å; R912-E916 WeakPolarHBondContact O-CG 3.48Å; R912-E916 PolarHBondContact O-N 2.94Å
913	L	90.4	Very high	90	Very high	74 Å²	74	76.4 Å²	76.4	39%	0.387	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-40.7	175	-72.3	170.3	0	0	0	112	T909 E916 K917 M950	T909-L913 HydrophobicContact CG2-CD1 4.02Å; T909-L913 HydrophobicContact CG2-CG 4.33Å; T909-L913 WeakPolarHBondContact O-CG 3.1Å; T909-L913 PolarHBondContact O-N 2.88Å; L913-E916 PolarHBondContact O-N 2.88Å; L913-K917 WeakPolarHBondContact O-CB 3.45Å; L913-K917 PolarHBondContact O-N 3.03Å; L913-M950 HydrophobicContact CB-CB 4.23Å
914	Y	93.3	Very high	90.5	Very high	37 Å²	37	81.5 Å²	81.5	15%	0.145	38%	0.375	C	S	.	.	H	α-helix	trans	-58.2	-51.8	173.3	177.9	-99.2	0	0	0	111.8	S910 K911 R912 E916 K917 F918 G948	S910-Y914 PolarHBondContact O-N 2.92Å; K911-Y914 PolarHBondContact O-N 3.22Å; R912-Y914 VanDerWaalsContact C-N 3.35Å; R912-Y914 PolarHBondContact O-N 3.07Å; Y914-E916 PolarHBondContact O-N 3.5Å; Y914-K917 PolarHBondContact O-N 3.43Å; Y914-F918 WeakPolarHBondContact O-CB 3.36Å; Y914-F918 PolarHBondContact O-N 3.42Å; Y914-G948 WeakPolarHBondContact CB-O 3.06Å
915	R	92.4	Very high	91	Very high	149 Å²	149	76.2 Å²	76.2	56%	0.562	35%	0.348	S	S	*	.	H	α-helix	trans	-62.9	-39.5	177.6	-69.4	-171.6	-59.6	-102.1	1.8	112.7	K911 R912 K919	K911-R915 WeakPolarHBondContact O-CG 3.43Å; K911-R915 PolarHBondContact O-N 3.32Å; R912-R915 PolarHBondContact O-N 3.38Å; R915-K919 WeakPolarHBondContact O-CB 3.26Å; R915-K919 PolarHBondContact O-N 3.21Å
916	E	93.6	Very high	91.5	Very high	83 Å²	83	72.4 Å²	72.4	39%	0.388	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-41.1	176.1	-76.9	168	-170.4	0	0	111.8	R912 L913 Y914 Q920	R912-E916 IonicContact CZ-OE1 3.34Å; R912-E916 IonicContact NE-OE1 2.72Å; R912-E916 PolarHBondContact NE-OE1 3.15Å; R912-E916 IonicContact NE-OE2 3.29Å; R912-E916 IonicContact NH2-OE1 3.21Å; R912-E916 PolarHBondContact NH2-OE1 3.48Å; R912-E916 IonicContact NH2-OE2 3.17Å; R912-E916 WeakPolarHBondContact O-CB 3.47Å; R912-E916 VanDerWaalsContact O-CG 3.3Å; R912-E916 WeakPolarHBondContact O-CG 3.48Å; R912-E916 PolarHBondContact O-N 2.94Å; L913-E916 PolarHBondContact O-N 2.88Å; Y914-E916 PolarHBondContact O-N 3.5Å; E916-Q920 WeakPolarHBondContact O-CG 3.38Å; E916-Q920 PolarHBondContact O-N 2.65Å
917	K	93.9	Very high	92.2	Very high	78 Å²	78	79.2 Å²	79.2	34%	0.339	36%	0.361	S	S	.	.	H	α-helix	trans	-73.9	-46.6	177.1	-175.1	65.3	176.6	179.3	0	112.5	L913 Y914 K919 Q920 V921 M950	L913-K917 WeakPolarHBondContact O-CB 3.45Å; L913-K917 PolarHBondContact O-N 3.03Å; Y914-K917 PolarHBondContact O-N 3.43Å; K917-K919 PolarHBondContact O-N 3.22Å; K917-Q920 WeakPolarHBondContact O-CA 3.47Å; K917-Q920 WeakPolarHBondContact O-CB 3.39Å; K917-Q920 PolarHBondContact O-N 3.49Å; K917-V921 PolarHBondContact O-N 3.34Å; K917-V921 VanDerWaalsContact O-N 3.15Å; K917-M950 HydrophobicContact CB-CE 4.25Å; K917-M950 HydrophobicContact CB-SD 3.44Å; K917-M950 WeakPolarHBondContact CB-SD 3.46Å; K917-M950 HydrophobicContact CD-CE 4.14Å; K917-M950 HydrophobicContact CD-SD 4.4Å; K917-M950 HydrophobicContact CG-CE 3.79Å; K917-M950 HydrophobicContact CG-SD 3.65Å
918	F	95.3	Very high	93	Very high	37 Å²	37	80.3 Å²	80.3	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-58.5	-40.3	178.6	-169.9	-100.6	0	0	0	110.9	Y914 Q920 V921 E922 A939 Y942	Y914-F918 WeakPolarHBondContact O-CB 3.36Å; Y914-F918 PolarHBondContact O-N 3.42Å; F918-Q920 VanDerWaalsContact C-N 3.3Å; F918-Q920 PolarHBondContact O-N 2.72Å; F918-V921 CarbonylContact O-C 3.56Å; F918-V921 WeakPolarHBondContact O-CA 3.32Å; F918-V921 VanDerWaalsContact O-CB 3.27Å; F918-V921 WeakPolarHBondContact O-CB 3.46Å; F918-V921 PolarHBondContact O-N 3.06Å; F918-E922 HydrophobicContact CD1-CG 3.98Å; F918-E922 HydrophobicContact CE1-CG 3.81Å; F918-E922 PolarHBondContact O-N 3.33Å; F918-A939 HydrophobicContact CE2-CB 4.42Å; F918-A939 HydrophobicContact CZ-CB 3.93Å; F918-Y942 HydrophobicContact CD2-CD1 4.32Å; F918-Y942 HydrophobicContact CD2-CG 4.09Å; F918-Y942 HydrophobicContact CE2-CG 4.28Å
919	K	96	Very high	93.7	Very high	97 Å²	97	86.3 Å²	86.3	42%	0.422	39%	0.385	S	S	.	.	H	α-helix	trans	-60.1	-33.4	172.6	-170.6	-179.5	-164.6	78.6	0	114.2	R915 K917 V921 E922 E923	R915-K919 WeakPolarHBondContact O-CB 3.26Å; R915-K919 PolarHBondContact O-N 3.21Å; K917-K919 PolarHBondContact O-N 3.22Å; K919-V921 VanDerWaalsContact C-N 3.31Å; K919-E922 WeakPolarHBondContact CA-OE2 3.5Å; K919-E922 PolarHBondContact O-N 2.9Å; K919-E923 WeakPolarHBondContact CE-OE1 3.48Å; K919-E923 WeakPolarHBondContact O-CB 3.31Å; K919-E923 WeakPolarHBondContact O-CG 3.34Å; K919-E923 PolarHBondContact O-N 2.8Å
920	Q	96.7	Very high	94.2	Very high	107 Å²	107	85.1 Å²	85.1	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-34.6	171.9	-65.1	167.7	12.2	0	0	111.3	E916 K917 F918 Y924	E916-Q920 WeakPolarHBondContact O-CG 3.38Å; E916-Q920 PolarHBondContact O-N 2.65Å; K917-Q920 WeakPolarHBondContact O-CA 3.47Å; K917-Q920 WeakPolarHBondContact O-CB 3.39Å; K917-Q920 PolarHBondContact O-N 3.49Å; F918-Q920 VanDerWaalsContact C-N 3.3Å; F918-Q920 PolarHBondContact O-N 2.72Å; Q920-Y924 VanDerWaalsContact O-CB 3.3Å; Q920-Y924 WeakPolarHBondContact O-CB 3.23Å; Q920-Y924 PolarHBondContact O-N 2.9Å
921	V	96.1	Very high	94.7	Very high	17 Å²	17	88.6 Å²	88.6	10%	0.103	40%	0.398	C	S	.	.	H	α-helix	trans	-67.1	-42.8	173.1	-174.3	0	0	0	0	110.1	K917 F918 K919 Y924 M925 I938 Y942	K917-V921 PolarHBondContact O-N 3.34Å; K917-V921 VanDerWaalsContact O-N 3.15Å; F918-V921 CarbonylContact O-C 3.56Å; F918-V921 WeakPolarHBondContact O-CA 3.32Å; F918-V921 VanDerWaalsContact O-CB 3.27Å; F918-V921 WeakPolarHBondContact O-CB 3.46Å; F918-V921 PolarHBondContact O-N 3.06Å; K919-V921 VanDerWaalsContact C-N 3.31Å; V921-Y924 CarbonylContact O-C 3.31Å; V921-Y924 WeakPolarHBondContact O-CB 3.39Å; V921-Y924 PolarHBondContact O-N 3.05Å; V921-M925 HydrophobicContact CG1-CE 4.23Å; V921-M925 HydrophobicContact CG1-CG 4.27Å; V921-M925 HydrophobicContact CG1-SD 4.39Å; V921-M925 WeakPolarHBondContact O-CB 3.44Å; V921-M925 VanDerWaalsContact O-CG 3.24Å; V921-M925 WeakPolarHBondContact O-CG 3.24Å; V921-M925 PolarHBondContact O-N 2.88Å; V921-I938 HydrophobicContact CG1-CG2 3.73Å; V921-Y942 HydrophobicContact CG1-CE2 4.12Å; V921-Y942 HydrophobicContact CG2-CE1 4.04Å; V921-Y942 HydrophobicContact CG2-CE2 4.06Å
922	E	95.5	Very high	95	Very high	87 Å²	87	93.1 Å²	93.1	41%	0.407	41%	0.413	S	S	.	.	H	α-helix	trans	-60.1	-49.8	172.6	-63.6	176.9	137.7	0	0	112.6	F918 K919 Y924 M925 A926	F918-E922 HydrophobicContact CD1-CG 3.98Å; F918-E922 HydrophobicContact CE1-CG 3.81Å; F918-E922 PolarHBondContact O-N 3.33Å; K919-E922 WeakPolarHBondContact CA-OE2 3.5Å; K919-E922 PolarHBondContact O-N 2.9Å; E922-Y924 PolarHBondContact O-N 3.06Å; E922-M925 HydrophobicContact CG-CE 4.28Å; E922-M925 PolarHBondContact O-N 3.2Å; E922-A926 WeakPolarHBondContact O-CB 3.45Å; E922-A926 PolarHBondContact O-N 3.29Å
923	E	96.1	Very high	95.3	Very high	88 Å²	88	92.2 Å²	92.2	41%	0.411	43%	0.425	S	S	.	.	H	α-helix	trans	-59.6	-34.2	177.1	-72.8	178.8	-173.4	0	0	110.4	R9 K919 Y927	R9-E923 IonicContact CZ-OE1 3.84Å; R9-E923 IonicContact CZ-OE2 3.96Å; R9-E923 IonicContact NH1-OE1 2.7Å; R9-E923 PolarHBondContact NH1-OE1 3.44Å; R9-E923 IonicContact NH1-OE2 2.84Å; R9-E923 PolarHBondContact NH1-OE2 3.01Å; R9-E923 IonicContact NH2-OE1 3.5Å; R9-E923 PolarHBondContact NH2-OE1 3.27Å; K919-E923 WeakPolarHBondContact CE-OE1 3.48Å; K919-E923 WeakPolarHBondContact O-CB 3.31Å; K919-E923 WeakPolarHBondContact O-CG 3.34Å; K919-E923 PolarHBondContact O-N 2.8Å; E923-Y927 WeakPolarHBondContact O-CB 3.39Å; E923-Y927 PolarHBondContact O-N 3.2Å; E923-Y927 VanDerWaalsContact O-N 3.08Å
924	Y	97	Very high	95.6	Very high	127 Å²	127	92.3 Å²	92.3	50%	0.498	43%	0.426	S	S	.	.	H	α-helix	trans	-71.4	-46.3	171.6	176.8	-98.2	0	0	0	114.1	Q920 V921 E922 A926 Y927 R928	Q920-Y924 VanDerWaalsContact O-CB 3.3Å; Q920-Y924 WeakPolarHBondContact O-CB 3.23Å; Q920-Y924 PolarHBondContact O-N 2.9Å; V921-Y924 CarbonylContact O-C 3.31Å; V921-Y924 WeakPolarHBondContact O-CB 3.39Å; V921-Y924 PolarHBondContact O-N 3.05Å; E922-Y924 PolarHBondContact O-N 3.06Å; Y924-A926 VanDerWaalsContact C-N 3.27Å; Y924-A926 PolarHBondContact O-N 3.25Å; Y924-Y927 PolarHBondContact O-N 3.2Å; Y924-R928 HydrophobicContact CD1-CG 4.48Å; Y924-R928 HydrophobicContact CD2-CG 4.21Å; Y924-R928 HydrophobicContact CE1-CG 4.02Å; Y924-R928 HydrophobicContact CE2-CG 3.71Å; Y924-R928 PolarHBondContact O-N 3.4Å
925	M	96.8	Very high	95.7	Very high	10 Å²	10	95.2 Å²	95.2	5%	0.049	44%	0.436	C	S	.	.	H	α-helix	trans	-62.1	-36.2	178.6	-72.2	-168.9	-67.4	0	0	111.6	V921 E922 K929 L930 R935 I938	V921-M925 HydrophobicContact CG1-CE 4.23Å; V921-M925 HydrophobicContact CG1-CG 4.27Å; V921-M925 HydrophobicContact CG1-SD 4.39Å; V921-M925 WeakPolarHBondContact O-CB 3.44Å; V921-M925 VanDerWaalsContact O-CG 3.24Å; V921-M925 WeakPolarHBondContact O-CG 3.24Å; V921-M925 PolarHBondContact O-N 2.88Å; E922-M925 HydrophobicContact CG-CE 4.28Å; E922-M925 PolarHBondContact O-N 3.2Å; M925-K929 PolarHBondContact O-N 3.29Å; M925-L930 HydrophobicContact CB-CD1 4.34Å; M925-L930 HydrophobicContact CG-CD1 3.96Å; M925-L930 PolarHBondContact O-N 3.41Å; M925-R935 HydrophobicContact CB-CG 4.18Å; M925-R935 HydrophobicContact CE-CB 4.37Å; M925-R935 HydrophobicContact CG-CG 4.48Å; M925-R935 HydrophobicContact SD-CB 3.83Å; M925-R935 HydrophobicContact SD-CG 3.78Å; M925-I938 HydrophobicContact CE-CG2 4.43Å; M925-I938 HydrophobicContact CG-CD1 4.21Å; M925-I938 HydrophobicContact SD-CB 3.86Å; M925-I938 HydrophobicContact SD-CD1 3.73Å; M925-I938 HydrophobicContact SD-CG1 4.4Å; M925-I938 HydrophobicContact SD-CG2 3.75Å
926	A	95.3	Very high	95.8	Very high	53 Å²	53	93.1 Å²	93.1	44%	0.438	43%	0.433	S	S	.	.	H	α-helix	trans	-68.6	-47.4	172.5	0	0	0	0	0	111.7	E922 Y924 R928 K929	E922-A926 WeakPolarHBondContact O-CB 3.45Å; E922-A926 PolarHBondContact O-N 3.29Å; Y924-A926 VanDerWaalsContact C-N 3.27Å; Y924-A926 PolarHBondContact O-N 3.25Å; A926-R928 PolarHBondContact O-N 3Å; A926-K929 PolarHBondContact O-N 3.5Å
927	Y	96.6	Very high	96	Very high	173 Å²	173	94.4 Å²	94.4	68%	0.678	43%	0.434	S	S	*	.	H	α-helix	trans	-58.3	-43.3	177.1	174.6	-109.1	0	0	0	112.8	E923 Y924 K929	E923-Y927 WeakPolarHBondContact O-CB 3.39Å; E923-Y927 PolarHBondContact O-N 3.2Å; E923-Y927 VanDerWaalsContact O-N 3.08Å; Y924-Y927 PolarHBondContact O-N 3.2Å; Y927-K929 VanDerWaalsContact C-N 3.26Å; Y927-K929 PolarHBondContact O-N 3.12Å
928	R	97.4	Very high	96.1	Very high	144 Å²	144	92.6 Å²	92.6	54%	0.543	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	1.5	175.4	-64.9	-58.3	-163.9	-178.2	2.9	114.3	Y924 A926 L930	Y924-R928 HydrophobicContact CD1-CG 4.48Å; Y924-R928 HydrophobicContact CD2-CG 4.21Å; Y924-R928 HydrophobicContact CE1-CG 4.02Å; Y924-R928 HydrophobicContact CE2-CG 3.71Å; Y924-R928 PolarHBondContact O-N 3.4Å; A926-R928 PolarHBondContact O-N 3Å; R928-L930 VanDerWaalsContact C-N 3.26Å; R928-L930 HydrophobicContact CB-CD2 3.81Å; R928-L930 HydrophobicContact CB-CG 4.07Å; R928-L930 PolarHBondContact O-N 3.02Å
929	K	95.8	Very high	96	Very high	180 Å²	180	91.9 Å²	91.9	78%	0.783	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	36.2	-179.7	-57.8	-177.3	179.2	179.9	0	114.5	M925 A926 Y927	M925-K929 PolarHBondContact O-N 3.29Å; A926-K929 PolarHBondContact O-N 3.5Å; Y927-K929 VanDerWaalsContact C-N 3.26Å; Y927-K929 PolarHBondContact O-N 3.12Å
930	L	96.5	Very high	96	Very high	37 Å²	37	89.8 Å²	89.8	19%	0.194	42%	0.422	C	S	.	.			trans	-61.5	147.6	-174.1	-57.8	-171.3	0	0	0	112.5	M925 R928 L934 R935 I938	M925-L930 HydrophobicContact CB-CD1 4.34Å; M925-L930 HydrophobicContact CG-CD1 3.96Å; M925-L930 PolarHBondContact O-N 3.41Å; R928-L930 VanDerWaalsContact C-N 3.26Å; R928-L930 HydrophobicContact CB-CD2 3.81Å; R928-L930 HydrophobicContact CB-CG 4.07Å; R928-L930 PolarHBondContact O-N 3.02Å; L930-L934 HydrophobicContact CB-CD2 4.32Å; L930-L934 HydrophobicContact CD1-CD2 4.06Å; L930-L934 HydrophobicContact CD1-CG 4.41Å; L930-L934 HydrophobicContact CD2-CD2 4.32Å; L930-L934 HydrophobicContact CG-CD2 4.47Å; L930-R935 HydrophobicContact CB-CG 4.22Å; L930-R935 VanDerWaalsContact O-CZ 3.25Å; L930-R935 PolarHBondContact O-NE 3.23Å; L930-R935 PolarHBondContact O-NH2 3.42Å; L930-I938 HydrophobicContact CD1-CD1 3.87Å
931	P	97	Very high	96	Very high	86 Å²	86	88.4 Å²	88.4	56%	0.558	41%	0.413	S	S	*	.			trans	-61.6	150.8	177.3	-24.1	34.6	0	0	0	113.8	A933 L934 R935	P931-A933 VanDerWaalsContact C-N 3.32Å; P931-A933 PolarHBondContact O-N 2.97Å; P931-L934 PolarHBondContact O-N 3.33Å; P931-R935 WeakPolarHBondContact O-CG 2.97Å; P931-R935 PolarHBondContact O-N 2.92Å
932	R	94.8	Very high	95.9	Very high	199 Å²	199	90 Å²	90	75%	0.751	42%	0.417	S	S	*	.	H	α-helix	trans	-53.3	-45.4	-178	-173.7	179.5	-179.8	-176.9	0.6	112.5	L934 R935 Q936	R932-L934 PolarHBondContact O-N 2.97Å; R932-R935 PolarHBondContact O-N 2.92Å; R932-Q936 PolarHBondContact O-N 3.19Å
933	A	95.5	Very high	95.8	Very high	74 Å²	74	91.8 Å²	91.8	61%	0.612	43%	0.426	S	S	*	.	H	α-helix	trans	-59	-43.6	177.9	0	0	0	0	0	112.8	P931 Q936 R937	P931-A933 VanDerWaalsContact C-N 3.32Å; P931-A933 PolarHBondContact O-N 2.97Å; A933-Q936 PolarHBondContact O-N 3.49Å; A933-R937 WeakPolarHBondContact O-CG 3.41Å; A933-R937 PolarHBondContact O-N 3.05Å
934	L	95.8	Very high	95.6	Very high	75 Å²	75	90.6 Å²	90.6	39%	0.393	42%	0.42	S	S	.	.	H	α-helix	trans	-67.7	-36	177.1	-177.2	57.8	0	0	0	111.8	L930 P931 R932 R937 I938	L930-L934 HydrophobicContact CB-CD2 4.32Å; L930-L934 HydrophobicContact CD1-CD2 4.06Å; L930-L934 HydrophobicContact CD1-CG 4.41Å; L930-L934 HydrophobicContact CD2-CD2 4.32Å; L930-L934 HydrophobicContact CG-CD2 4.47Å; P931-L934 PolarHBondContact O-N 3.33Å; R932-L934 PolarHBondContact O-N 2.97Å; L934-R937 PolarHBondContact O-N 3.39Å; L934-I938 HydrophobicContact CD1-CD1 4.31Å; L934-I938 HydrophobicContact CD1-CG1 4.48Å; L934-I938 HydrophobicContact CG-CD1 4.07Å; L934-I938 WeakPolarHBondContact O-CD1 3.28Å; L934-I938 VanDerWaalsContact O-CG1 3.28Å; L934-I938 WeakPolarHBondContact O-CG1 3.49Å; L934-I938 PolarHBondContact O-N 2.94Å
935	R	95.5	Very high	95.5	Very high	99 Å²	99	86.9 Å²	86.9	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-42.6	173.5	-59.9	-171.4	-158.4	177.2	9.2	112	M925 L930 P931 R932 I938 A939	M925-R935 HydrophobicContact CB-CG 4.18Å; M925-R935 HydrophobicContact CE-CB 4.37Å; M925-R935 HydrophobicContact CG-CG 4.48Å; M925-R935 HydrophobicContact SD-CB 3.83Å; M925-R935 HydrophobicContact SD-CG 3.78Å; L930-R935 HydrophobicContact CB-CG 4.22Å; L930-R935 VanDerWaalsContact O-CZ 3.25Å; L930-R935 PolarHBondContact O-NE 3.23Å; L930-R935 PolarHBondContact O-NH2 3.42Å; P931-R935 WeakPolarHBondContact O-CG 2.97Å; P931-R935 PolarHBondContact O-N 2.92Å; R932-R935 PolarHBondContact O-N 2.92Å; R935-I938 PolarHBondContact O-N 3.08Å; R935-A939 WeakPolarHBondContact O-CB 3.44Å; R935-A939 PolarHBondContact O-N 3.34Å
936	Q	95.6	Very high	95.2	Very high	105 Å²	105	89.6 Å²	89.6	49%	0.491	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-43	176.7	-165.8	64.4	47.5	0	0	111.3	R932 A933 I938 A939 N940	R932-Q936 PolarHBondContact O-N 3.19Å; A933-Q936 PolarHBondContact O-N 3.49Å; Q936-I938 VanDerWaalsContact C-N 3.34Å; Q936-I938 PolarHBondContact O-N 3.18Å; Q936-A939 WeakPolarHBondContact O-CB 3.14Å; Q936-A939 PolarHBondContact O-N 3.39Å; Q936-A939 VanDerWaalsContact O-N 3.17Å; Q936-N940 PolarHBondContact NE2-OD1 3.01Å; Q936-N940 VanDerWaalsContact O-CG 3.25Å; Q936-N940 PolarHBondContact O-N 2.91Å; Q936-N940 PolarHBondContact O-OD1 2.97Å
937	R	96.1	Very high	95	Very high	110 Å²	110	94 Å²	94	42%	0.415	43%	0.427	S	S	.	.	H	α-helix	trans	-57.1	-45.8	173.7	-76.7	-165.4	60.2	-175.9	-7.2	112.4	A933 L934 Y941 Q1004 D1007	A933-R937 WeakPolarHBondContact O-CG 3.41Å; A933-R937 PolarHBondContact O-N 3.05Å; L934-R937 PolarHBondContact O-N 3.39Å; R937-Y941 WeakPolarHBondContact O-CB 3.43Å; R937-Y941 PolarHBondContact O-N 3.22Å; R937-Q1004 PolarHBondContact O-NE2 3.38Å; R937-D1007 IonicContact CZ-OD1 3.11Å; R937-D1007 IonicContact NH1-OD1 3.99Å; R937-D1007 VanDerWaalsContact NH2-CG 3.34Å; R937-D1007 IonicContact NH2-OD1 3.22Å; R937-D1007 PolarHBondContact NH2-OD1 2.81Å; R937-D1007 IonicContact NH2-OD2 2.69Å; R937-D1007 PolarHBondContact NH2-OD2 2.67Å
938	I	96.2	Very high	94.6	Very high	39 Å²	39	86.9 Å²	86.9	20%	0.2	41%	0.407	C	S	.	.	H	α-helix	trans	-63	-41.1	175.7	-68.1	164	0	0	0	111.3	V921 M925 L930 L934 R935 Q936 Y941 Y942	V921-I938 HydrophobicContact CG1-CG2 3.73Å; M925-I938 HydrophobicContact CE-CG2 4.43Å; M925-I938 HydrophobicContact CG-CD1 4.21Å; M925-I938 HydrophobicContact SD-CB 3.86Å; M925-I938 HydrophobicContact SD-CD1 3.73Å; M925-I938 HydrophobicContact SD-CG1 4.4Å; M925-I938 HydrophobicContact SD-CG2 3.75Å; L930-I938 HydrophobicContact CD1-CD1 3.87Å; L934-I938 HydrophobicContact CD1-CD1 4.31Å; L934-I938 HydrophobicContact CD1-CG1 4.48Å; L934-I938 HydrophobicContact CG-CD1 4.07Å; L934-I938 WeakPolarHBondContact O-CD1 3.28Å; L934-I938 VanDerWaalsContact O-CG1 3.28Å; L934-I938 WeakPolarHBondContact O-CG1 3.49Å; L934-I938 PolarHBondContact O-N 2.94Å; R935-I938 PolarHBondContact O-N 3.08Å; Q936-I938 VanDerWaalsContact C-N 3.34Å; Q936-I938 PolarHBondContact O-N 3.18Å; I938-Y941 PolarHBondContact O-N 3.2Å; I938-Y942 HydrophobicContact CG2-CD2 3.95Å; I938-Y942 HydrophobicContact CG2-CE2 4.14Å; I938-Y942 WeakPolarHBondContact O-CD2 3.38Å; I938-Y942 PolarHBondContact O-N 2.77Å
939	A	94.7	Very high	94.2	Very high	23 Å²	23	84.7 Å²	84.7	19%	0.19	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-55	176.6	0	0	0	0	0	111.6	F918 R935 Q936 Y941 Y942 E943	F918-A939 HydrophobicContact CE2-CB 4.42Å; F918-A939 HydrophobicContact CZ-CB 3.93Å; R935-A939 WeakPolarHBondContact O-CB 3.44Å; R935-A939 PolarHBondContact O-N 3.34Å; Q936-A939 WeakPolarHBondContact O-CB 3.14Å; Q936-A939 PolarHBondContact O-N 3.39Å; Q936-A939 VanDerWaalsContact O-N 3.17Å; A939-Y941 VanDerWaalsContact C-N 3.26Å; A939-Y941 PolarHBondContact O-N 3.13Å; A939-Y942 PolarHBondContact O-N 2.76Å; A939-Y942 VanDerWaalsContact O-N 3.13Å; A939-E943 PolarHBondContact O-N 3.26Å
940	N	95.5	Very high	93.8	Very high	53 Å²	53	78.7 Å²	78.7	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-36.2	179	-61.3	13.8	0	0	0	111.9	Q936 H944	Q936-N940 PolarHBondContact NE2-OD1 3.01Å; Q936-N940 VanDerWaalsContact O-CG 3.25Å; Q936-N940 PolarHBondContact O-N 2.91Å; Q936-N940 PolarHBondContact O-OD1 2.97Å; N940-H944 WeakPolarHBondContact O-CB 3.24Å; N940-H944 PolarHBondContact O-N 3.03Å
941	Y	96	Very high	93.4	Very high	77 Å²	77	82.5 Å²	82.5	30%	0.302	39%	0.392	S	S	.	.	H	α-helix	trans	-63.8	-47.8	174.5	171.1	-91.2	0	0	0	112.2	R937 I938 A939 E943 H944 R945 V1002	R937-Y941 WeakPolarHBondContact O-CB 3.43Å; R937-Y941 PolarHBondContact O-N 3.22Å; I938-Y941 PolarHBondContact O-N 3.2Å; A939-Y941 VanDerWaalsContact C-N 3.26Å; A939-Y941 PolarHBondContact O-N 3.13Å; Y941-E943 VanDerWaalsContact C-N 3.32Å; Y941-E943 PolarHBondContact O-N 2.72Å; Y941-H944 PolarHBondContact O-N 3.03Å; Y941-R945 HydrophobicContact CE1-CB 4.39Å; Y941-R945 VanDerWaalsContact O-CB 3.24Å; Y941-R945 WeakPolarHBondContact O-CB 3.24Å; Y941-R945 PolarHBondContact O-N 2.75Å; Y941-V1002 HydrophobicContact CE2-CB 4.4Å; Y941-V1002 WeakPolarHBondContact CE2-O 3.27Å
942	Y	94.2	Very high	93	Very high	50 Å²	50	82.8 Å²	82.8	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-65.4	-36.8	178.7	-95.4	-94.1	0	0	0	112	F918 V921 I938 A939 Y946	F918-Y942 HydrophobicContact CD2-CD1 4.32Å; F918-Y942 HydrophobicContact CD2-CG 4.09Å; F918-Y942 HydrophobicContact CE2-CG 4.28Å; V921-Y942 HydrophobicContact CG1-CE2 4.12Å; V921-Y942 HydrophobicContact CG2-CE1 4.04Å; V921-Y942 HydrophobicContact CG2-CE2 4.06Å; I938-Y942 HydrophobicContact CG2-CD2 3.95Å; I938-Y942 HydrophobicContact CG2-CE2 4.14Å; I938-Y942 WeakPolarHBondContact O-CD2 3.38Å; I938-Y942 PolarHBondContact O-N 2.77Å; A939-Y942 PolarHBondContact O-N 2.76Å; A939-Y942 VanDerWaalsContact O-N 3.13Å; Y942-Y946 AromaticContact CD1-CD2 3.78Å; Y942-Y946 HydrophobicContact CD1-CD2 3.78Å; Y942-Y946 AromaticContact CD1-CE2 3.76Å; Y942-Y946 HydrophobicContact CD1-CE2 3.76Å; Y942-Y946 HydrophobicContact CE1-CD2 4.31Å; Y942-Y946 AromaticContact CE1-CE2 3.84Å; Y942-Y946 HydrophobicContact CE1-CE2 3.84Å; Y942-Y946 HydrophobicContact CG-CD2 4.48Å; Y942-Y946 WeakPolarHBondContact O-CB 3.33Å; Y942-Y946 WeakPolarHBondContact O-CD2 3.31Å; Y942-Y946 PolarHBondContact O-N 2.69Å
943	E	93.5	Very high	92.7	Very high	126 Å²	126	77.6 Å²	77.6	59%	0.589	37%	0.373	S	S	*	.	H	α-helix	trans	-63.3	-50.9	174.6	-177.7	165.9	-143.8	0	0	111.5	A939 Y941 Q947	A939-E943 PolarHBondContact O-N 3.26Å; Y941-E943 VanDerWaalsContact C-N 3.32Å; Y941-E943 PolarHBondContact O-N 2.72Å; E943-Q947 VanDerWaalsContact O-CA 3.3Å; E943-Q947 WeakPolarHBondContact O-CA 3.25Å; E943-Q947 PolarHBondContact O-N 3.31Å
944	H	92.9	Very high	92.3	Very high	62 Å²	62	77 Å²	77	29%	0.287	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-45.3	179.3	-162	101.9	0	0	0	112.3	N940 Y941 Y946 Y1066	N940-H944 WeakPolarHBondContact O-CB 3.24Å; N940-H944 PolarHBondContact O-N 3.03Å; Y941-H944 PolarHBondContact O-N 3.03Å; H944-Y946 VanDerWaalsContact C-N 3.34Å; H944-Y946 PolarHBondContact O-N 3.18Å; H944-Y1066 HydrophobicContact CB-CD1 4.19Å; H944-Y1066 HydrophobicContact CB-CE1 4.11Å; H944-Y1066 VanDerWaalsContact CE1-CB 3.46Å; H944-Y1066 WeakPolarHBondContact CE1-CB 3.39Å; H944-Y1066 AromaticContact CE1-CD1 3.93Å; H944-Y1066 AromaticContact CE1-CG 3.65Å; H944-Y1066 AromaticContact CG-CD1 3.69Å; H944-Y1066 AromaticContact ND1-CD1 3.57Å; H944-Y1066 AromaticContact ND1-CG 3.61Å
945	R	93.5	Very high	92.1	Very high	50 Å²	50	76.8 Å²	76.8	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-24.8	-176.1	178.8	58.4	-172.9	88.3	-10.4	114.2	Y941 V1002	Y941-R945 HydrophobicContact CE1-CB 4.39Å; Y941-R945 VanDerWaalsContact O-CB 3.24Å; Y941-R945 WeakPolarHBondContact O-CB 3.24Å; Y941-R945 PolarHBondContact O-N 2.75Å; R945-V1002 VanDerWaalsContact CD-CG2 3.45Å
946	Y	91.7	Very high	91.9	Very high	67 Å²	67	73.9 Å²	73.9	26%	0.263	36%	0.356	S	S	.	.	H	α-helix	trans	-127.3	-10.2	-173	-62.8	-75.3	0	0	0	115.2	Y942 H944 G948 K949	Y942-Y946 AromaticContact CD1-CD2 3.78Å; Y942-Y946 HydrophobicContact CD1-CD2 3.78Å; Y942-Y946 AromaticContact CD1-CE2 3.76Å; Y942-Y946 HydrophobicContact CD1-CE2 3.76Å; Y942-Y946 HydrophobicContact CE1-CD2 4.31Å; Y942-Y946 AromaticContact CE1-CE2 3.84Å; Y942-Y946 HydrophobicContact CE1-CE2 3.84Å; Y942-Y946 HydrophobicContact CG-CD2 4.48Å; Y942-Y946 WeakPolarHBondContact O-CB 3.33Å; Y942-Y946 WeakPolarHBondContact O-CD2 3.31Å; Y942-Y946 PolarHBondContact O-N 2.69Å; H944-Y946 VanDerWaalsContact C-N 3.34Å; H944-Y946 PolarHBondContact O-N 3.18Å; Y946-G948 PolarHBondContact O-N 3.06Å; Y946-G948 VanDerWaalsContact O-N 3.1Å; Y946-K949 PolarHBondContact O-N 3.49Å
947	Q	91.2	Very high	91.7	Very high	144 Å²	144	70.4 Å²	70.4	67%	0.673	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	42.3	175	-56.7	177.9	-3.8	0	0	113.2	E943 K949	E943-Q947 VanDerWaalsContact O-CA 3.3Å; E943-Q947 WeakPolarHBondContact O-CA 3.25Å; E943-Q947 PolarHBondContact O-N 3.31Å; Q947-K949 PolarHBondContact O-N 3.21Å
948	G	86.3	Confident	91.4	Very high	25 Å²	25	70.6 Å²	70.6	26%	0.258	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	5.9	-178.6	0	0	0	0	0	116.4	Y914 Y946	Y914-G948 WeakPolarHBondContact CB-O 3.06Å; Y946-G948 PolarHBondContact O-N 3.06Å; Y946-G948 VanDerWaalsContact O-N 3.1Å
949	K	89.4	Confident	91.2	Very high	97 Å²	97	72 Å²	72	42%	0.422	36%	0.356	S	S	.	.			trans	-126.6	121.7	-175	-59.3	157.9	-165.7	152.1	0	109.9	Y946 Q947 F951	Y946-K949 PolarHBondContact O-N 3.49Å; Q947-K949 PolarHBondContact O-N 3.21Å; K949-F951 HydrophobicContact CB-CD2 4.43Å; K949-F951 HydrophobicContact CB-CE2 3.64Å; K949-F951 HydrophobicContact CB-CZ 4.03Å; K949-F951 HydrophobicContact CD-CE2 4.44Å
950	M	87.3	Confident	91.1	Very high	54 Å²	54	73.5 Å²	73.5	27%	0.266	36%	0.358	S	S	.	.			trans	-98.9	129.6	176.4	-167.5	-179.2	-175	0	0	111.5	S910 L913 K917	S910-M950 PolarHBondContact O-N 3.43Å; L913-M950 HydrophobicContact CB-CB 4.23Å; K917-M950 HydrophobicContact CB-CE 4.25Å; K917-M950 HydrophobicContact CB-SD 3.44Å; K917-M950 WeakPolarHBondContact CB-SD 3.46Å; K917-M950 HydrophobicContact CD-CE 4.14Å; K917-M950 HydrophobicContact CD-SD 4.4Å; K917-M950 HydrophobicContact CG-CE 3.79Å; K917-M950 HydrophobicContact CG-SD 3.65Å
951	F	88.8	Confident	90.9	Very high	117 Å²	117	74.4 Å²	74.4	51%	0.513	37%	0.368	S	S	.	.			trans	-131.3	148.2	172.1	-55.3	-72.8	0	0	0	109.7	K949 I956	K949-F951 HydrophobicContact CB-CD2 4.43Å; K949-F951 HydrophobicContact CB-CE2 3.64Å; K949-F951 HydrophobicContact CB-CZ 4.03Å; K949-F951 HydrophobicContact CD-CE2 4.44Å; F951-I956 HydrophobicContact CB-CD1 4.22Å
952	D	88.8	Confident	90.5	Very high	92 Å²	92	77.8 Å²	77.8	49%	0.492	39%	0.387	S	S	.	.			trans	-92.8	99.4	161.2	-173	-29.4	0	0	0	107.3	A954 Q955 I956	D952-A954 PolarHBondContact OD1-N 3.04Å; D952-Q955 HydrophobicContact CB-CB 4Å; D952-Q955 VanDerWaalsContact CG-CB 3.4Å; D952-Q955 VanDerWaalsContact OD1-CB 3.3Å; D952-Q955 WeakPolarHBondContact OD1-CB 3.24Å; D952-Q955 PolarHBondContact OD1-N 3.32Å; D952-I956 WeakPolarHBondContact O-CD1 3.42Å; D952-I956 VanDerWaalsContact O-CG1 3.25Å; D952-I956 WeakPolarHBondContact O-CG1 3.4Å; D952-I956 PolarHBondContact O-N 2.68Å
953	E	87.9	Confident	90.2	Very high	90 Å²	90	79.3 Å²	79.3	42%	0.421	40%	0.404	S	S	.	.	H	α-helix	trans	-73	-42.7	-173.3	-176.5	166.7	-156.5	0	0	111.9	Q955 I956 L957	E953-Q955 VanDerWaalsContact C-N 3.33Å; E953-Q955 PolarHBondContact O-N 3.32Å; E953-I956 PolarHBondContact O-N 3.16Å; E953-I956 VanDerWaalsContact O-N 3.15Å; E953-L957 HydrophobicContact CG-CD1 4.12Å; E953-L957 WeakPolarHBondContact O-CG 3.28Å; E953-L957 PolarHBondContact O-N 2.93Å
954	A	87.4	Confident	90.1	Very high	61 Å²	61	77.6 Å²	77.6	50%	0.504	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-42.3	175.6	0	0	0	0	0	111.4	D952 I956 L957 N958	D952-A954 PolarHBondContact OD1-N 3.04Å; A954-I956 PolarHBondContact O-N 3.14Å; A954-L957 PolarHBondContact O-N 2.69Å; A954-N958 WeakPolarHBondContact O-CB 3.4Å; A954-N958 VanDerWaalsContact O-CG 3.24Å; A954-N958 PolarHBondContact O-N 2.84Å; A954-N958 PolarHBondContact O-ND2 3.47Å
955	Q	91.2	Very high	89.9	Confident	71 Å²	71	77.9 Å²	77.9	33%	0.332	40%	0.397	S	S	.	.	H	α-helix	trans	-64.7	-37.4	175.4	-158.9	-138.9	-2	0	0	112.2	D952 E953 E959	D952-Q955 HydrophobicContact CB-CB 4Å; D952-Q955 VanDerWaalsContact CG-CB 3.4Å; D952-Q955 VanDerWaalsContact OD1-CB 3.3Å; D952-Q955 WeakPolarHBondContact OD1-CB 3.24Å; D952-Q955 PolarHBondContact OD1-N 3.32Å; E953-Q955 VanDerWaalsContact C-N 3.33Å; E953-Q955 PolarHBondContact O-N 3.32Å; Q955-E959 PolarHBondContact NE2-OE1 3.05Å; Q955-E959 VanDerWaalsContact O-CG 3.27Å; Q955-E959 WeakPolarHBondContact O-CG 3.38Å; Q955-E959 PolarHBondContact O-N 2.7Å; Q955-E959 VanDerWaalsContact O-N 3.14Å
956	I	92.5	Very high	89.6	Confident	39 Å²	39	79.4 Å²	79.4	20%	0.2	41%	0.406	C	S	.	.	H	α-helix	trans	-63.6	-51.8	175.5	-69.1	163.7	0	0	0	110.8	F951 D952 E953 A954 N958 E959 F960 K1209	F951-I956 HydrophobicContact CB-CD1 4.22Å; D952-I956 WeakPolarHBondContact O-CD1 3.42Å; D952-I956 VanDerWaalsContact O-CG1 3.25Å; D952-I956 WeakPolarHBondContact O-CG1 3.4Å; D952-I956 PolarHBondContact O-N 2.68Å; E953-I956 PolarHBondContact O-N 3.16Å; E953-I956 VanDerWaalsContact O-N 3.15Å; A954-I956 PolarHBondContact O-N 3.14Å; I956-N958 VanDerWaalsContact C-N 3.26Å; I956-N958 PolarHBondContact O-N 3.33Å; I956-E959 WeakPolarHBondContact O-CB 3.45Å; I956-E959 PolarHBondContact O-N 2.88Å; I956-E959 VanDerWaalsContact O-N 3.07Å; I956-F960 HydrophobicContact CG2-CD2 4.48Å; I956-F960 HydrophobicContact CG2-CE1 3.92Å; I956-F960 HydrophobicContact CG2-CE2 3.71Å; I956-F960 HydrophobicContact CG2-CZ 3.39Å; I956-F960 PolarHBondContact O-N 2.69Å; I956-K1209 HydrophobicContact CG1-CD 4.01Å; I956-K1209 VanDerWaalsContact CG1-NZ 3.27Å
957	L	90.3	Very high	89.4	Confident	31 Å²	31	82.1 Å²	82.1	16%	0.162	42%	0.421	C	S	.	.	H	α-helix	trans	-64.6	-34.3	-175.6	-68	174.1	0	0	0	111.3	E953 A954 F960 R965 V968 I969	E953-L957 HydrophobicContact CG-CD1 4.12Å; E953-L957 WeakPolarHBondContact O-CG 3.28Å; E953-L957 PolarHBondContact O-N 2.93Å; A954-L957 PolarHBondContact O-N 2.69Å; L957-F960 HydrophobicContact CD2-CD2 4.17Å; L957-F960 HydrophobicContact CD2-CE2 4.33Å; L957-F960 PolarHBondContact O-N 3.41Å; L957-R965 HydrophobicContact CB-CG 4.16Å; L957-R965 HydrophobicContact CD2-CG 4.32Å; L957-R965 PolarHBondContact O-NE 3.21Å; L957-R965 PolarHBondContact O-NH2 3.05Å; L957-V968 HydrophobicContact CD2-CG1 4.03Å; L957-I969 HydrophobicContact CD1-CD1 4.4Å; L957-I969 HydrophobicContact CD1-CG1 4.35Å; L957-I969 HydrophobicContact CD2-CG1 4.38Å
958	N	90.4	Very high	89.4	Confident	114 Å²	114	77.8 Å²	77.8	61%	0.61	41%	0.405	S	S	*	.	H	α-helix	trans	-72.7	-24.2	174	-70.9	-18	0	0	0	114	A954 I956 F960	A954-N958 WeakPolarHBondContact O-CB 3.4Å; A954-N958 VanDerWaalsContact O-CG 3.24Å; A954-N958 PolarHBondContact O-N 2.84Å; A954-N958 PolarHBondContact O-ND2 3.47Å; I956-N958 VanDerWaalsContact C-N 3.26Å; I956-N958 PolarHBondContact O-N 3.33Å; N958-F960 VanDerWaalsContact C-N 3.28Å
959	E	92.4	Very high	89.5	Confident	69 Å²	69	77.9 Å²	77.9	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-75.8	-14.4	170.8	-75.2	164.8	-170.4	0	0	112.7	Q955 I956 K1209	Q955-E959 PolarHBondContact NE2-OE1 3.05Å; Q955-E959 VanDerWaalsContact O-CG 3.27Å; Q955-E959 WeakPolarHBondContact O-CG 3.38Å; Q955-E959 PolarHBondContact O-N 2.7Å; Q955-E959 VanDerWaalsContact O-N 3.14Å; I956-E959 WeakPolarHBondContact O-CB 3.45Å; I956-E959 PolarHBondContact O-N 2.88Å; I956-E959 VanDerWaalsContact O-N 3.07Å; E959-K1209 VanDerWaalsContact OE2-CD 3.24Å; E959-K1209 WeakPolarHBondContact OE2-CD 3.18Å
960	F	91.3	Very high	89.3	Confident	55 Å²	55	75.1 Å²	75.1	24%	0.241	39%	0.389	C	S	.	.	S	Bend	trans	-88.1	148.8	175.1	-61.9	-15.6	0	0	0	112.5	I956 L957 N958 L964 R965 V968	I956-F960 HydrophobicContact CG2-CD2 4.48Å; I956-F960 HydrophobicContact CG2-CE1 3.92Å; I956-F960 HydrophobicContact CG2-CE2 3.71Å; I956-F960 HydrophobicContact CG2-CZ 3.39Å; I956-F960 PolarHBondContact O-N 2.69Å; L957-F960 HydrophobicContact CD2-CD2 4.17Å; L957-F960 HydrophobicContact CD2-CE2 4.33Å; L957-F960 PolarHBondContact O-N 3.41Å; N958-F960 VanDerWaalsContact C-N 3.28Å; F960-L964 HydrophobicContact CB-CB 4.2Å; F960-R965 HydrophobicContact CB-CB 4.41Å; F960-R965 PolarHBondContact O-NH2 3.14Å; F960-V968 HydrophobicContact CD2-CG2 4.49Å; F960-V968 HydrophobicContact CE2-CG2 4.16Å
961	S	91.8	Very high	89.4	Confident	71 Å²	71	79.1 Å²	79.1	50%	0.497	40%	0.402	S	S	.	.			trans	-64.3	155.5	165.3	57.7	0	0	0	0	111.1	C963 L964 R965	S961-C963 PolarHBondContact O-N 3.41Å; S961-L964 PolarHBondContact O-N 2.92Å; S961-R965 PolarHBondContact O-N 3.32Å
962	E	88.1	Confident	89.4	Confident	149 Å²	149	76.8 Å²	76.8	70%	0.696	40%	0.395	S	S	*	.	H	α-helix	trans	-56.8	-47.7	-171.5	-68.1	165.1	165.9	0	0	112.4	L964 R965 E966	E962-L964 VanDerWaalsContact C-N 3.29Å; E962-L964 PolarHBondContact O-N 3.02Å; E962-R965 WeakPolarHBondContact O-CB 3.38Å; E962-R965 PolarHBondContact O-N 3.39Å; E962-R965 VanDerWaalsContact O-N 3.16Å; E962-E966 WeakPolarHBondContact O-CB 3.31Å; E962-E966 PolarHBondContact O-N 2.88Å
963	C	87.9	Confident	89.3	Confident	81 Å²	81	72.5 Å²	72.5	55%	0.547	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-32.8	176.9	-44.9	0	0	0	0	113.4	S961 Q967	S961-C963 PolarHBondContact O-N 3.41Å; C963-Q967 WeakPolarHBondContact O-CB 3.27Å; C963-Q967 WeakPolarHBondContact O-CG 3.14Å; C963-Q967 PolarHBondContact O-N 3.06Å
964	L	90.5	Very high	89.2	Confident	90 Å²	90	75.2 Å²	75.2	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-76.9	-37.9	176.1	-74.1	177.2	0	0	0	111.5	F960 S961 E962 Q967 V968	F960-L964 HydrophobicContact CB-CB 4.2Å; S961-L964 PolarHBondContact O-N 2.92Å; E962-L964 VanDerWaalsContact C-N 3.29Å; E962-L964 PolarHBondContact O-N 3.02Å; L964-Q967 PolarHBondContact O-N 3.18Å; L964-V968 WeakPolarHBondContact O-CB 3.24Å; L964-V968 VanDerWaalsContact O-CG2 3.27Å; L964-V968 WeakPolarHBondContact O-CG2 3.44Å; L964-V968 PolarHBondContact O-N 3.21Å
965	R	90.1	Very high	89.1	Confident	69 Å²	69	75.1 Å²	75.1	26%	0.26	38%	0.377	S	S	.	.	H	α-helix	trans	-60.4	-51	173.6	-174	-174.5	-54.3	152.5	10.8	110.3	L957 F960 S961 E962 V968 I969	L957-R965 HydrophobicContact CB-CG 4.16Å; L957-R965 HydrophobicContact CD2-CG 4.32Å; L957-R965 PolarHBondContact O-NE 3.21Å; L957-R965 PolarHBondContact O-NH2 3.05Å; F960-R965 HydrophobicContact CB-CB 4.41Å; F960-R965 PolarHBondContact O-NH2 3.14Å; S961-R965 PolarHBondContact O-N 3.32Å; E962-R965 WeakPolarHBondContact O-CB 3.38Å; E962-R965 PolarHBondContact O-N 3.39Å; E962-R965 VanDerWaalsContact O-N 3.16Å; R965-V968 PolarHBondContact O-N 3.14Å; R965-I969 HydrophobicContact CG-CD1 3.86Å; R965-I969 VanDerWaalsContact O-CG1 3.27Å; R965-I969 WeakPolarHBondContact O-CG1 3Å; R965-I969 PolarHBondContact O-N 2.91Å
966	E	85.6	Confident	88.8	Confident	81 Å²	81	71.8 Å²	71.8	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-51.5	175.3	-180	-179.9	-157.5	0	0	111.7	E962 V968 I969 N970 S992	E962-E966 WeakPolarHBondContact O-CB 3.31Å; E962-E966 PolarHBondContact O-N 2.88Å; E966-V968 VanDerWaalsContact C-N 3.3Å; E966-V968 PolarHBondContact O-N 3.46Å; E966-I969 PolarHBondContact O-N 3.33Å; E966-N970 WeakPolarHBondContact CG-ND2 3.35Å; E966-N970 VanDerWaalsContact O-CB 3.29Å; E966-N970 WeakPolarHBondContact O-CB 3.42Å; E966-N970 PolarHBondContact O-N 3.47Å; E966-N970 PolarHBondContact O-ND2 3.02Å; E966-S992 PolarHBondContact OE1-OG 3.4Å
967	Q	88	Confident	88.4	Confident	125 Å²	125	71.5 Å²	71.5	58%	0.584	36%	0.362	S	S	*	.	H	α-helix	trans	-59.5	-38	178.4	-76.7	169.9	16.7	0	0	113	C963 L964 Y971	C963-Q967 WeakPolarHBondContact O-CB 3.27Å; C963-Q967 WeakPolarHBondContact O-CG 3.14Å; C963-Q967 PolarHBondContact O-N 3.06Å; L964-Q967 PolarHBondContact O-N 3.18Å; Q967-Y971 VanDerWaalsContact O-CB 3.23Å; Q967-Y971 WeakPolarHBondContact O-CB 3.43Å; Q967-Y971 PolarHBondContact O-N 3.32Å
968	V	90.7	Very high	88.1	Confident	53 Å²	53	73.7 Å²	73.7	32%	0.321	38%	0.384	S	S	.	.	H	α-helix	trans	-70	-45	177.1	168.3	0	0	0	0	111.7	L957 F960 L964 R965 E966 Y971 N972	L957-V968 HydrophobicContact CD2-CG1 4.03Å; F960-V968 HydrophobicContact CD2-CG2 4.49Å; F960-V968 HydrophobicContact CE2-CG2 4.16Å; L964-V968 WeakPolarHBondContact O-CB 3.24Å; L964-V968 VanDerWaalsContact O-CG2 3.27Å; L964-V968 WeakPolarHBondContact O-CG2 3.44Å; L964-V968 PolarHBondContact O-N 3.21Å; R965-V968 PolarHBondContact O-N 3.14Å; E966-V968 VanDerWaalsContact C-N 3.3Å; E966-V968 PolarHBondContact O-N 3.46Å; V968-Y971 PolarHBondContact O-N 3.01Å; V968-N972 VanDerWaalsContact O-CG 3.3Å; V968-N972 PolarHBondContact O-N 3.27Å; V968-N972 PolarHBondContact O-OD1 3.41Å
969	I	88.4	Confident	87.7	Confident	26 Å²	26	70.6 Å²	70.6	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-69.3	-41.7	-179.5	-56.5	166.2	0	0	0	110.3	L957 R965 E966 Y971 N972 C973 V995	L957-I969 HydrophobicContact CD1-CD1 4.4Å; L957-I969 HydrophobicContact CD1-CG1 4.35Å; L957-I969 HydrophobicContact CD2-CG1 4.38Å; R965-I969 HydrophobicContact CG-CD1 3.86Å; R965-I969 VanDerWaalsContact O-CG1 3.27Å; R965-I969 WeakPolarHBondContact O-CG1 3Å; R965-I969 PolarHBondContact O-N 2.91Å; E966-I969 PolarHBondContact O-N 3.33Å; I969-Y971 VanDerWaalsContact C-N 3.34Å; I969-Y971 PolarHBondContact O-N 2.98Å; I969-N972 PolarHBondContact O-N 3.17Å; I969-C973 WeakPolarHBondContact O-CB 3.42Å; I969-C973 PolarHBondContact O-N 3.39Å; I969-C973 PolarHBondContact O-SG 3.25Å; I969-V995 HydrophobicContact CB-CG1 4.4Å; I969-V995 HydrophobicContact CG2-CG1 3.59Å; I969-V995 WeakPolarHBondContact CG2-O 3.16Å
970	N	87	Confident	87.3	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.214	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-36.4	173.1	-80.8	-42.1	0	0	0	112.3	E966 R974 S992 V995	E966-N970 WeakPolarHBondContact CG-ND2 3.35Å; E966-N970 VanDerWaalsContact O-CB 3.29Å; E966-N970 WeakPolarHBondContact O-CB 3.42Å; E966-N970 PolarHBondContact O-N 3.47Å; E966-N970 PolarHBondContact O-ND2 3.02Å; N970-R974 WeakPolarHBondContact O-CB 3.24Å; N970-R974 PolarHBondContact O-N 2.88Å; N970-S992 PolarHBondContact ND2-OG 2.72Å; N970-V995 WeakPolarHBondContact OD1-CG1 3.26Å
971	Y	88.9	Confident	86.5	Confident	138 Å²	138	68.6 Å²	68.6	54%	0.541	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-42.3	172.6	-177.7	-88.8	0	0	0	112.4	Q967 V968 I969 R974	Q967-Y971 VanDerWaalsContact O-CB 3.23Å; Q967-Y971 WeakPolarHBondContact O-CB 3.43Å; Q967-Y971 PolarHBondContact O-N 3.32Å; V968-Y971 PolarHBondContact O-N 3.01Å; I969-Y971 VanDerWaalsContact C-N 3.34Å; I969-Y971 PolarHBondContact O-N 2.98Å; Y971-R974 WeakPolarHBondContact O-CD 3.26Å; Y971-R974 WeakPolarHBondContact O-CG 3.49Å; Y971-R974 PolarHBondContact O-NE 3.31Å; Y971-R974 PolarHBondContact OH-NH2 3.29Å
972	N	87.6	Confident	85.5	Confident	68 Å²	68	66.2 Å²	66.2	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-65.5	-41.2	177.2	-70.6	-5.7	0	0	0	111.6	V968 I969	V968-N972 VanDerWaalsContact O-CG 3.3Å; V968-N972 PolarHBondContact O-N 3.27Å; V968-N972 PolarHBondContact O-OD1 3.41Å; I969-N972 PolarHBondContact O-N 3.17Å
973	C	86.9	Confident	85.1	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-86.2	-4.9	-176.9	-59.5	0	0	0	0	114.1	I969 A975 L976 V977 V995	I969-C973 WeakPolarHBondContact O-CB 3.42Å; I969-C973 PolarHBondContact O-N 3.39Å; I969-C973 PolarHBondContact O-SG 3.25Å; C973-A975 PolarHBondContact O-N 3.38Å; C973-L976 WeakPolarHBondContact O-CA 3.19Å; C973-L976 WeakPolarHBondContact O-CB 3.29Å; C973-L976 PolarHBondContact O-N 3.09Å; C973-V977 HydrophobicContact CB-CG2 4.41Å; C973-V977 WeakPolarHBondContact O-CG2 3.14Å; C973-V977 PolarHBondContact O-N 2.91Å; C973-V995 HydrophobicContact CB-CG1 3.73Å; C973-V995 HydrophobicContact CB-CG2 4.07Å
974	R	86.2	Confident	84.5	Confident	148 Å²	148	59.5 Å²	59.5	56%	0.558	32%	0.32	S	S	*	.	H	α-helix	trans	-52	-35	-175.9	73.9	-168.1	172.3	136.5	5.3	114.5	N970 Y971 A978	N970-R974 WeakPolarHBondContact O-CB 3.24Å; N970-R974 PolarHBondContact O-N 2.88Å; Y971-R974 WeakPolarHBondContact O-CD 3.26Å; Y971-R974 WeakPolarHBondContact O-CG 3.49Å; Y971-R974 PolarHBondContact O-NE 3.31Å; Y971-R974 PolarHBondContact OH-NH2 3.29Å; R974-A978 WeakPolarHBondContact O-CB 3.39Å; R974-A978 PolarHBondContact O-N 3.44Å; R974-A978 VanDerWaalsContact O-N 3.09Å
975	A	84.5	Confident	83.7	Confident	58 Å²	58	64.8 Å²	64.8	48%	0.479	34%	0.335	S	S	.	.	H	α-helix	trans	-70.2	-43.3	177.4	0	0	0	0	0	111.3	C973 A978 A979	C973-A975 PolarHBondContact O-N 3.38Å; A975-A978 PolarHBondContact O-N 3.47Å; A975-A979 WeakPolarHBondContact O-CB 3.28Å; A975-A979 PolarHBondContact O-N 3.34Å
976	L	85.4	Confident	83.2	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-45.7	175	-169.2	79.6	0	0	0	111.5	C973 A978 A979 V980 L998 F1021 I1022 Q1023 Y1070	C973-L976 WeakPolarHBondContact O-CA 3.19Å; C973-L976 WeakPolarHBondContact O-CB 3.29Å; C973-L976 PolarHBondContact O-N 3.09Å; L976-A978 VanDerWaalsContact C-N 3.29Å; L976-A978 PolarHBondContact O-N 3.39Å; L976-A979 PolarHBondContact O-N 3.23Å; L976-V980 HydrophobicContact CD1-CG2 4.13Å; L976-V980 HydrophobicContact CG-CG2 4.03Å; L976-V980 WeakPolarHBondContact O-CB 3.28Å; L976-V980 VanDerWaalsContact O-CG2 3.27Å; L976-V980 WeakPolarHBondContact O-CG2 3.48Å; L976-V980 PolarHBondContact O-N 3.29Å; L976-L998 HydrophobicContact CD2-CD1 3.82Å; L976-F1021 HydrophobicContact CD1-CB 3.93Å; L976-F1021 HydrophobicContact CD2-CB 3.87Å; L976-F1021 HydrophobicContact CD2-CG 4.38Å; L976-F1021 HydrophobicContact CG-CB 4.33Å; L976-I1022 VanDerWaalsContact CD1-O 3.23Å; L976-I1022 WeakPolarHBondContact CD1-O 3.35Å; L976-Q1023 HydrophobicContact CD1-CB 4.24Å; L976-Y1070 HydrophobicContact CD2-CD2 3.78Å; L976-Y1070 HydrophobicContact CD2-CE2 4.45Å; L976-Y1070 HydrophobicContact CD2-CG 4.35Å
977	V	85.5	Confident	83.1	Confident	33 Å²	33	63.1 Å²	63.1	20%	0.2	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-37.3	178.4	171.8	0	0	0	0	111.8	C973 F983 V991 V995	C973-V977 HydrophobicContact CB-CG2 4.41Å; C973-V977 WeakPolarHBondContact O-CG2 3.14Å; C973-V977 PolarHBondContact O-N 2.91Å; V977-F983 HydrophobicContact CG1-CB 4.28Å; V977-V991 HydrophobicContact CB-CG1 4.44Å; V977-V991 HydrophobicContact CG1-CG1 3.75Å; V977-V991 HydrophobicContact CG2-CG1 3.74Å; V977-V995 HydrophobicContact CG2-CG2 3.77Å
978	A	82.6	Confident	82.9	Confident	76 Å²	76	63.8 Å²	63.8	63%	0.628	34%	0.34	S	S	*	.	H	α-helix	trans	-78.4	-29.5	176.5	0	0	0	0	0	113.7	R974 A975 L976	R974-A978 WeakPolarHBondContact O-CB 3.39Å; R974-A978 PolarHBondContact O-N 3.44Å; R974-A978 VanDerWaalsContact O-N 3.09Å; A975-A978 PolarHBondContact O-N 3.47Å; L976-A978 VanDerWaalsContact C-N 3.29Å; L976-A978 PolarHBondContact O-N 3.39Å
979	A	82.5	Confident	82.6	Confident	49 Å²	49	66.2 Å²	66.2	41%	0.405	35%	0.352	S	S	.	.	H	α-helix	trans	-86.1	-32	-176.6	0	0	0	0	0	113.5	A975 L976 P981	A975-A979 WeakPolarHBondContact O-CB 3.28Å; A975-A979 PolarHBondContact O-N 3.34Å; L976-A979 PolarHBondContact O-N 3.23Å; A979-P981 VanDerWaalsContact O-CD 3.24Å; A979-P981 WeakPolarHBondContact O-CD 3.26Å
980	V	83	Confident	82.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.346	C	S	.	.			trans	-80.4	108.3	178.2	173	0	0	0	0	109.6	L976 F982 F983 T984 F1021 G1043 Y1045	L976-V980 HydrophobicContact CD1-CG2 4.13Å; L976-V980 HydrophobicContact CG-CG2 4.03Å; L976-V980 WeakPolarHBondContact O-CB 3.28Å; L976-V980 VanDerWaalsContact O-CG2 3.27Å; L976-V980 WeakPolarHBondContact O-CG2 3.48Å; L976-V980 PolarHBondContact O-N 3.29Å; V980-F982 HydrophobicContact CG1-CB 3.95Å; V980-F982 PolarHBondContact O-N 3.31Å; V980-F983 HydrophobicContact CB-CD2 3.63Å; V980-F983 HydrophobicContact CB-CE2 4.13Å; V980-F983 HydrophobicContact CB-CG 4.42Å; V980-F983 HydrophobicContact CG1-CD2 3.62Å; V980-F983 HydrophobicContact CG1-CE2 3.91Å; V980-F983 HydrophobicContact CG1-CG 4.16Å; V980-F983 HydrophobicContact CG2-CD2 4.2Å; V980-F983 HydrophobicContact CG2-CE2 4.28Å; V980-F983 PolarHBondContact O-N 3.17Å; V980-T984 PolarHBondContact O-N 3.01Å; V980-T984 PolarHBondContact O-OG1 3.34Å; V980-F1021 HydrophobicContact CG1-CD1 4.5Å; V980-F1021 HydrophobicContact CG2-CD1 4.23Å; V980-G1043 WeakPolarHBondContact CA-O 3.43Å; V980-G1043 VanDerWaalsContact CG2-O 3.27Å; V980-G1043 WeakPolarHBondContact CG2-O 3.3Å; V980-Y1045 HydrophobicContact CG1-CD1 4.08Å; V980-Y1045 HydrophobicContact CG1-CE1 4.45Å
981	P	75.7	Confident	82.5	Confident	82 Å²	82	63.5 Å²	63.5	53%	0.532	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-25	-171.7	-23	35.3	0	0	0	113.8	A979 F983 T984 Y985	A979-P981 VanDerWaalsContact O-CD 3.24Å; A979-P981 WeakPolarHBondContact O-CD 3.26Å; P981-F983 VanDerWaalsContact C-N 3.32Å; P981-F983 PolarHBondContact O-N 3.43Å; P981-T984 PolarHBondContact O-N 3.18Å; P981-Y985 VanDerWaalsContact O-CD2 3.25Å; P981-Y985 WeakPolarHBondContact O-CD2 3.48Å
982	F	71.3	Confident	82.3	Confident	22 Å²	22	57.5 Å²	57.5	10%	0.096	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-33.2	174.7	168.7	-94.3	0	0	0	112.8	V980 F990 Y1045 M1087 T1090 M1091	V980-F982 HydrophobicContact CG1-CB 3.95Å; V980-F982 PolarHBondContact O-N 3.31Å; F982-F990 AromaticContact CE1-CE1 3.82Å; F982-F990 HydrophobicContact CE1-CE1 3.82Å; F982-F990 AromaticContact CE1-CZ 3.74Å; F982-F990 HydrophobicContact CE1-CZ 3.74Å; F982-F990 HydrophobicContact CZ-CE1 4.28Å; F982-F990 AromaticContact CZ-CZ 3.89Å; F982-F990 HydrophobicContact CZ-CZ 3.89Å; F982-Y1045 HydrophobicContact CB-CE1 4.13Å; F982-M1087 HydrophobicContact CD2-SD 3.78Å; F982-M1087 HydrophobicContact CE1-CG 4.31Å; F982-M1087 HydrophobicContact CE1-SD 4.3Å; F982-M1087 HydrophobicContact CE2-CG 3.7Å; F982-M1087 HydrophobicContact CE2-SD 3.31Å; F982-M1087 WeakPolarHBondContact CE2-SD 2.96Å; F982-M1087 HydrophobicContact CG-SD 4.45Å; F982-M1087 HydrophobicContact CZ-CG 3.48Å; F982-M1087 VanDerWaalsContact CZ-CG 3.48Å; F982-M1087 HydrophobicContact CZ-SD 3.62Å; F982-T1090 HydrophobicContact CD2-CG2 4.46Å; F982-M1091 HydrophobicContact CE1-CE 4.43Å; F982-M1091 HydrophobicContact CE1-SD 4.42Å; F982-M1091 HydrophobicContact CE2-CB 4.1Å; F982-M1091 HydrophobicContact CE2-CG 4.1Å; F982-M1091 HydrophobicContact CE2-SD 3.97Å; F982-M1091 HydrophobicContact CZ-CE 4.14Å; F982-M1091 HydrophobicContact CZ-CG 4.37Å; F982-M1091 HydrophobicContact CZ-SD 3.62Å
983	F	79.7	Confident	82.2	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-81.8	-29.8	174.6	-64.3	-44	0	0	0	112.6	V977 V980 P981 Y985 A986 F990 V991 V994 F1021	V977-F983 HydrophobicContact CG1-CB 4.28Å; V980-F983 HydrophobicContact CB-CD2 3.63Å; V980-F983 HydrophobicContact CB-CE2 4.13Å; V980-F983 HydrophobicContact CB-CG 4.42Å; V980-F983 HydrophobicContact CG1-CD2 3.62Å; V980-F983 HydrophobicContact CG1-CE2 3.91Å; V980-F983 HydrophobicContact CG1-CG 4.16Å; V980-F983 HydrophobicContact CG2-CD2 4.2Å; V980-F983 HydrophobicContact CG2-CE2 4.28Å; V980-F983 PolarHBondContact O-N 3.17Å; P981-F983 VanDerWaalsContact C-N 3.32Å; P981-F983 PolarHBondContact O-N 3.43Å; F983-Y985 PolarHBondContact O-N 2.93Å; F983-Y985 VanDerWaalsContact O-N 3.15Å; F983-A986 WeakPolarHBondContact O-CB 3.38Å; F983-A986 PolarHBondContact O-N 3.31Å; F983-F990 HydrophobicContact CD1-CD1 4.48Å; F983-F990 AromaticContact CD1-CE1 3.86Å; F983-F990 HydrophobicContact CD1-CE1 3.86Å; F983-F990 AromaticContact CE1-CE1 3.78Å; F983-F990 HydrophobicContact CE1-CE1 3.78Å; F983-F990 HydrophobicContact CE1-CZ 4.42Å; F983-V991 HydrophobicContact CB-CG2 4.05Å; F983-V991 HydrophobicContact CD1-CG2 4.02Å; F983-V991 HydrophobicContact CG-CG2 4.32Å; F983-V994 HydrophobicContact CE1-CB 4.33Å; F983-V994 HydrophobicContact CE1-CG1 4.04Å; F983-V994 HydrophobicContact CE1-CG2 4.41Å; F983-V994 HydrophobicContact CZ-CG1 3.81Å; F983-F1021 HydrophobicContact CE2-CD1 4Å; F983-F1021 AromaticContact CE2-CE1 3.76Å; F983-F1021 HydrophobicContact CE2-CE1 3.76Å; F983-F1021 HydrophobicContact CE2-CZ 4.39Å; F983-F1021 HydrophobicContact CZ-CD1 4.19Å; F983-F1021 AromaticContact CZ-CE1 3.5Å; F983-F1021 HydrophobicContact CZ-CE1 3.5Å; F983-F1021 AromaticContact CZ-CZ 3.76Å; F983-F1021 HydrophobicContact CZ-CZ 3.76Å
984	T	75	Confident	82.3	Confident	82 Å²	82	56.6 Å²	56.6	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-24.3	-179.7	-49.4	0	0	0	0	114.2	V980 P981	V980-T984 PolarHBondContact O-N 3.01Å; V980-T984 PolarHBondContact O-OG1 3.34Å; P981-T984 PolarHBondContact O-N 3.18Å
985	Y	73.5	Confident	82.4	Confident	202 Å²	202	49.5 Å²	49.5	79%	0.792	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	5	176.4	-55.7	-69.3	0	0	0	113.8	P981 F983	P981-Y985 VanDerWaalsContact O-CD2 3.25Å; P981-Y985 WeakPolarHBondContact O-CD2 3.48Å; F983-Y985 PolarHBondContact O-N 2.93Å; F983-Y985 VanDerWaalsContact O-N 3.15Å
986	A	79.5	Confident	82.5	Confident	24 Å²	24	49.8 Å²	49.8	20%	0.198	28%	0.278	C	S	.	.	S	Bend	trans	-83.1	169.5	-179.7	0	0	0	0	0	112.5	F983 F990 V991 M1087	F983-A986 WeakPolarHBondContact O-CB 3.38Å; F983-A986 PolarHBondContact O-N 3.31Å; A986-F990 HydrophobicContact CB-CD1 3.68Å; A986-F990 HydrophobicContact CB-CE1 4.12Å; A986-V991 HydrophobicContact CB-CG2 3.95Å; A986-M1087 HydrophobicContact CB-CE 3.47Å; A986-M1087 VanDerWaalsContact CB-CE 3.47Å
987	D	82.6	Confident	82.7	Confident	91 Å²	91	53.1 Å²	53.1	49%	0.487	29%	0.293	S	S	.	.			trans	-73	146.5	170	-162.1	2.8	0	0	0	111.1	D989 F990 V991	D987-D989 VanDerWaalsContact C-N 3.25Å; D987-D989 PolarHBondContact O-N 2.82Å; D987-F990 HydrophobicContact CB-CB 4.29Å; D987-F990 PolarHBondContact O-N 3.46Å; D987-V991 WeakPolarHBondContact O-CG2 3.43Å; D987-V991 PolarHBondContact O-N 2.69Å
988	Q	83.7	Confident	82.9	Confident	138 Å²	138	52.5 Å²	52.5	65%	0.645	29%	0.288	S	S	*	.	H	α-helix	trans	-62.1	-37.2	-177.7	-172.4	71	74.6	0	0	111.2	V991 S992	Q988-V991 PolarHBondContact O-N 3.43Å; Q988-S992 PolarHBondContact O-N 3.08Å
989	D	84.9	Confident	83.4	Confident	105 Å²	105	54 Å²	54	56%	0.561	28%	0.281	S	S	*	.	H	α-helix	trans	-73.3	-40.6	-178.5	-65.6	-8.5	0	0	0	111.2	D987 V991 S992 E993 Y1084	D987-D989 VanDerWaalsContact C-N 3.25Å; D987-D989 PolarHBondContact O-N 2.82Å; D989-V991 VanDerWaalsContact C-N 3.33Å; D989-V991 PolarHBondContact O-N 2.83Å; D989-S992 PolarHBondContact O-N 3.35Å; D989-E993 PolarHBondContact O-N 2.88Å; D989-Y1084 WeakPolarHBondContact CB-OH 3.48Å
990	F	87	Confident	83.8	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.018	27%	0.273	C	S	.	.	H	α-helix	trans	-57.2	-45.6	169.3	167.8	-95	0	0	0	111.5	F982 F983 A986 D987 S992 E993 V994 V1080 L1081 Y1084 M1087	F982-F990 AromaticContact CE1-CE1 3.82Å; F982-F990 HydrophobicContact CE1-CE1 3.82Å; F982-F990 AromaticContact CE1-CZ 3.74Å; F982-F990 HydrophobicContact CE1-CZ 3.74Å; F982-F990 HydrophobicContact CZ-CE1 4.28Å; F982-F990 AromaticContact CZ-CZ 3.89Å; F982-F990 HydrophobicContact CZ-CZ 3.89Å; F983-F990 HydrophobicContact CD1-CD1 4.48Å; F983-F990 AromaticContact CD1-CE1 3.86Å; F983-F990 HydrophobicContact CD1-CE1 3.86Å; F983-F990 AromaticContact CE1-CE1 3.78Å; F983-F990 HydrophobicContact CE1-CE1 3.78Å; F983-F990 HydrophobicContact CE1-CZ 4.42Å; A986-F990 HydrophobicContact CB-CD1 3.68Å; A986-F990 HydrophobicContact CB-CE1 4.12Å; D987-F990 HydrophobicContact CB-CB 4.29Å; D987-F990 PolarHBondContact O-N 3.46Å; F990-S992 PolarHBondContact O-N 2.86Å; F990-E993 PolarHBondContact O-N 3.35Å; F990-V994 HydrophobicContact CD1-CG2 4.39Å; F990-V994 HydrophobicContact CD2-CG2 4.2Å; F990-V994 HydrophobicContact CE1-CG2 3.97Å; F990-V994 HydrophobicContact CE2-CG2 3.74Å; F990-V994 HydrophobicContact CZ-CG2 3.61Å; F990-V994 WeakPolarHBondContact O-CG2 3.38Å; F990-V994 PolarHBondContact O-N 3.26Å; F990-V1080 HydrophobicContact CD2-CG1 3.51Å; F990-V1080 HydrophobicContact CE2-CG1 3.56Å; F990-L1081 HydrophobicContact CE2-CD2 4.28Å; F990-Y1084 HydrophobicContact CB-CD1 3.9Å; F990-Y1084 HydrophobicContact CB-CD2 4Å; F990-Y1084 HydrophobicContact CB-CE1 3.84Å; F990-Y1084 HydrophobicContact CB-CE2 3.95Å; F990-Y1084 HydrophobicContact CB-CG 3.98Å; F990-Y1084 HydrophobicContact CD2-CD1 4.48Å; F990-Y1084 AromaticContact CD2-CD2 3.59Å; F990-Y1084 HydrophobicContact CD2-CD2 3.59Å; F990-Y1084 HydrophobicContact CD2-CE2 4.22Å; F990-Y1084 AromaticContact CD2-CG 3.74Å; F990-Y1084 HydrophobicContact CD2-CG 3.74Å; F990-Y1084 HydrophobicContact CG-CD2 4.28Å; F990-Y1084 HydrophobicContact CG-CG 4.28Å; F990-Y1084 PolarHBondContact N-OH 3.27Å; F990-M1087 HydrophobicContact CD1-CG 4.45Å; F990-M1087 HydrophobicContact CD2-CG 4.38Å; F990-M1087 HydrophobicContact CE1-CG 3.83Å; F990-M1087 HydrophobicContact CE1-SD 4.45Å; F990-M1087 HydrophobicContact CE2-CB 4.23Å; F990-M1087 HydrophobicContact CE2-CG 3.77Å; F990-M1087 HydrophobicContact CZ-CB 4.41Å; F990-M1087 HydrophobicContact CZ-CG 3.47Å; F990-M1087 VanDerWaalsContact CZ-CG 3.47Å
991	V	86.6	Confident	84.4	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-44.7	178.9	171.7	0	0	0	0	110.7	V977 F983 A986 D987 Q988 D989 V994 V995	V977-V991 HydrophobicContact CB-CG1 4.44Å; V977-V991 HydrophobicContact CG1-CG1 3.75Å; V977-V991 HydrophobicContact CG2-CG1 3.74Å; F983-V991 HydrophobicContact CB-CG2 4.05Å; F983-V991 HydrophobicContact CD1-CG2 4.02Å; F983-V991 HydrophobicContact CG-CG2 4.32Å; A986-V991 HydrophobicContact CB-CG2 3.95Å; D987-V991 WeakPolarHBondContact O-CG2 3.43Å; D987-V991 PolarHBondContact O-N 2.69Å; Q988-V991 PolarHBondContact O-N 3.43Å; D989-V991 VanDerWaalsContact C-N 3.33Å; D989-V991 PolarHBondContact O-N 2.83Å; V991-V994 PolarHBondContact O-N 3.14Å; V991-V995 HydrophobicContact CG1-CG2 4.08Å; V991-V995 WeakPolarHBondContact O-CB 3.35Å; V991-V995 WeakPolarHBondContact O-CG2 3.18Å; V991-V995 PolarHBondContact O-N 2.95Å
992	S	84.6	Confident	85.3	Confident	12 Å²	12	53.2 Å²	53.2	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-39.5	178	-146.6	0	0	0	0	112.2	E966 N970 Q988 D989 F990 V995 T996	E966-S992 PolarHBondContact OE1-OG 3.4Å; N970-S992 PolarHBondContact ND2-OG 2.72Å; Q988-S992 PolarHBondContact O-N 3.08Å; D989-S992 PolarHBondContact O-N 3.35Å; F990-S992 PolarHBondContact O-N 2.86Å; S992-V995 PolarHBondContact O-N 3.32Å; S992-T996 WeakPolarHBondContact O-CB 3.4Å; S992-T996 WeakPolarHBondContact O-CG2 3.32Å; S992-T996 PolarHBondContact O-N 3.47Å; S992-T996 PolarHBondContact O-OG1 3.29Å
993	E	86.6	Confident	86.6	Confident	45 Å²	45	53.7 Å²	53.7	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-39.8	177	-153.8	-170.8	158.9	0	0	112.1	D989 F990 T996 K997 V1080 N1083 Y1084	D989-E993 PolarHBondContact O-N 2.88Å; F990-E993 PolarHBondContact O-N 3.35Å; E993-T996 PolarHBondContact O-OG1 3.43Å; E993-K997 WeakPolarHBondContact O-CG 3.36Å; E993-V1080 HydrophobicContact CB-CG1 4.46Å; E993-V1080 HydrophobicContact CB-CG2 4.32Å; E993-V1080 HydrophobicContact CG-CG2 3.9Å; E993-N1083 PolarHBondContact OE1-ND2 2.74Å; E993-N1083 PolarHBondContact OE2-ND2 2.98Å; E993-Y1084 WeakPolarHBondContact OE2-CE2 3.46Å
994	V	88.8	Confident	87.4	Confident	5 Å²	5	54 Å²	54	3%	0.03	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-51	172	174.8	0	0	0	0	111	F983 F990 V991 T996 K997 L998 L1072 V1080	F983-V994 HydrophobicContact CE1-CB 4.33Å; F983-V994 HydrophobicContact CE1-CG1 4.04Å; F983-V994 HydrophobicContact CE1-CG2 4.41Å; F983-V994 HydrophobicContact CZ-CG1 3.81Å; F990-V994 HydrophobicContact CD1-CG2 4.39Å; F990-V994 HydrophobicContact CD2-CG2 4.2Å; F990-V994 HydrophobicContact CE1-CG2 3.97Å; F990-V994 HydrophobicContact CE2-CG2 3.74Å; F990-V994 HydrophobicContact CZ-CG2 3.61Å; F990-V994 WeakPolarHBondContact O-CG2 3.38Å; F990-V994 PolarHBondContact O-N 3.26Å; V991-V994 PolarHBondContact O-N 3.14Å; V994-T996 VanDerWaalsContact C-N 3.31Å; V994-T996 PolarHBondContact O-N 3.49Å; V994-K997 WeakPolarHBondContact O-CB 3.1Å; V994-K997 PolarHBondContact O-N 3.23Å; V994-L998 HydrophobicContact CG1-CD2 4.16Å; V994-L998 HydrophobicContact CG1-CG 4.45Å; V994-L998 PolarHBondContact O-N 2.94Å; V994-L1072 HydrophobicContact CG1-CD2 4.14Å; V994-V1080 HydrophobicContact CG2-CG1 3.87Å
995	V	87.9	Confident	88.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-38.8	-172.9	163.1	0	0	0	0	112	I969 N970 C973 V977 V991 S992 K997 L998	I969-V995 HydrophobicContact CB-CG1 4.4Å; I969-V995 HydrophobicContact CG2-CG1 3.59Å; I969-V995 WeakPolarHBondContact CG2-O 3.16Å; N970-V995 WeakPolarHBondContact OD1-CG1 3.26Å; C973-V995 HydrophobicContact CB-CG1 3.73Å; C973-V995 HydrophobicContact CB-CG2 4.07Å; V977-V995 HydrophobicContact CG2-CG2 3.77Å; V991-V995 HydrophobicContact CG1-CG2 4.08Å; V991-V995 WeakPolarHBondContact O-CB 3.35Å; V991-V995 WeakPolarHBondContact O-CG2 3.18Å; V991-V995 PolarHBondContact O-N 2.95Å; S992-V995 PolarHBondContact O-N 3.32Å; V995-K997 PolarHBondContact O-N 3.29Å; V995-L998 HydrophobicContact CG2-CD1 4.36Å; V995-L998 PolarHBondContact O-N 3.2Å
996	T	86.3	Confident	89.3	Confident	63 Å²	63	45.6 Å²	45.6	39%	0.387	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.8	176.2	52.9	0	0	0	0	114.7	S992 E993 V994	S992-T996 WeakPolarHBondContact O-CB 3.4Å; S992-T996 WeakPolarHBondContact O-CG2 3.32Å; S992-T996 PolarHBondContact O-N 3.47Å; S992-T996 PolarHBondContact O-OG1 3.29Å; E993-T996 PolarHBondContact O-OG1 3.43Å; V994-T996 VanDerWaalsContact C-N 3.31Å; V994-T996 PolarHBondContact O-N 3.49Å
997	K	88.9	Confident	90.1	Very high	73 Å²	73	46.2 Å²	46.2	32%	0.317	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-13.2	177.7	-55.1	-79.9	-172.4	157.4	0	113.4	E993 V994 V995 L1072	E993-K997 WeakPolarHBondContact O-CG 3.36Å; V994-K997 WeakPolarHBondContact O-CB 3.1Å; V994-K997 PolarHBondContact O-N 3.23Å; V995-K997 PolarHBondContact O-N 3.29Å; K997-L1072 HydrophobicContact CB-CD1 3.65Å
998	L	91.2	Very high	90.7	Very high	20 Å²	20	46.2 Å²	46.2	11%	0.105	24%	0.244	C	C	.	.			trans	-65.9	142.7	-178.1	-66	-176.5	0	0	0	112.6	L976 V994 V995 F1021 Y1070 L1072	L976-L998 HydrophobicContact CD2-CD1 3.82Å; V994-L998 HydrophobicContact CG1-CD2 4.16Å; V994-L998 HydrophobicContact CG1-CG 4.45Å; V994-L998 PolarHBondContact O-N 2.94Å; V995-L998 HydrophobicContact CG2-CD1 4.36Å; V995-L998 PolarHBondContact O-N 3.2Å; L998-F1021 HydrophobicContact CD2-CD2 3.85Å; L998-F1021 HydrophobicContact CD2-CE2 3.83Å; L998-Y1070 HydrophobicContact CB-CD1 3.74Å; L998-Y1070 HydrophobicContact CB-CG 4.18Å; L998-Y1070 HydrophobicContact CD1-CD1 4.36Å; L998-Y1070 HydrophobicContact CD1-CG 4.12Å; L998-L1072 HydrophobicContact CD2-CB 3.99Å; L998-L1072 HydrophobicContact CD2-CD1 4.35Å
999	K	91.7	Very high	91.3	Very high	108 Å²	108	40.2 Å²	40.2	47%	0.47	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121	-178.9	-71	157.1	-170.6	164.8	0	110.7	E1001 Y1070 S1071 D1073	K999-E1001 PolarHBondContact O-N 3.46Å; K999-Y1070 WeakPolarHBondContact O-CA 3.49Å; K999-S1071 PolarHBondContact N-O 3.25Å; K999-S1071 PolarHBondContact O-N 3.48Å; K999-D1073 IonicContact NZ-OD1 2.88Å; K999-D1073 PolarHBondContact NZ-OD1 3.5Å
1000	F	92.3	Very high	91.8	Very high	55 Å²	55	35.6 Å²	35.6	24%	0.241	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.8	-175.4	-175.7	-96.8	0	0	0	112.7	V1002 N1068 Y1070	F1000-V1002 HydrophobicContact CD1-CG2 4.26Å; F1000-V1002 HydrophobicContact CE1-CG2 3.44Å; F1000-V1002 VanDerWaalsContact CE1-CG2 3.44Å; F1000-V1002 HydrophobicContact CZ-CG2 3.81Å; F1000-N1068 HydrophobicContact CE2-CB 3.93Å; F1000-N1068 HydrophobicContact CZ-CB 3.96Å; F1000-Y1070 HydrophobicContact CB-CD1 4.16Å; F1000-Y1070 HydrophobicContact CB-CE1 3.84Å; F1000-Y1070 HydrophobicContact CD2-CD1 4.45Å; F1000-Y1070 AromaticContact CD2-CE1 3.99Å; F1000-Y1070 HydrophobicContact CD2-CE1 3.99Å; F1000-Y1070 HydrophobicContact CD2-CE2 4.24Å; F1000-Y1070 AromaticContact CD2-CZ 3.86Å; F1000-Y1070 HydrophobicContact CG-CE1 4.41Å
1001	E	94.4	Very high	92.1	Very high	49 Å²	49	41.7 Å²	41.7	23%	0.229	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	155.5	178.9	-66.2	-176.7	-157.2	0	0	110.8	K999 F1003 K1018 L1069 S1071	K999-E1001 PolarHBondContact O-N 3.46Å; E1001-F1003 HydrophobicContact CB-CE2 3.92Å; E1001-F1003 WeakPolarHBondContact OE2-CZ 3.24Å; E1001-K1018 IonicContact OE1-NZ 3.4Å; E1001-K1018 PolarHBondContact OE1-NZ 3.08Å; E1001-K1018 IonicContact OE2-NZ 3.33Å; E1001-K1018 PolarHBondContact OE2-NZ 3.33Å; E1001-L1069 PolarHBondContact N-O 3Å; E1001-L1069 PolarHBondContact O-N 3.4Å; E1001-L1069 VanDerWaalsContact O-O 3.06Å; E1001-S1071 VanDerWaalsContact OE1-CB 3.26Å; E1001-S1071 WeakPolarHBondContact OE1-CB 3.49Å; E1001-S1071 PolarHBondContact OE1-OG 3.17Å
1002	V	95.8	Very high	92.3	Very high	9 Å²	9	43.6 Å²	43.6	6%	0.055	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	135.9	-177.7	176.2	0	0	0	0	109	Y941 R945 F1000 S1067 N1068	Y941-V1002 HydrophobicContact CE2-CB 4.4Å; Y941-V1002 WeakPolarHBondContact CE2-O 3.27Å; R945-V1002 VanDerWaalsContact CD-CG2 3.45Å; F1000-V1002 HydrophobicContact CD1-CG2 4.26Å; F1000-V1002 HydrophobicContact CE1-CG2 3.44Å; F1000-V1002 VanDerWaalsContact CE1-CG2 3.44Å; F1000-V1002 HydrophobicContact CZ-CG2 3.81Å; V1002-S1067 WeakPolarHBondContact CA-O 3.21Å; V1002-N1068 WeakPolarHBondContact CG2-OD1 3.35Å
1003	F	96.8	Very high	92.5	Very high	33 Å²	33	44.5 Å²	44.5	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147	178.3	-65.5	-93	0	0	0	111	E1001 D1007 I1009 Y1020 A1063 Y1066 S1067 L1069	E1001-F1003 HydrophobicContact CB-CE2 3.92Å; E1001-F1003 WeakPolarHBondContact OE2-CZ 3.24Å; F1003-D1007 HydrophobicContact CB-CB 4.36Å; F1003-D1007 HydrophobicContact CD1-CB 4.35Å; F1003-I1009 HydrophobicContact CB-CG1 4.16Å; F1003-I1009 HydrophobicContact CD1-CB 4.47Å; F1003-I1009 HydrophobicContact CD1-CG1 3.78Å; F1003-I1009 HydrophobicContact CD2-CG1 4.22Å; F1003-I1009 HydrophobicContact CD2-CG2 4.49Å; F1003-I1009 HydrophobicContact CE1-CB 4.43Å; F1003-I1009 HydrophobicContact CE1-CG1 4.22Å; F1003-I1009 HydrophobicContact CE1-CG2 4.16Å; F1003-I1009 HydrophobicContact CE2-CG2 4.15Å; F1003-I1009 HydrophobicContact CG-CD1 4.5Å; F1003-I1009 HydrophobicContact CG-CG1 3.77Å; F1003-I1009 HydrophobicContact CZ-CG2 3.96Å; F1003-Y1020 HydrophobicContact CE2-CE1 4.01Å; F1003-Y1020 HydrophobicContact CZ-CE1 4.03Å; F1003-A1063 HydrophobicContact CB-CB 4.33Å; F1003-Y1066 WeakPolarHBondContact O-CA 3.2Å; F1003-S1067 PolarHBondContact N-O 3.47Å; F1003-S1067 PolarHBondContact O-N 3.13Å; F1003-L1069 HydrophobicContact CD2-CD1 3.65Å; F1003-L1069 HydrophobicContact CD2-CG 4.18Å; F1003-L1069 HydrophobicContact CE2-CD1 3.81Å
1004	Q	96.5	Very high	92.8	Very high	12 Å²	12	45 Å²	45	6%	0.056	25%	0.245	C	C	.	.			trans	-87.2	155.4	178.9	-51.9	-167	-70.9	0	0	110.9	R937 G1006 D1007 A1063 Y1066	R937-Q1004 PolarHBondContact O-NE2 3.38Å; Q1004-G1006 PolarHBondContact O-N 3.1Å; Q1004-D1007 VanDerWaalsContact CB-OD2 3.27Å; Q1004-D1007 WeakPolarHBondContact CB-OD2 3.45Å; Q1004-D1007 PolarHBondContact N-OD2 3.09Å; Q1004-D1007 WeakPolarHBondContact O-CB 3.28Å; Q1004-D1007 PolarHBondContact O-N 2.83Å; Q1004-A1063 VanDerWaalsContact O-CB 3.3Å; Q1004-A1063 WeakPolarHBondContact O-CB 3.42Å; Q1004-Y1066 HydrophobicContact CB-CE1 4.23Å; Q1004-Y1066 HydrophobicContact CG-CE1 4.05Å
1005	P	96.2	Very high	92.9	Very high	61 Å²	61	50.5 Å²	50.5	40%	0.396	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	129.8	168.1	23.1	-35	0	0	0	111	V1064 Y1066	P1005-V1064 VanDerWaalsContact CB-O 3.27Å; P1005-V1064 WeakPolarHBondContact CB-O 3.35Å; P1005-Y1066 HydrophobicContact CG-CD2 4.26Å; P1005-Y1066 HydrophobicContact CG-CE2 4.06Å
1006	G	93.6	Very high	92.9	Very high	46 Å²	46	50.6 Å²	50.6	47%	0.474	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-9.8	-175.6	0	0	0	0	0	115.8	Q1004 A1063	Q1004-G1006 PolarHBondContact O-N 3.1Å; G1006-A1063 PolarHBondContact N-O 3.34Å
1007	D	95.8	Very high	93.1	Very high	38 Å²	38	51 Å²	51	20%	0.203	27%	0.273	C	S	.	.			trans	-72.6	137	-180	-80.1	-32.2	0	0	0	113.1	R937 F1003 Q1004 I1009 K1062 A1063	R937-D1007 IonicContact CZ-OD1 3.11Å; R937-D1007 IonicContact NH1-OD1 3.99Å; R937-D1007 VanDerWaalsContact NH2-CG 3.34Å; R937-D1007 IonicContact NH2-OD1 3.22Å; R937-D1007 PolarHBondContact NH2-OD1 2.81Å; R937-D1007 IonicContact NH2-OD2 2.69Å; R937-D1007 PolarHBondContact NH2-OD2 2.67Å; F1003-D1007 HydrophobicContact CB-CB 4.36Å; F1003-D1007 HydrophobicContact CD1-CB 4.35Å; Q1004-D1007 VanDerWaalsContact CB-OD2 3.27Å; Q1004-D1007 WeakPolarHBondContact CB-OD2 3.45Å; Q1004-D1007 PolarHBondContact N-OD2 3.09Å; Q1004-D1007 WeakPolarHBondContact O-CB 3.28Å; Q1004-D1007 PolarHBondContact O-N 2.83Å; D1007-I1009 PolarHBondContact O-N 3.39Å; D1007-K1062 CarbonylContact O-C 3.59Å; D1007-K1062 WeakPolarHBondContact O-CA 3.32Å; D1007-A1063 PolarHBondContact O-N 2.83Å
1008	L	95.1	Very high	93.3	Very high	91 Å²	91	49.7 Å²	49.7	48%	0.476	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	95.1	176.5	-170.5	68.3	0	0	0	110.1	I1010 K1011 V1061 K1062	L1008-I1010 VanDerWaalsContact CD1-O 3.28Å; L1008-I1010 WeakPolarHBondContact CD1-O 3.43Å; L1008-I1010 WeakPolarHBondContact CG-O 3.32Å; L1008-K1011 HydrophobicContact CD2-CB 3.72Å; L1008-K1011 HydrophobicContact CD2-CD 4.38Å; L1008-K1011 HydrophobicContact CD2-CG 3.96Å; L1008-K1011 HydrophobicContact CG-CB 4.37Å; L1008-V1061 CarbonylContact C-O 3.53Å; L1008-K1062 HydrophobicContact CD1-CB 4.41Å
1009	I	95.8	Very high	93.4	Very high	12 Å²	12	48.8 Å²	48.8	6%	0.062	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-34.7	-176.3	-54.9	155.1	0	0	0	111.3	F1003 D1007 Y1020 V1027 F1046 V1061 A1063 L1069	F1003-I1009 HydrophobicContact CB-CG1 4.16Å; F1003-I1009 HydrophobicContact CD1-CB 4.47Å; F1003-I1009 HydrophobicContact CD1-CG1 3.78Å; F1003-I1009 HydrophobicContact CD2-CG1 4.22Å; F1003-I1009 HydrophobicContact CD2-CG2 4.49Å; F1003-I1009 HydrophobicContact CE1-CB 4.43Å; F1003-I1009 HydrophobicContact CE1-CG1 4.22Å; F1003-I1009 HydrophobicContact CE1-CG2 4.16Å; F1003-I1009 HydrophobicContact CE2-CG2 4.15Å; F1003-I1009 HydrophobicContact CG-CD1 4.5Å; F1003-I1009 HydrophobicContact CG-CG1 3.77Å; F1003-I1009 HydrophobicContact CZ-CG2 3.96Å; D1007-I1009 PolarHBondContact O-N 3.39Å; I1009-Y1020 HydrophobicContact CG2-CD1 4.45Å; I1009-Y1020 HydrophobicContact CG2-CD2 4.04Å; I1009-Y1020 HydrophobicContact CG2-CE1 4.05Å; I1009-Y1020 HydrophobicContact CG2-CE2 3.58Å; I1009-Y1020 HydrophobicContact CG2-CG 4.42Å; I1009-Y1020 PolarHBondContact O-OH 3.5Å; I1009-V1027 HydrophobicContact CD1-CB 4.24Å; I1009-V1027 HydrophobicContact CD1-CG1 3.54Å; I1009-F1046 HydrophobicContact CD1-CZ 4.21Å; I1009-F1046 HydrophobicContact CG2-CE2 3.91Å; I1009-F1046 HydrophobicContact CG2-CZ 3.95Å; I1009-V1061 HydrophobicContact CD1-CG1 4.45Å; I1009-V1061 PolarHBondContact N-O 3.39Å; I1009-A1063 HydrophobicContact CD1-CB 4Å; I1009-A1063 HydrophobicContact CG1-CB 4.48Å; I1009-L1069 HydrophobicContact CD1-CD1 4.08Å; I1009-L1069 HydrophobicContact CG2-CD1 4.11Å
1010	I	95.5	Very high	93.6	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.041	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.4	173.1	-65.3	-178.8	0	0	0	108.4	L1008 Y1020 F1046 R1057 S1060 V1061	L1008-I1010 VanDerWaalsContact CD1-O 3.28Å; L1008-I1010 WeakPolarHBondContact CD1-O 3.43Å; L1008-I1010 WeakPolarHBondContact CG-O 3.32Å; I1010-Y1020 HydrophobicContact CD1-CD2 4.25Å; I1010-Y1020 HydrophobicContact CD1-CE2 4.19Å; I1010-Y1020 HydrophobicContact CG1-CD2 4.47Å; I1010-Y1020 HydrophobicContact CG1-CE2 3.98Å; I1010-F1046 HydrophobicContact CD1-CD2 3.63Å; I1010-F1046 HydrophobicContact CD1-CE2 3.81Å; I1010-F1046 HydrophobicContact CG1-CD2 4.5Å; I1010-F1046 HydrophobicContact CG1-CE2 4.22Å; I1010-R1057 HydrophobicContact CG2-CB 3.94Å; I1010-R1057 HydrophobicContact CG2-CG 3.65Å; I1010-S1060 CarbonylContact O-C 3.45Å; I1010-S1060 WeakPolarHBondContact O-CA 3.15Å; I1010-V1061 HydrophobicContact CB-CB 4Å; I1010-V1061 HydrophobicContact CB-CG2 4.07Å; I1010-V1061 HydrophobicContact CD1-CG2 4.2Å; I1010-V1061 HydrophobicContact CG1-CB 4.46Å; I1010-V1061 HydrophobicContact CG1-CG2 4.49Å; I1010-V1061 PolarHBondContact N-O 2.97Å; I1010-V1061 VanDerWaalsContact N-O 3.15Å; I1010-V1061 PolarHBondContact O-N 3.4Å
1011	K	93.1	Very high	93.6	Very high	131 Å²	131	41.6 Å²	41.6	57%	0.57	23%	0.231	S	C	*	.			trans	-104.5	134.3	167.5	-174.9	-179.9	177.6	-178.5	0	109.8	L1008 T1014 R1057	L1008-K1011 HydrophobicContact CD2-CB 3.72Å; L1008-K1011 HydrophobicContact CD2-CD 4.38Å; L1008-K1011 HydrophobicContact CD2-CG 3.96Å; L1008-K1011 HydrophobicContact CG-CB 4.37Å; K1011-T1014 HydrophobicContact CB-CG2 3.86Å; K1011-T1014 HydrophobicContact CD-CG2 4.31Å; K1011-T1014 HydrophobicContact CG-CG2 4.21Å; K1011-T1014 PolarHBondContact O-OG1 2.87Å; K1011-R1057 WeakPolarHBondContact O-CB 3.41Å
1012	E	90.9	Very high	93.6	Very high	44 Å²	44	39.3 Å²	39.3	21%	0.206	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	152.2	172.9	-159	-170.3	140.3	0	0	112.2	T1014 K1032 R1057 S1060	E1012-T1014 PolarHBondContact O-N 3.41Å; E1012-K1032 WeakPolarHBondContact OE1-CE 3.44Å; E1012-K1032 WeakPolarHBondContact OE1-CG 3.44Å; E1012-K1032 VanDerWaalsContact OE2-CG 3.27Å; E1012-K1032 WeakPolarHBondContact OE2-CG 3.12Å; E1012-K1032 PolarHBondContact OE2-N 3.3Å; E1012-R1057 VanDerWaalsContact CG-O 3.25Å; E1012-R1057 WeakPolarHBondContact CG-O 3.47Å; E1012-S1060 PolarHBondContact N-OG 3.15Å
1013	G	89.1	Confident	93.4	Very high	32 Å²	32	41.6 Å²	41.6	33%	0.33	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	-11.9	177.3	0	0	0	0	0	115	R1056 R1057	G1013-R1056 VanDerWaalsContact O-CD 3.28Å; G1013-R1056 WeakPolarHBondContact O-CD 3.5Å; G1013-R1056 WeakPolarHBondContact O-CG 3.39Å; G1013-R1056 PolarHBondContact O-NH1 3.46Å; G1013-R1057 PolarHBondContact N-O 2.89Å
1014	T	92.2	Very high	93.2	Very high	56 Å²	56	45.1 Å²	45.1	34%	0.344	25%	0.247	S	C	.	.	S	Bend	trans	-75.6	168.2	174.5	66.8	0	0	0	0	112.3	K1011 E1012 R1056 R1057	K1011-T1014 HydrophobicContact CB-CG2 3.86Å; K1011-T1014 HydrophobicContact CD-CG2 4.31Å; K1011-T1014 HydrophobicContact CG-CG2 4.21Å; K1011-T1014 PolarHBondContact O-OG1 2.87Å; E1012-T1014 PolarHBondContact O-N 3.41Å; T1014-R1056 CarbonylContact O-C 3.45Å; T1014-R1056 WeakPolarHBondContact O-CA 3.47Å; T1014-R1057 WeakPolarHBondContact O-CG 3.23Å; T1014-R1057 PolarHBondContact O-N 2.91Å; T1014-R1057 WeakPolarHBondContact OG1-CG 3.11Å
1015	I	91	Very high	93	Very high	119 Å²	119	44.8 Å²	44.8	61%	0.61	25%	0.247	S	C	*	.			trans	-93.6	136.2	174.4	-58.5	173.9	0	0	0	108.5	R1056	I1015-R1056 HydrophobicContact CG1-CG 4.47Å
1016	G	88.1	Confident	93	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.021	25%	0.246	C	C	.	.			trans	-113.2	107	-170.2	0	0	0	0	0	114.6	T1050 L1051	G1016-T1050 WeakPolarHBondContact O-CG2 3.15Å; G1016-L1051 WeakPolarHBondContact O-CD2 3.47Å
1017	N	91.1	Very high	93.2	Very high	72 Å²	72	43.1 Å²	43.1	39%	0.385	22%	0.224	S	C	.	.	S	Bend	trans	-103	22	-177.3	-61.3	10.1	0	0	0	113.4	K116 R1074	K116-N1017 PolarHBondContact NZ-O 3.02Å; N1017-R1074 PolarHBondContact O-N 3.02Å
1018	K	93.9	Very high	93.2	Very high	46 Å²	46	42.7 Å²	42.7	20%	0.2	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	155.8	172.1	45.2	166.9	164.1	171.6	0	112.2	E1001 Y1020 R1057 L1072	E1001-K1018 IonicContact OE1-NZ 3.4Å; E1001-K1018 PolarHBondContact OE1-NZ 3.08Å; E1001-K1018 IonicContact OE2-NZ 3.33Å; E1001-K1018 PolarHBondContact OE2-NZ 3.33Å; K1018-Y1020 HydrophobicContact CD-CE1 3.88Å; K1018-Y1020 HydrophobicContact CD-CE2 4.38Å; K1018-Y1020 WeakPolarHBondContact CE-OH 3.44Å; K1018-Y1020 PolarHBondContact NZ-OH 3.32Å; K1018-Y1020 VanDerWaalsContact NZ-OH 3.09Å; K1018-R1057 PolarHBondContact O-NH2 3.24Å; K1018-L1072 CarbonylContact C-O 3.53Å; K1018-L1072 WeakPolarHBondContact CA-O 3.44Å; K1018-L1072 WeakPolarHBondContact CB-O 3.33Å
1019	M	92.8	Very high	93.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	171.8	161	65.7	171.7	-66.6	0	0	110.2	F1021 Y1045 E1048 L1051 S1071 L1072 F1077 M1091	M1019-F1021 HydrophobicContact CE-CD1 4.28Å; M1019-F1021 HydrophobicContact CE-CD2 4.22Å; M1019-F1021 HydrophobicContact CE-CE1 3.7Å; M1019-F1021 HydrophobicContact CE-CE2 3.63Å; M1019-F1021 HydrophobicContact CE-CZ 3.34Å; M1019-F1021 HydrophobicContact CG-CE2 4.28Å; M1019-F1021 HydrophobicContact SD-CE2 3.96Å; M1019-F1021 HydrophobicContact SD-CZ 3.86Å; M1019-Y1045 HydrophobicContact CE-CD2 3.77Å; M1019-Y1045 HydrophobicContact CE-CG 4.14Å; M1019-E1048 HydrophobicContact CE-CB 4.35Å; M1019-E1048 HydrophobicContact SD-CB 4.42Å; M1019-L1051 HydrophobicContact CB-CD1 3.69Å; M1019-L1051 HydrophobicContact CG-CD1 3.78Å; M1019-L1051 HydrophobicContact SD-CD1 4.32Å; M1019-S1071 WeakPolarHBondContact O-CA 3.24Å; M1019-L1072 HydrophobicContact CG-CB 4Å; M1019-L1072 PolarHBondContact N-O 3.09Å; M1019-L1072 PolarHBondContact O-N 2.83Å; M1019-L1072 HydrophobicContact SD-CD2 4.4Å; M1019-F1077 HydrophobicContact SD-CD2 3.8Å; M1019-F1077 HydrophobicContact SD-CE2 3.58Å; M1019-F1077 VanDerWaalsContact SD-CE2 3.58Å; M1019-F1077 HydrophobicContact SD-CZ 4.34Å; M1019-M1091 HydrophobicContact CE-CE 3.69Å; M1019-M1091 HydrophobicContact SD-CE 3.89Å
1020	Y	95	Very high	92.9	Very high	11 Å²	11	40.3 Å²	40.3	4%	0.043	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.9	179	-59	-89.9	0	0	0	111.7	F1003 I1009 I1010 K1018 Y1045 F1046 L1069 Y1070	F1003-Y1020 HydrophobicContact CE2-CE1 4.01Å; F1003-Y1020 HydrophobicContact CZ-CE1 4.03Å; I1009-Y1020 HydrophobicContact CG2-CD1 4.45Å; I1009-Y1020 HydrophobicContact CG2-CD2 4.04Å; I1009-Y1020 HydrophobicContact CG2-CE1 4.05Å; I1009-Y1020 HydrophobicContact CG2-CE2 3.58Å; I1009-Y1020 HydrophobicContact CG2-CG 4.42Å; I1009-Y1020 PolarHBondContact O-OH 3.5Å; I1010-Y1020 HydrophobicContact CD1-CD2 4.25Å; I1010-Y1020 HydrophobicContact CD1-CE2 4.19Å; I1010-Y1020 HydrophobicContact CG1-CD2 4.47Å; I1010-Y1020 HydrophobicContact CG1-CE2 3.98Å; K1018-Y1020 HydrophobicContact CD-CE1 3.88Å; K1018-Y1020 HydrophobicContact CD-CE2 4.38Å; K1018-Y1020 WeakPolarHBondContact CE-OH 3.44Å; K1018-Y1020 PolarHBondContact NZ-OH 3.32Å; K1018-Y1020 VanDerWaalsContact NZ-OH 3.09Å; Y1020-Y1045 CarbonylContact O-C 3.52Å; Y1020-Y1045 VanDerWaalsContact O-CA 3.26Å; Y1020-Y1045 WeakPolarHBondContact O-CA 3.46Å; Y1020-Y1045 WeakPolarHBondContact O-CB 3.46Å; Y1020-F1046 HydrophobicContact CD2-CD2 4.06Å; Y1020-F1046 AromaticContact CD2-CE2 3.41Å; Y1020-F1046 HydrophobicContact CD2-CE2 3.41Å; Y1020-F1046 VanDerWaalsContact CD2-CE2 3.41Å; Y1020-F1046 AromaticContact CD2-CZ 3.96Å; Y1020-F1046 HydrophobicContact CD2-CZ 3.96Å; Y1020-F1046 HydrophobicContact CE2-CE2 4.17Å; Y1020-F1046 AromaticContact CG-CE2 3.9Å; Y1020-F1046 HydrophobicContact CG-CE2 3.9Å; Y1020-F1046 AromaticContact CG-CZ 3.96Å; Y1020-F1046 HydrophobicContact CG-CZ 3.96Å; Y1020-F1046 PolarHBondContact N-O 3.42Å; Y1020-F1046 PolarHBondContact O-N 3Å; Y1020-L1069 HydrophobicContact CD1-CB 4.29Å; Y1020-L1069 HydrophobicContact CD1-CD1 3.99Å; Y1020-L1069 HydrophobicContact CG-CD1 4.3Å; Y1020-Y1070 CarbonylContact C-O 3.48Å; Y1020-Y1070 WeakPolarHBondContact CA-O 3.23Å
1021	F	93.1	Very high	92.3	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.1	168.5	-58	-96.3	0	0	0	109	L976 V980 F983 L998 M1019 Y1045 L1069 Y1070 L1072	L976-F1021 HydrophobicContact CD1-CB 3.93Å; L976-F1021 HydrophobicContact CD2-CB 3.87Å; L976-F1021 HydrophobicContact CD2-CG 4.38Å; L976-F1021 HydrophobicContact CG-CB 4.33Å; V980-F1021 HydrophobicContact CG1-CD1 4.5Å; V980-F1021 HydrophobicContact CG2-CD1 4.23Å; F983-F1021 HydrophobicContact CE2-CD1 4Å; F983-F1021 AromaticContact CE2-CE1 3.76Å; F983-F1021 HydrophobicContact CE2-CE1 3.76Å; F983-F1021 HydrophobicContact CE2-CZ 4.39Å; F983-F1021 HydrophobicContact CZ-CD1 4.19Å; F983-F1021 AromaticContact CZ-CE1 3.5Å; F983-F1021 HydrophobicContact CZ-CE1 3.5Å; F983-F1021 AromaticContact CZ-CZ 3.76Å; F983-F1021 HydrophobicContact CZ-CZ 3.76Å; L998-F1021 HydrophobicContact CD2-CD2 3.85Å; L998-F1021 HydrophobicContact CD2-CE2 3.83Å; M1019-F1021 HydrophobicContact CE-CD1 4.28Å; M1019-F1021 HydrophobicContact CE-CD2 4.22Å; M1019-F1021 HydrophobicContact CE-CE1 3.7Å; M1019-F1021 HydrophobicContact CE-CE2 3.63Å; M1019-F1021 HydrophobicContact CE-CZ 3.34Å; M1019-F1021 HydrophobicContact CG-CE2 4.28Å; M1019-F1021 HydrophobicContact SD-CE2 3.96Å; M1019-F1021 HydrophobicContact SD-CZ 3.86Å; F1021-Y1045 HydrophobicContact CD1-CG 4.29Å; F1021-Y1045 HydrophobicContact CE1-CG 4.33Å; F1021-L1069 WeakPolarHBondContact O-CA 3.27Å; F1021-Y1070 PolarHBondContact N-O 3.29Å; F1021-Y1070 PolarHBondContact O-N 2.72Å; F1021-L1072 HydrophobicContact CE2-CB 4.09Å; F1021-L1072 HydrophobicContact CE2-CD2 4.12Å
1022	I	94	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	112.6	-178.8	-50.3	-176.1	0	0	0	109.4	L976 G1025 V1027 L1040 G1043 S1044 F1046 L1069	L976-I1022 VanDerWaalsContact CD1-O 3.23Å; L976-I1022 WeakPolarHBondContact CD1-O 3.35Å; I1022-G1025 WeakPolarHBondContact CG2-O 3.46Å; I1022-V1027 HydrophobicContact CD1-CG1 4.44Å; I1022-V1027 HydrophobicContact CD1-CG2 3.71Å; I1022-L1040 HydrophobicContact CD1-CB 3.82Å; I1022-G1043 PolarHBondContact O-N 3.41Å; I1022-S1044 PolarHBondContact N-O 3.41Å; I1022-F1046 HydrophobicContact CD1-CD1 4.14Å; I1022-F1046 HydrophobicContact CD1-CE1 3.99Å; I1022-F1046 HydrophobicContact CG1-CD1 4.13Å; I1022-F1046 HydrophobicContact CG1-CE1 3.82Å; I1022-L1069 HydrophobicContact CB-CD2 4.06Å; I1022-L1069 HydrophobicContact CG1-CD2 3.83Å; I1022-L1069 HydrophobicContact CG2-CD2 4.02Å
1023	Q	91.3	Very high	91.1	Very high	58 Å²	58	47.4 Å²	47.4	27%	0.271	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-46	170.9	-178.2	-177.4	-5.4	0	0	110.8	L976 N1068 Y1070	L976-Q1023 HydrophobicContact CD1-CB 4.24Å; Q1023-N1068 WeakPolarHBondContact CB-O 3.48Å; Q1023-N1068 PolarHBondContact N-O 2.91Å; Q1023-Y1070 HydrophobicContact CB-CD2 4.2Å; Q1023-Y1070 HydrophobicContact CB-CE2 4.09Å; Q1023-Y1070 HydrophobicContact CG-CE2 4.29Å; Q1023-Y1070 PolarHBondContact OE1-OH 3.13Å
1024	E	92.3	Very high	90.7	Very high	106 Å²	106	48.3 Å²	48.3	50%	0.495	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	125.4	-177	171.2	-172.6	-154.6	0	0	108	D1042 N1068	E1024-D1042 WeakPolarHBondContact CA-OD1 3.4Å; E1024-N1068 HydrophobicContact CB-CB 4.2Å; E1024-N1068 PolarHBondContact N-O 2.78Å; E1024-N1068 PolarHBondContact O-N 3Å; E1024-N1068 PolarHBondContact OE2-ND2 3.34Å
1025	G	93.3	Very high	90.3	Very high	6 Å²	6	52.1 Å²	52.1	6%	0.062	27%	0.271	C	S	.	.			trans	134.3	174.2	176.1	0	0	0	0	0	114.3	I1022 S1041 D1042	I1022-G1025 WeakPolarHBondContact CG2-O 3.46Å; G1025-S1041 WeakPolarHBondContact O-CA 3.35Å; G1025-D1042 PolarHBondContact N-OD1 2.93Å; G1025-D1042 PolarHBondContact O-N 2.73Å
1026	I	96.2	Very high	90.1	Very high	72 Å²	72	49.6 Å²	49.6	37%	0.369	26%	0.261	S	S	.	.			trans	-126.7	131.3	-178.9	-55.3	175	0	0	0	109	L1040 V1064 V1065	I1026-L1040 WeakPolarHBondContact CA-O 3.34Å; I1026-V1064 HydrophobicContact CB-CB 4.31Å; I1026-V1064 HydrophobicContact CG2-CB 4.28Å; I1026-V1064 HydrophobicContact CG2-CG2 4.07Å; I1026-V1064 WeakPolarHBondContact O-CB 3.21Å; I1026-V1064 PolarHBondContact O-N 2.89Å; I1026-V1065 HydrophobicContact CB-CG2 4.05Å; I1026-V1065 HydrophobicContact CG1-CG2 4.31Å
1027	V	96.7	Very high	89.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.2	178	-51.3	0	0	0	0	111.2	I1009 I1022 S1039 L1040 F1046 V1061 K1062	I1009-V1027 HydrophobicContact CD1-CB 4.24Å; I1009-V1027 HydrophobicContact CD1-CG1 3.54Å; I1022-V1027 HydrophobicContact CD1-CG1 4.44Å; I1022-V1027 HydrophobicContact CD1-CG2 3.71Å; V1027-S1039 CarbonylContact O-C 3.58Å; V1027-S1039 WeakPolarHBondContact O-CA 3.48Å; V1027-L1040 HydrophobicContact CG2-CB 3.95Å; V1027-L1040 PolarHBondContact N-O 2.73Å; V1027-L1040 PolarHBondContact O-N 3.04Å; V1027-F1046 HydrophobicContact CG1-CE1 4.48Å; V1027-F1046 HydrophobicContact CG2-CD1 4.1Å; V1027-F1046 HydrophobicContact CG2-CE1 3.79Å; V1027-F1046 HydrophobicContact CG2-CZ 4.38Å; V1027-V1061 HydrophobicContact CB-CG1 3.85Å; V1027-V1061 HydrophobicContact CG2-CG1 3.67Å; V1027-K1062 CarbonylContact C-O 3.55Å; V1027-K1062 WeakPolarHBondContact CA-O 3.47Å
1028	D	95.6	Very high	89.8	Confident	29 Å²	29	52.4 Å²	52.4	16%	0.155	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.5	176.6	-68.9	-25.6	0	0	0	110.7	I1030 V1036 S1039 V1061 K1062 V1064	D1028-I1030 HydrophobicContact CB-CG1 4.38Å; D1028-V1036 HydrophobicContact CB-CG1 3.89Å; D1028-V1036 HydrophobicContact CB-CG2 4.27Å; D1028-S1039 WeakPolarHBondContact OD1-CB 3.42Å; D1028-S1039 PolarHBondContact OD1-OG 3.24Å; D1028-V1061 CarbonylContact O-C 3.48Å; D1028-V1061 VanDerWaalsContact O-CA 3.32Å; D1028-V1061 WeakPolarHBondContact O-CA 3.37Å; D1028-K1062 PolarHBondContact N-O 3.08Å; D1028-K1062 PolarHBondContact O-N 3.48Å; D1028-V1064 HydrophobicContact CB-CG2 4.26Å; D1028-V1064 WeakPolarHBondContact OD1-CG2 3.2Å; D1028-V1064 VanDerWaalsContact OD2-CG2 3.23Å; D1028-V1064 WeakPolarHBondContact OD2-CG2 3.47Å
1029	I	93.3	Very high	89.8	Confident	23 Å²	23	53.2 Å²	53.2	12%	0.118	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.9	168	-54.9	-170.2	0	0	0	108.5	V1036 A1037 T1038 L1040 A1059 S1060 V1061	I1029-V1036 CarbonylContact O-C 3.56Å; I1029-V1036 WeakPolarHBondContact O-CA 3.43Å; I1029-A1037 PolarHBondContact O-N 3.07Å; I1029-T1038 HydrophobicContact CB-CG2 4.11Å; I1029-T1038 HydrophobicContact CD1-CG2 3.78Å; I1029-T1038 HydrophobicContact CG1-CG2 4.05Å; I1029-T1038 PolarHBondContact N-O 3.09Å; I1029-L1040 HydrophobicContact CD1-CD1 3.9Å; I1029-L1040 HydrophobicContact CD1-CG 4.14Å; I1029-L1040 HydrophobicContact CG1-CD1 4.49Å; I1029-L1040 HydrophobicContact CG1-CG 4.47Å; I1029-A1059 HydrophobicContact CG2-CB 3.64Å; I1029-S1060 WeakPolarHBondContact CA-O 3.47Å; I1029-V1061 HydrophobicContact CG1-CG2 4.37Å
1030	I	91.3	Very high	89.8	Confident	30 Å²	30	54.4 Å²	54.4	15%	0.154	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.2	-174.4	-59	170.4	0	0	0	109.3	D1028 E1035 V1036 S1060 K1062	D1028-I1030 HydrophobicContact CB-CG1 4.38Å; I1030-E1035 WeakPolarHBondContact CA-O 3.43Å; I1030-V1036 HydrophobicContact CG1-CG2 4.27Å; I1030-S1060 PolarHBondContact N-O 2.94Å; I1030-S1060 PolarHBondContact O-N 2.78Å; I1030-K1062 HydrophobicContact CD1-CB 3.81Å; I1030-K1062 HydrophobicContact CD1-CD 3.76Å; I1030-K1062 HydrophobicContact CD1-CG 4.46Å
1031	T	83.6	Confident	89.7	Confident	32 Å²	32	56.9 Å²	56.9	20%	0.196	32%	0.324	C	S	.	.			trans	-86.1	177.6	177.9	68.2	0	0	0	0	112.4	D1033 G1034 E1035 A1037	T1031-D1033 PolarHBondContact O-N 2.81Å; T1031-D1033 PolarHBondContact OG1-N 2.89Å; T1031-D1033 PolarHBondContact OG1-OD2 3.48Å; T1031-G1034 PolarHBondContact O-N 2.79Å; T1031-G1034 VanDerWaalsContact O-N 3.12Å; T1031-E1035 PolarHBondContact N-O 3.42Å; T1031-A1037 HydrophobicContact CG2-CB 3.76Å
1032	K	80.5	Confident	89.6	Confident	162 Å²	162	60.9 Å²	60.9	70%	0.704	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.7	173.9	-69.9	-179.4	178.3	177.1	0	113.5	E1012 G1034	E1012-K1032 WeakPolarHBondContact OE1-CE 3.44Å; E1012-K1032 WeakPolarHBondContact OE1-CG 3.44Å; E1012-K1032 VanDerWaalsContact OE2-CG 3.27Å; E1012-K1032 WeakPolarHBondContact OE2-CG 3.12Å; E1012-K1032 PolarHBondContact OE2-N 3.3Å; K1032-G1034 PolarHBondContact O-N 3.16Å
1033	D	79.2	Confident	89.3	Confident	137 Å²	137	61.2 Å²	61.2	73%	0.733	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.9	-173.9	-39.6	-72.5	0	0	0	112.1	T1031 E1035	T1031-D1033 PolarHBondContact O-N 2.81Å; T1031-D1033 PolarHBondContact OG1-N 2.89Å; T1031-D1033 PolarHBondContact OG1-OD2 3.48Å; D1033-E1035 VanDerWaalsContact C-N 3.27Å
1034	G	79.3	Confident	89.2	Confident	52 Å²	52	59.8 Å²	59.8	54%	0.536	35%	0.345	S	S	.	.	S	Bend	trans	87.2	-9.6	-175.8	0	0	0	0	0	114	T1031 K1032	T1031-G1034 PolarHBondContact O-N 2.79Å; T1031-G1034 VanDerWaalsContact O-N 3.12Å; K1032-G1034 PolarHBondContact O-N 3.16Å
1035	E	84	Confident	89.2	Confident	135 Å²	135	55.5 Å²	55.5	63%	0.631	32%	0.324	S	S	*	.			trans	-71.8	145.8	-179.6	-69.6	-59.8	157.1	0	0	113	I1030 T1031 D1033 A1037	I1030-E1035 WeakPolarHBondContact CA-O 3.43Å; T1031-E1035 PolarHBondContact N-O 3.42Å; D1033-E1035 VanDerWaalsContact C-N 3.27Å; E1035-A1037 PolarHBondContact O-N 3.18Å
1036	V	87.5	Confident	89.2	Confident	67 Å²	67	55.4 Å²	55.4	41%	0.406	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	102.8	174.6	179	0	0	0	0	108.8	D1028 I1029 I1030	D1028-V1036 HydrophobicContact CB-CG1 3.89Å; D1028-V1036 HydrophobicContact CB-CG2 4.27Å; I1029-V1036 CarbonylContact O-C 3.56Å; I1029-V1036 WeakPolarHBondContact O-CA 3.43Å; I1030-V1036 HydrophobicContact CG1-CG2 4.27Å
1037	A	84.1	Confident	89	Confident	62 Å²	62	52.6 Å²	52.6	51%	0.512	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-34.8	179.9	0	0	0	0	0	112.8	I1029 T1031 E1035	I1029-A1037 PolarHBondContact O-N 3.07Å; T1031-A1037 HydrophobicContact CG2-CB 3.76Å; E1035-A1037 PolarHBondContact O-N 3.18Å
1038	T	89.6	Confident	88.6	Confident	70 Å²	70	52.8 Å²	52.8	43%	0.429	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	153.3	176.1	-168.3	0	0	0	0	111.1	I1029	I1029-T1038 HydrophobicContact CB-CG2 4.11Å; I1029-T1038 HydrophobicContact CD1-CG2 3.78Å; I1029-T1038 HydrophobicContact CG1-CG2 4.05Å; I1029-T1038 PolarHBondContact N-O 3.09Å
1039	S	92.8	Very high	88.3	Confident	64 Å²	64	52 Å²	52	45%	0.448	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.6	170.7	-50.6	0	0	0	0	109.7	V1027 D1028	V1027-S1039 CarbonylContact O-C 3.58Å; V1027-S1039 WeakPolarHBondContact O-CA 3.48Å; D1028-S1039 WeakPolarHBondContact OD1-CB 3.42Å; D1028-S1039 PolarHBondContact OD1-OG 3.24Å
1040	L	92.9	Very high	88.1	Confident	24 Å²	24	51.1 Å²	51.1	13%	0.126	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.7	177.1	-63.8	-176.1	0	0	0	110.9	I1022 I1026 V1027 I1029 F1046	I1022-L1040 HydrophobicContact CD1-CB 3.82Å; I1026-L1040 WeakPolarHBondContact CA-O 3.34Å; V1027-L1040 HydrophobicContact CG2-CB 3.95Å; V1027-L1040 PolarHBondContact N-O 2.73Å; V1027-L1040 PolarHBondContact O-N 3.04Å; I1029-L1040 HydrophobicContact CD1-CD1 3.9Å; I1029-L1040 HydrophobicContact CD1-CG 4.14Å; I1029-L1040 HydrophobicContact CG1-CD1 4.49Å; I1029-L1040 HydrophobicContact CG1-CG 4.47Å; L1040-F1046 HydrophobicContact CD1-CB 3.91Å; L1040-F1046 HydrophobicContact CD1-CD1 4.22Å; L1040-F1046 HydrophobicContact CD1-CG 4.46Å
1041	S	92.7	Very high	87.9	Confident	64 Å²	64	49.8 Å²	49.8	45%	0.448	30%	0.297	S	S	.	.			trans	-112.3	177.3	177.1	63.1	0	0	0	0	112.7	G1025 S1044	G1025-S1041 WeakPolarHBondContact O-CA 3.35Å; S1041-S1044 WeakPolarHBondContact O-CB 3.39Å; S1041-S1044 PolarHBondContact O-N 3.38Å; S1041-S1044 PolarHBondContact O-OG 3Å
1042	D	91	Very high	88	Confident	86 Å²	86	49.3 Å²	49.3	46%	0.46	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-25.6	130.9	163.4	-58.2	22.6	0	0	0	113.7	E1024 G1025 S1044	E1024-D1042 WeakPolarHBondContact CA-OD1 3.4Å; G1025-D1042 PolarHBondContact N-OD1 2.93Å; G1025-D1042 PolarHBondContact O-N 2.73Å; D1042-S1044 PolarHBondContact O-N 2.84Å
1043	G	87.1	Confident	88.1	Confident	7 Å²	7	42.6 Å²	42.6	7%	0.072	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-10.7	-176.4	0	0	0	0	0	115	V980 I1022	V980-G1043 WeakPolarHBondContact CA-O 3.43Å; V980-G1043 VanDerWaalsContact CG2-O 3.27Å; V980-G1043 WeakPolarHBondContact CG2-O 3.3Å; I1022-G1043 PolarHBondContact O-N 3.41Å
1044	S	91.1	Very high	88.2	Confident	28 Å²	28	41.5 Å²	41.5	20%	0.196	26%	0.26	C	S	.	.			trans	-79.1	162.3	170.6	-53.7	0	0	0	0	112	I1022 S1041 D1042	I1022-S1044 PolarHBondContact N-O 3.41Å; S1041-S1044 WeakPolarHBondContact O-CB 3.39Å; S1041-S1044 PolarHBondContact O-N 3.38Å; S1041-S1044 PolarHBondContact O-OG 3Å; D1042-S1044 PolarHBondContact O-N 2.84Å
1045	Y	91.9	Very high	88.4	Confident	15 Å²	15	41.5 Å²	41.5	6%	0.059	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.9	170.7	65.2	-95.5	0	0	0	110.7	V980 F982 M1019 Y1020 F1021 E1048 M1091 R1098	V980-Y1045 HydrophobicContact CG1-CD1 4.08Å; V980-Y1045 HydrophobicContact CG1-CE1 4.45Å; F982-Y1045 HydrophobicContact CB-CE1 4.13Å; M1019-Y1045 HydrophobicContact CE-CD2 3.77Å; M1019-Y1045 HydrophobicContact CE-CG 4.14Å; Y1020-Y1045 CarbonylContact O-C 3.52Å; Y1020-Y1045 VanDerWaalsContact O-CA 3.26Å; Y1020-Y1045 WeakPolarHBondContact O-CA 3.46Å; Y1020-Y1045 WeakPolarHBondContact O-CB 3.46Å; F1021-Y1045 HydrophobicContact CD1-CG 4.29Å; F1021-Y1045 HydrophobicContact CE1-CG 4.33Å; Y1045-E1048 HydrophobicContact CD2-CG 4.42Å; Y1045-E1048 HydrophobicContact CE2-CG 4.01Å; Y1045-M1091 HydrophobicContact CD2-CE 4.11Å; Y1045-M1091 HydrophobicContact CE2-CE 3.7Å; Y1045-R1098 PolarHBondContact O-NH1 2.96Å; Y1045-R1098 PolarHBondContact O-NH2 2.84Å; Y1045-R1098 VanDerWaalsContact O-NH2 3.1Å
1046	F	92.8	Very high	88.7	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	159.6	-176.5	63.1	-93.3	0	0	0	113.6	I1009 I1010 Y1020 I1022 V1027 L1040 E1048 V1061 L1069	I1009-F1046 HydrophobicContact CD1-CZ 4.21Å; I1009-F1046 HydrophobicContact CG2-CE2 3.91Å; I1009-F1046 HydrophobicContact CG2-CZ 3.95Å; I1010-F1046 HydrophobicContact CD1-CD2 3.63Å; I1010-F1046 HydrophobicContact CD1-CE2 3.81Å; I1010-F1046 HydrophobicContact CG1-CD2 4.5Å; I1010-F1046 HydrophobicContact CG1-CE2 4.22Å; Y1020-F1046 HydrophobicContact CD2-CD2 4.06Å; Y1020-F1046 AromaticContact CD2-CE2 3.41Å; Y1020-F1046 HydrophobicContact CD2-CE2 3.41Å; Y1020-F1046 VanDerWaalsContact CD2-CE2 3.41Å; Y1020-F1046 AromaticContact CD2-CZ 3.96Å; Y1020-F1046 HydrophobicContact CD2-CZ 3.96Å; Y1020-F1046 HydrophobicContact CE2-CE2 4.17Å; Y1020-F1046 AromaticContact CG-CE2 3.9Å; Y1020-F1046 HydrophobicContact CG-CE2 3.9Å; Y1020-F1046 AromaticContact CG-CZ 3.96Å; Y1020-F1046 HydrophobicContact CG-CZ 3.96Å; Y1020-F1046 PolarHBondContact N-O 3.42Å; Y1020-F1046 PolarHBondContact O-N 3Å; I1022-F1046 HydrophobicContact CD1-CD1 4.14Å; I1022-F1046 HydrophobicContact CD1-CE1 3.99Å; I1022-F1046 HydrophobicContact CG1-CD1 4.13Å; I1022-F1046 HydrophobicContact CG1-CE1 3.82Å; V1027-F1046 HydrophobicContact CG1-CE1 4.48Å; V1027-F1046 HydrophobicContact CG2-CD1 4.1Å; V1027-F1046 HydrophobicContact CG2-CE1 3.79Å; V1027-F1046 HydrophobicContact CG2-CZ 4.38Å; L1040-F1046 HydrophobicContact CD1-CB 3.91Å; L1040-F1046 HydrophobicContact CD1-CD1 4.22Å; L1040-F1046 HydrophobicContact CD1-CG 4.46Å; F1046-E1048 WeakPolarHBondContact CA-OE2 3.47Å; F1046-V1061 HydrophobicContact CD2-CB 4.31Å; F1046-V1061 HydrophobicContact CD2-CG1 4.01Å; F1046-V1061 HydrophobicContact CD2-CG2 4Å; F1046-V1061 HydrophobicContact CE1-CG1 4.43Å; F1046-V1061 HydrophobicContact CE2-CB 4.16Å; F1046-V1061 HydrophobicContact CE2-CG1 3.76Å; F1046-V1061 HydrophobicContact CE2-CG2 4.35Å; F1046-V1061 HydrophobicContact CG-CG1 4.45Å; F1046-V1061 HydrophobicContact CZ-CG1 3.98Å; F1046-L1069 HydrophobicContact CE1-CD1 4.36Å; F1046-L1069 HydrophobicContact CZ-CD1 3.89Å
1047	G	91.4	Very high	88.9	Confident	14 Å²	14	40.1 Å²	40.1	14%	0.144	23%	0.231	C	C	.	.			trans	86.3	10.3	177.7	0	0	0	0	0	114.7	R1057	G1047-R1057 PolarHBondContact O-NH1 3.03Å
1048	E	89.1	Confident	89.1	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.019	21%	0.214	C	C	.	.			trans	-68.5	-36.2	176.5	70.1	-66.9	158.9	0	0	113.6	M1019 Y1045 F1046 T1050 L1051 L1052 M1091 R1098	M1019-E1048 HydrophobicContact CE-CB 4.35Å; M1019-E1048 HydrophobicContact SD-CB 4.42Å; Y1045-E1048 HydrophobicContact CD2-CG 4.42Å; Y1045-E1048 HydrophobicContact CE2-CG 4.01Å; F1046-E1048 WeakPolarHBondContact CA-OE2 3.47Å; E1048-T1050 PolarHBondContact O-N 2.81Å; E1048-L1051 WeakPolarHBondContact O-CA 3.38Å; E1048-L1051 WeakPolarHBondContact O-CB 3.1Å; E1048-L1051 PolarHBondContact O-N 2.92Å; E1048-L1052 PolarHBondContact O-N 2.96Å; E1048-M1091 HydrophobicContact CB-CE 3.96Å; E1048-M1091 HydrophobicContact CG-CE 4.44Å; E1048-R1098 WeakPolarHBondContact OE1-CD 3.46Å; E1048-R1098 IonicContact OE1-CZ 3.89Å; E1048-R1098 IonicContact OE1-NE 3.14Å; E1048-R1098 IonicContact OE1-NH1 3.68Å; E1048-R1098 PolarHBondContact OE1-NH1 2.69Å; E1048-R1098 IonicContact OE2-NH1 3.26Å; E1048-R1098 PolarHBondContact OE2-NH1 2.89Å
1049	I	89	Confident	89.1	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-50.6	-56.6	-174.3	-59.9	175.7	0	0	0	110.7	L1051 L1052 T1053 T1058 A1095 R1098 L1099	I1049-L1051 PolarHBondContact O-N 2.83Å; I1049-L1051 VanDerWaalsContact O-N 3.13Å; I1049-L1052 PolarHBondContact O-N 3.48Å; I1049-T1053 HydrophobicContact CG2-CG2 3.71Å; I1049-T1053 WeakPolarHBondContact O-CG2 3.18Å; I1049-T1053 PolarHBondContact O-N 3.39Å; I1049-T1053 PolarHBondContact O-OG1 2.98Å; I1049-T1058 HydrophobicContact CG2-CG2 4.33Å; I1049-A1095 HydrophobicContact CG1-CB 4.07Å; I1049-R1098 HydrophobicContact CD1-CB 4.2Å; I1049-L1099 HydrophobicContact CD1-CD2 4.01Å; I1049-L1099 HydrophobicContact CD1-CG 4.29Å; I1049-L1099 HydrophobicContact CG2-CD2 3.95Å; I1049-L1099 HydrophobicContact CG2-CG 4.26Å
1050	T	88.6	Confident	89.1	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-56.5	-26.2	177.5	-66.8	0	0	0	0	114.8	G1016 E1048 N1054 T1055	G1016-T1050 WeakPolarHBondContact O-CG2 3.15Å; E1048-T1050 PolarHBondContact O-N 2.81Å; T1050-N1054 WeakPolarHBondContact O-CA 3.02Å; T1050-N1054 PolarHBondContact O-N 2.88Å; T1050-T1055 WeakPolarHBondContact CB-O 3.3Å; T1050-T1055 WeakPolarHBondContact CG2-O 3.36Å; T1050-T1055 PolarHBondContact OG1-O 3.23Å
1051	L	88.4	Confident	89.2	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-76.3	-32	176.3	-57.8	-174.4	0	0	0	112	G1016 M1019 E1048 I1049 R1074 F1077	G1016-L1051 WeakPolarHBondContact O-CD2 3.47Å; M1019-L1051 HydrophobicContact CB-CD1 3.69Å; M1019-L1051 HydrophobicContact CG-CD1 3.78Å; M1019-L1051 HydrophobicContact SD-CD1 4.32Å; E1048-L1051 WeakPolarHBondContact O-CA 3.38Å; E1048-L1051 WeakPolarHBondContact O-CB 3.1Å; E1048-L1051 PolarHBondContact O-N 2.92Å; I1049-L1051 PolarHBondContact O-N 2.83Å; I1049-L1051 VanDerWaalsContact O-N 3.13Å; L1051-R1074 HydrophobicContact CD2-CB 3.78Å; L1051-R1074 HydrophobicContact CD2-CG 4.04Å; L1051-F1077 HydrophobicContact CB-CD1 3.67Å; L1051-F1077 HydrophobicContact CB-CE1 3.52Å; L1051-F1077 HydrophobicContact CB-CZ 4.44Å; L1051-F1077 HydrophobicContact CD1-CB 4.19Å; L1051-F1077 HydrophobicContact CD1-CD1 3.55Å; L1051-F1077 HydrophobicContact CD1-CD2 4.31Å; L1051-F1077 HydrophobicContact CD1-CE1 3.86Å; L1051-F1077 HydrophobicContact CD1-CG 3.77Å; L1051-F1077 HydrophobicContact CD1-CZ 4.35Å; L1051-F1077 HydrophobicContact CG-CD1 4.25Å; L1051-F1077 HydrophobicContact CG-CE1 4.36Å
1052	L	85.1	Confident	89.4	Confident	22 Å²	22	33.4 Å²	33.4	12%	0.115	17%	0.174	C	C	.	.	H	α-helix	trans	-86.7	-48.1	180	-62.2	171	0	0	0	111.8	E1048 I1049 F1077 L1081 M1091 E1092 A1095	E1048-L1052 PolarHBondContact O-N 2.96Å; I1049-L1052 PolarHBondContact O-N 3.48Å; L1052-F1077 HydrophobicContact CD2-CE1 3.87Å; L1052-F1077 HydrophobicContact CD2-CZ 4.1Å; L1052-F1077 HydrophobicContact CG-CE1 4.25Å; L1052-F1077 HydrophobicContact CG-CZ 4.41Å; L1052-L1081 HydrophobicContact CD2-CD1 4.01Å; L1052-M1091 HydrophobicContact CD1-CB 4.33Å; L1052-M1091 HydrophobicContact CD1-CG 4.31Å; L1052-E1092 HydrophobicContact CD1-CG 4.21Å; L1052-E1092 HydrophobicContact CD2-CG 4.26Å; L1052-A1095 HydrophobicContact CD1-CB 3.92Å
1053	T	82.6	Confident	89.7	Confident	22 Å²	22	29.3 Å²	29.3	14%	0.135	15%	0.152	C	C	.	.	H	α-helix	trans	-79.4	-18.3	-175	62.1	0	0	0	0	114.1	I1049 T1055 I1108 V1109	I1049-T1053 HydrophobicContact CG2-CG2 3.71Å; I1049-T1053 WeakPolarHBondContact O-CG2 3.18Å; I1049-T1053 PolarHBondContact O-N 3.39Å; I1049-T1053 PolarHBondContact O-OG1 2.98Å; T1053-T1055 WeakPolarHBondContact CB-OG1 3.47Å; T1053-T1055 PolarHBondContact O-N 3.16Å; T1053-T1055 VanDerWaalsContact O-N 3.15Å; T1053-T1055 PolarHBondContact OG1-N 3.23Å; T1053-T1055 PolarHBondContact OG1-OG1 3.5Å; T1053-I1108 HydrophobicContact CG2-CG2 4.04Å; T1053-V1109 HydrophobicContact CG2-CB 4.34Å; T1053-V1109 HydrophobicContact CG2-CG2 3.62Å
1054	N	80.9	Confident	90.1	Very high	114 Å²	114	32 Å²	32	61%	0.61	17%	0.167	S	C	*	.			trans	59	11.9	-164.9	-156.9	32.4	0	0	0	114.7	T1050 R1074	T1050-N1054 WeakPolarHBondContact O-CA 3.02Å; T1050-N1054 PolarHBondContact O-N 2.88Å; N1054-R1074 VanDerWaalsContact OD1-CZ 3.27Å; N1054-R1074 PolarHBondContact OD1-NH1 3.06Å; N1054-R1074 PolarHBondContact OD1-NH2 3.26Å
1055	T	84.2	Confident	90.3	Very high	52 Å²	52	33.6 Å²	33.6	32%	0.319	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-90.8	158.5	-179.3	62.8	0	0	0	0	113	T1050 T1053 I1108	T1050-T1055 WeakPolarHBondContact CB-O 3.3Å; T1050-T1055 WeakPolarHBondContact CG2-O 3.36Å; T1050-T1055 PolarHBondContact OG1-O 3.23Å; T1053-T1055 WeakPolarHBondContact CB-OG1 3.47Å; T1053-T1055 PolarHBondContact O-N 3.16Å; T1053-T1055 VanDerWaalsContact O-N 3.15Å; T1053-T1055 PolarHBondContact OG1-N 3.23Å; T1053-T1055 PolarHBondContact OG1-OG1 3.5Å; T1055-I1108 HydrophobicContact CG2-CG2 3.95Å
1056	R	90	Very high	90.5	Very high	156 Å²	156	36.2 Å²	36.2	59%	0.589	19%	0.186	S	C	*	.	P	Polyproline II helix	trans	-55.8	155.8	174.6	-71.4	170.2	178.8	-91.4	3.7	111.7	G1013 T1014 I1015 T1058	G1013-R1056 VanDerWaalsContact O-CD 3.28Å; G1013-R1056 WeakPolarHBondContact O-CD 3.5Å; G1013-R1056 WeakPolarHBondContact O-CG 3.39Å; G1013-R1056 PolarHBondContact O-NH1 3.46Å; T1014-R1056 CarbonylContact O-C 3.45Å; T1014-R1056 WeakPolarHBondContact O-CA 3.47Å; I1015-R1056 HydrophobicContact CG1-CG 4.47Å; R1056-T1058 PolarHBondContact O-N 3.5Å
1057	R	91.2	Very high	90.6	Very high	16 Å²	16	36 Å²	36	6%	0.06	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-53.6	124.4	179.1	-67.1	-62.4	-158	-164.5	7.5	110.9	I1010 K1011 E1012 G1013 T1014 K1018 G1047	I1010-R1057 HydrophobicContact CG2-CB 3.94Å; I1010-R1057 HydrophobicContact CG2-CG 3.65Å; K1011-R1057 WeakPolarHBondContact O-CB 3.41Å; E1012-R1057 VanDerWaalsContact CG-O 3.25Å; E1012-R1057 WeakPolarHBondContact CG-O 3.47Å; G1013-R1057 PolarHBondContact N-O 2.89Å; T1014-R1057 WeakPolarHBondContact O-CG 3.23Å; T1014-R1057 PolarHBondContact O-N 2.91Å; T1014-R1057 WeakPolarHBondContact OG1-CG 3.11Å; K1018-R1057 PolarHBondContact O-NH2 3.24Å; G1047-R1057 PolarHBondContact O-NH1 3.03Å
1058	T	87.8	Confident	90.8	Very high	24 Å²	24	36.1 Å²	36.1	15%	0.147	18%	0.182	C	C	.	.	S	Bend	trans	-87.8	-15.3	-170.4	50.8	0	0	0	0	114.9	I1049 R1056 L1099 Q1104	I1049-T1058 HydrophobicContact CG2-CG2 4.33Å; R1056-T1058 PolarHBondContact O-N 3.5Å; T1058-L1099 HydrophobicContact CG2-CD2 3.99Å; T1058-Q1104 VanDerWaalsContact CG2-OE1 3.27Å; T1058-Q1104 PolarHBondContact O-NE2 2.71Å
1059	A	89.6	Confident	91.1	Very high	9 Å²	9	36 Å²	36	7%	0.074	18%	0.181	C	C	.	.	S	Bend	trans	-149.7	167	172	0	0	0	0	0	109.7	I1029	I1029-A1059 HydrophobicContact CG2-CB 3.64Å
1060	S	93.3	Very high	91.3	Very high	19 Å²	19	36.4 Å²	36.4	13%	0.133	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	151.6	169.4	-69.5	0	0	0	0	110.8	I1010 E1012 I1029 I1030	I1010-S1060 CarbonylContact O-C 3.45Å; I1010-S1060 WeakPolarHBondContact O-CA 3.15Å; E1012-S1060 PolarHBondContact N-OG 3.15Å; I1029-S1060 WeakPolarHBondContact CA-O 3.47Å; I1030-S1060 PolarHBondContact N-O 2.94Å; I1030-S1060 PolarHBondContact O-N 2.78Å
1061	V	95.7	Very high	91.6	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	124.6	176.4	-173.3	0	0	0	0	110.2	L1008 I1009 I1010 V1027 D1028 I1029 F1046	L1008-V1061 CarbonylContact C-O 3.53Å; I1009-V1061 HydrophobicContact CD1-CG1 4.45Å; I1009-V1061 PolarHBondContact N-O 3.39Å; I1010-V1061 HydrophobicContact CB-CB 4Å; I1010-V1061 HydrophobicContact CB-CG2 4.07Å; I1010-V1061 HydrophobicContact CD1-CG2 4.2Å; I1010-V1061 HydrophobicContact CG1-CB 4.46Å; I1010-V1061 HydrophobicContact CG1-CG2 4.49Å; I1010-V1061 PolarHBondContact N-O 2.97Å; I1010-V1061 VanDerWaalsContact N-O 3.15Å; I1010-V1061 PolarHBondContact O-N 3.4Å; V1027-V1061 HydrophobicContact CB-CG1 3.85Å; V1027-V1061 HydrophobicContact CG2-CG1 3.67Å; D1028-V1061 CarbonylContact O-C 3.48Å; D1028-V1061 VanDerWaalsContact O-CA 3.32Å; D1028-V1061 WeakPolarHBondContact O-CA 3.37Å; I1029-V1061 HydrophobicContact CG1-CG2 4.37Å; F1046-V1061 HydrophobicContact CD2-CB 4.31Å; F1046-V1061 HydrophobicContact CD2-CG1 4.01Å; F1046-V1061 HydrophobicContact CD2-CG2 4Å; F1046-V1061 HydrophobicContact CE1-CG1 4.43Å; F1046-V1061 HydrophobicContact CE2-CB 4.16Å; F1046-V1061 HydrophobicContact CE2-CG1 3.76Å; F1046-V1061 HydrophobicContact CE2-CG2 4.35Å; F1046-V1061 HydrophobicContact CG-CG1 4.45Å; F1046-V1061 HydrophobicContact CZ-CG1 3.98Å
1062	K	96	Very high	91.9	Very high	85 Å²	85	36.4 Å²	36.4	37%	0.37	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134	-172	-180	-170.4	173.5	-166.3	0	111	D1007 L1008 V1027 D1028 I1030	D1007-K1062 CarbonylContact O-C 3.59Å; D1007-K1062 WeakPolarHBondContact O-CA 3.32Å; L1008-K1062 HydrophobicContact CD1-CB 4.41Å; V1027-K1062 CarbonylContact C-O 3.55Å; V1027-K1062 WeakPolarHBondContact CA-O 3.47Å; D1028-K1062 PolarHBondContact N-O 3.08Å; D1028-K1062 PolarHBondContact O-N 3.48Å; I1030-K1062 HydrophobicContact CD1-CB 3.81Å; I1030-K1062 HydrophobicContact CD1-CD 3.76Å; I1030-K1062 HydrophobicContact CD1-CG 4.46Å
1063	A	97.4	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	129.4	172.8	0	0	0	0	0	111.5	F1003 Q1004 G1006 D1007 I1009	F1003-A1063 HydrophobicContact CB-CB 4.33Å; Q1004-A1063 VanDerWaalsContact O-CB 3.3Å; Q1004-A1063 WeakPolarHBondContact O-CB 3.42Å; G1006-A1063 PolarHBondContact N-O 3.34Å; D1007-A1063 PolarHBondContact O-N 2.83Å; I1009-A1063 HydrophobicContact CD1-CB 4Å; I1009-A1063 HydrophobicContact CG1-CB 4.48Å
1064	V	95.8	Very high	92.7	Very high	63 Å²	63	37.3 Å²	37.3	38%	0.382	18%	0.183	S	C	.	.	S	Bend	trans	-87.8	-43.4	173.4	-173.5	0	0	0	0	110.3	P1005 I1026 D1028	P1005-V1064 VanDerWaalsContact CB-O 3.27Å; P1005-V1064 WeakPolarHBondContact CB-O 3.35Å; I1026-V1064 HydrophobicContact CB-CB 4.31Å; I1026-V1064 HydrophobicContact CG2-CB 4.28Å; I1026-V1064 HydrophobicContact CG2-CG2 4.07Å; I1026-V1064 WeakPolarHBondContact O-CB 3.21Å; I1026-V1064 PolarHBondContact O-N 2.89Å; D1028-V1064 HydrophobicContact CB-CG2 4.26Å; D1028-V1064 WeakPolarHBondContact OD1-CG2 3.2Å; D1028-V1064 VanDerWaalsContact OD2-CG2 3.23Å; D1028-V1064 WeakPolarHBondContact OD2-CG2 3.47Å
1065	V	95.8	Very high	93.2	Very high	62 Å²	62	34.2 Å²	34.2	38%	0.376	17%	0.165	S	C	.	.	S	Bend	trans	-120.4	176.3	177.3	-65	0	0	0	0	110.1	I1026 S1067	I1026-V1065 HydrophobicContact CB-CG2 4.05Å; I1026-V1065 HydrophobicContact CG1-CG2 4.31Å; V1065-S1067 PolarHBondContact O-N 3.31Å; V1065-S1067 VanDerWaalsContact O-N 3.17Å; V1065-S1067 PolarHBondContact O-OG 3.44Å
1066	Y	95.9	Very high	93.6	Very high	70 Å²	70	32.5 Å²	32.5	28%	0.275	15%	0.154	S	C	.	.			trans	-55.5	124.4	166.2	-78.6	-84.4	0	0	0	109.2	H944 F1003 Q1004 P1005	H944-Y1066 HydrophobicContact CB-CD1 4.19Å; H944-Y1066 HydrophobicContact CB-CE1 4.11Å; H944-Y1066 VanDerWaalsContact CE1-CB 3.46Å; H944-Y1066 WeakPolarHBondContact CE1-CB 3.39Å; H944-Y1066 AromaticContact CE1-CD1 3.93Å; H944-Y1066 AromaticContact CE1-CG 3.65Å; H944-Y1066 AromaticContact CG-CD1 3.69Å; H944-Y1066 AromaticContact ND1-CD1 3.57Å; H944-Y1066 AromaticContact ND1-CG 3.61Å; F1003-Y1066 WeakPolarHBondContact O-CA 3.2Å; Q1004-Y1066 HydrophobicContact CB-CE1 4.23Å; Q1004-Y1066 HydrophobicContact CG-CE1 4.05Å; P1005-Y1066 HydrophobicContact CG-CD2 4.26Å; P1005-Y1066 HydrophobicContact CG-CE2 4.06Å
1067	S	95.7	Very high	93.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.8	-170.1	-60.3	0	0	0	0	109.9	V1002 F1003 V1065	V1002-S1067 WeakPolarHBondContact CA-O 3.21Å; F1003-S1067 PolarHBondContact N-O 3.47Å; F1003-S1067 PolarHBondContact O-N 3.13Å; V1065-S1067 PolarHBondContact O-N 3.31Å; V1065-S1067 VanDerWaalsContact O-N 3.17Å; V1065-S1067 PolarHBondContact O-OG 3.44Å
1068	N	94.8	Very high	93.6	Very high	16 Å²	16	25.9 Å²	25.9	9%	0.086	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	108.5	177.2	-70.2	-35.1	0	0	0	108.2	F1000 V1002 Q1023 E1024	F1000-N1068 HydrophobicContact CE2-CB 3.93Å; F1000-N1068 HydrophobicContact CZ-CB 3.96Å; V1002-N1068 WeakPolarHBondContact CG2-OD1 3.35Å; Q1023-N1068 WeakPolarHBondContact CB-O 3.48Å; Q1023-N1068 PolarHBondContact N-O 2.91Å; E1024-N1068 HydrophobicContact CB-CB 4.2Å; E1024-N1068 PolarHBondContact N-O 2.78Å; E1024-N1068 PolarHBondContact O-N 3Å; E1024-N1068 PolarHBondContact OE2-ND2 3.34Å
1069	L	95	Very high	93.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.6	-169.6	-55.9	-174.3	0	0	0	111.2	E1001 F1003 I1009 Y1020 F1021 I1022 F1046	E1001-L1069 PolarHBondContact N-O 3Å; E1001-L1069 PolarHBondContact O-N 3.4Å; E1001-L1069 VanDerWaalsContact O-O 3.06Å; F1003-L1069 HydrophobicContact CD2-CD1 3.65Å; F1003-L1069 HydrophobicContact CD2-CG 4.18Å; F1003-L1069 HydrophobicContact CE2-CD1 3.81Å; I1009-L1069 HydrophobicContact CD1-CD1 4.08Å; I1009-L1069 HydrophobicContact CG2-CD1 4.11Å; Y1020-L1069 HydrophobicContact CD1-CB 4.29Å; Y1020-L1069 HydrophobicContact CD1-CD1 3.99Å; Y1020-L1069 HydrophobicContact CG-CD1 4.3Å; F1021-L1069 WeakPolarHBondContact O-CA 3.27Å; I1022-L1069 HydrophobicContact CB-CD2 4.06Å; I1022-L1069 HydrophobicContact CG1-CD2 3.83Å; I1022-L1069 HydrophobicContact CG2-CD2 4.02Å; F1046-L1069 HydrophobicContact CE1-CD1 4.36Å; F1046-L1069 HydrophobicContact CZ-CD1 3.89Å
1070	Y	94.1	Very high	93.8	Very high	21 Å²	21	26.7 Å²	26.7	8%	0.082	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121	162.5	-74.3	-81	0	0	0	109.8	L976 L998 K999 F1000 Y1020 F1021 Q1023	L976-Y1070 HydrophobicContact CD2-CD2 3.78Å; L976-Y1070 HydrophobicContact CD2-CE2 4.45Å; L976-Y1070 HydrophobicContact CD2-CG 4.35Å; L998-Y1070 HydrophobicContact CB-CD1 3.74Å; L998-Y1070 HydrophobicContact CB-CG 4.18Å; L998-Y1070 HydrophobicContact CD1-CD1 4.36Å; L998-Y1070 HydrophobicContact CD1-CG 4.12Å; K999-Y1070 WeakPolarHBondContact O-CA 3.49Å; F1000-Y1070 HydrophobicContact CB-CD1 4.16Å; F1000-Y1070 HydrophobicContact CB-CE1 3.84Å; F1000-Y1070 HydrophobicContact CD2-CD1 4.45Å; F1000-Y1070 AromaticContact CD2-CE1 3.99Å; F1000-Y1070 HydrophobicContact CD2-CE1 3.99Å; F1000-Y1070 HydrophobicContact CD2-CE2 4.24Å; F1000-Y1070 AromaticContact CD2-CZ 3.86Å; F1000-Y1070 HydrophobicContact CG-CE1 4.41Å; Y1020-Y1070 CarbonylContact C-O 3.48Å; Y1020-Y1070 WeakPolarHBondContact CA-O 3.23Å; F1021-Y1070 PolarHBondContact N-O 3.29Å; F1021-Y1070 PolarHBondContact O-N 2.72Å; Q1023-Y1070 HydrophobicContact CB-CD2 4.2Å; Q1023-Y1070 HydrophobicContact CB-CE2 4.09Å; Q1023-Y1070 HydrophobicContact CG-CE2 4.29Å; Q1023-Y1070 PolarHBondContact OE1-OH 3.13Å
1071	S	95	Very high	93.5	Very high	3 Å²	3	26 Å²	26	2%	0.021	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	143.3	171.1	78.3	0	0	0	0	111.3	K999 E1001 M1019	K999-S1071 PolarHBondContact N-O 3.25Å; K999-S1071 PolarHBondContact O-N 3.48Å; E1001-S1071 VanDerWaalsContact OE1-CB 3.26Å; E1001-S1071 WeakPolarHBondContact OE1-CB 3.49Å; E1001-S1071 PolarHBondContact OE1-OG 3.17Å; M1019-S1071 WeakPolarHBondContact O-CA 3.24Å
1072	L	93.7	Very high	93.2	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.7	172.7	-178	63.1	0	0	0	108.4	V994 K997 L998 K1018 M1019 F1021 F1077	V994-L1072 HydrophobicContact CG1-CD2 4.14Å; K997-L1072 HydrophobicContact CB-CD1 3.65Å; L998-L1072 HydrophobicContact CD2-CB 3.99Å; L998-L1072 HydrophobicContact CD2-CD1 4.35Å; K1018-L1072 CarbonylContact C-O 3.53Å; K1018-L1072 WeakPolarHBondContact CA-O 3.44Å; K1018-L1072 WeakPolarHBondContact CB-O 3.33Å; M1019-L1072 HydrophobicContact CG-CB 4Å; M1019-L1072 PolarHBondContact N-O 3.09Å; M1019-L1072 PolarHBondContact O-N 2.83Å; M1019-L1072 HydrophobicContact SD-CD2 4.4Å; F1021-L1072 HydrophobicContact CE2-CB 4.09Å; F1021-L1072 HydrophobicContact CE2-CD2 4.12Å; L1072-F1077 HydrophobicContact CD2-CB 4.07Å; L1072-F1077 HydrophobicContact CD2-CD2 3.83Å; L1072-F1077 HydrophobicContact CD2-CG 4.45Å; L1072-F1077 HydrophobicContact CG-CB 4.2Å
1073	D	93.6	Very high	92.8	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	154	178.5	53.1	-106.9	0	0	0	113.2	K116 K999 E1075 S1076 F1077	K116-D1073 HydrophobicContact CD-CB 4.36Å; K116-D1073 VanDerWaalsContact NZ-CB 3.27Å; K999-D1073 IonicContact NZ-OD1 2.88Å; K999-D1073 PolarHBondContact NZ-OD1 3.5Å; D1073-E1075 PolarHBondContact O-N 3.06Å; D1073-E1075 VanDerWaalsContact O-N 3.11Å; D1073-S1076 PolarHBondContact O-N 3.08Å; D1073-S1076 WeakPolarHBondContact OD2-CB 3.26Å; D1073-S1076 PolarHBondContact OD2-N 3.35Å; D1073-S1076 PolarHBondContact OD2-OG 3.05Å; D1073-F1077 WeakPolarHBondContact O-CB 3.2Å; D1073-F1077 PolarHBondContact O-N 3.09Å
1074	R	91.5	Very high	92.4	Very high	55 Å²	55	34 Å²	34	21%	0.208	17%	0.172	C	C	.	.	H	α-helix	trans	-54.1	-31.8	-178.7	-178.2	169.8	176.6	159.2	-3.8	113.3	N1017 L1051 N1054 L1078	N1017-R1074 PolarHBondContact O-N 3.02Å; L1051-R1074 HydrophobicContact CD2-CB 3.78Å; L1051-R1074 HydrophobicContact CD2-CG 4.04Å; N1054-R1074 VanDerWaalsContact OD1-CZ 3.27Å; N1054-R1074 PolarHBondContact OD1-NH1 3.06Å; N1054-R1074 PolarHBondContact OD1-NH2 3.26Å; R1074-L1078 HydrophobicContact CG-CD1 3.79Å; R1074-L1078 HydrophobicContact CG-CG 4.26Å; R1074-L1078 WeakPolarHBondContact O-CB 3.31Å; R1074-L1078 VanDerWaalsContact O-CG 3.27Å; R1074-L1078 WeakPolarHBondContact O-CG 3.34Å; R1074-L1078 PolarHBondContact O-N 3.41Å
1075	E	92.1	Very high	91.9	Very high	49 Å²	49	34.7 Å²	34.7	23%	0.229	18%	0.177	C	C	.	.	H	α-helix	trans	-76.9	-53	-168.8	-41	-174.9	-171.5	0	0	108.9	K116 H117 S118 D1073 F1077 S1079	K116-E1075 WeakPolarHBondContact CA-OE1 3.27Å; K116-E1075 WeakPolarHBondContact CB-OE1 3.39Å; H117-E1075 WeakPolarHBondContact CA-OE1 3.41Å; H117-E1075 PolarHBondContact N-OE1 3.37Å; H117-E1075 PolarHBondContact N-OE2 3.35Å; S118-E1075 PolarHBondContact N-OE1 3.39Å; S118-E1075 PolarHBondContact N-OE2 2.65Å; D1073-E1075 PolarHBondContact O-N 3.06Å; D1073-E1075 VanDerWaalsContact O-N 3.11Å; E1075-F1077 VanDerWaalsContact C-N 3.33Å; E1075-F1077 PolarHBondContact O-N 3.34Å; E1075-S1079 WeakPolarHBondContact O-CB 3.17Å; E1075-S1079 PolarHBondContact O-N 2.84Å
1076	S	92.1	Very high	91.4	Very high	15 Å²	15	38.1 Å²	38.1	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-40.2	170.1	-53.1	0	0	0	0	111.6	D1073 V1080	D1073-S1076 PolarHBondContact O-N 3.08Å; D1073-S1076 WeakPolarHBondContact OD2-CB 3.26Å; D1073-S1076 PolarHBondContact OD2-N 3.35Å; D1073-S1076 PolarHBondContact OD2-OG 3.05Å; S1076-V1080 VanDerWaalsContact O-CG2 3.24Å; S1076-V1080 WeakPolarHBondContact O-CG2 3.42Å; S1076-V1080 PolarHBondContact O-N 2.94Å
1077	F	90.4	Very high	90.8	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-51	178.5	179	-108.1	0	0	0	112.7	M1019 L1051 L1052 L1072 D1073 E1075 V1080 L1081 M1091	M1019-F1077 HydrophobicContact SD-CD2 3.8Å; M1019-F1077 HydrophobicContact SD-CE2 3.58Å; M1019-F1077 VanDerWaalsContact SD-CE2 3.58Å; M1019-F1077 HydrophobicContact SD-CZ 4.34Å; L1051-F1077 HydrophobicContact CB-CD1 3.67Å; L1051-F1077 HydrophobicContact CB-CE1 3.52Å; L1051-F1077 HydrophobicContact CB-CZ 4.44Å; L1051-F1077 HydrophobicContact CD1-CB 4.19Å; L1051-F1077 HydrophobicContact CD1-CD1 3.55Å; L1051-F1077 HydrophobicContact CD1-CD2 4.31Å; L1051-F1077 HydrophobicContact CD1-CE1 3.86Å; L1051-F1077 HydrophobicContact CD1-CG 3.77Å; L1051-F1077 HydrophobicContact CD1-CZ 4.35Å; L1051-F1077 HydrophobicContact CG-CD1 4.25Å; L1051-F1077 HydrophobicContact CG-CE1 4.36Å; L1052-F1077 HydrophobicContact CD2-CE1 3.87Å; L1052-F1077 HydrophobicContact CD2-CZ 4.1Å; L1052-F1077 HydrophobicContact CG-CE1 4.25Å; L1052-F1077 HydrophobicContact CG-CZ 4.41Å; L1072-F1077 HydrophobicContact CD2-CB 4.07Å; L1072-F1077 HydrophobicContact CD2-CD2 3.83Å; L1072-F1077 HydrophobicContact CD2-CG 4.45Å; L1072-F1077 HydrophobicContact CG-CB 4.2Å; D1073-F1077 WeakPolarHBondContact O-CB 3.2Å; D1073-F1077 PolarHBondContact O-N 3.09Å; E1075-F1077 VanDerWaalsContact C-N 3.33Å; E1075-F1077 PolarHBondContact O-N 3.34Å; F1077-V1080 PolarHBondContact O-N 2.88Å; F1077-L1081 HydrophobicContact CD1-CD1 4.16Å; F1077-L1081 HydrophobicContact CD2-CD1 4.36Å; F1077-L1081 HydrophobicContact CE1-CD1 3.58Å; F1077-L1081 HydrophobicContact CE2-CD1 3.82Å; F1077-L1081 HydrophobicContact CE2-CG 4.36Å; F1077-L1081 HydrophobicContact CZ-CD1 3.41Å; F1077-L1081 VanDerWaalsContact CZ-CD1 3.41Å; F1077-L1081 HydrophobicContact CZ-CG 4.4Å; F1077-L1081 WeakPolarHBondContact O-CB 3.39Å; F1077-L1081 WeakPolarHBondContact O-CG 3.39Å; F1077-L1081 PolarHBondContact O-N 2.92Å; F1077-M1091 HydrophobicContact CE2-CE 3.93Å; F1077-M1091 HydrophobicContact CE2-SD 3.47Å; F1077-M1091 WeakPolarHBondContact CE2-SD 3.41Å; F1077-M1091 HydrophobicContact CZ-CE 4.26Å; F1077-M1091 HydrophobicContact CZ-SD 3.55Å; F1077-M1091 VanDerWaalsContact CZ-SD 3.55Å
1078	L	90.2	Very high	90.4	Very high	26 Å²	26	40 Å²	40	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-42.1	178	-69.5	174.7	0	0	0	111.3	R1074 V1080 L1081 E1082	R1074-L1078 HydrophobicContact CG-CD1 3.79Å; R1074-L1078 HydrophobicContact CG-CG 4.26Å; R1074-L1078 WeakPolarHBondContact O-CB 3.31Å; R1074-L1078 VanDerWaalsContact O-CG 3.27Å; R1074-L1078 WeakPolarHBondContact O-CG 3.34Å; R1074-L1078 PolarHBondContact O-N 3.41Å; L1078-V1080 VanDerWaalsContact C-N 3.3Å; L1078-V1080 PolarHBondContact O-N 3.07Å; L1078-L1081 CarbonylContact O-C 3.55Å; L1078-L1081 PolarHBondContact O-N 3.41Å; L1078-L1081 VanDerWaalsContact O-N 3.12Å; L1078-E1082 WeakPolarHBondContact O-CB 3.47Å; L1078-E1082 WeakPolarHBondContact O-CG 3.15Å; L1078-E1082 PolarHBondContact O-N 2.93Å
1079	S	90.7	Very high	89.8	Confident	47 Å²	47	44.7 Å²	44.7	33%	0.329	22%	0.217	S	C	.	.	H	α-helix	trans	-55.8	-41	175.4	177.8	0	0	0	0	112.9	E1075	E1075-S1079 WeakPolarHBondContact O-CB 3.17Å; E1075-S1079 PolarHBondContact O-N 2.84Å
1080	V	90.2	Very high	89.3	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-75.5	-37.9	176.5	-178.8	0	0	0	0	111	F990 E993 V994 S1076 F1077 L1078 E1082 N1083 Y1084	F990-V1080 HydrophobicContact CD2-CG1 3.51Å; F990-V1080 HydrophobicContact CE2-CG1 3.56Å; E993-V1080 HydrophobicContact CB-CG1 4.46Å; E993-V1080 HydrophobicContact CB-CG2 4.32Å; E993-V1080 HydrophobicContact CG-CG2 3.9Å; V994-V1080 HydrophobicContact CG2-CG1 3.87Å; S1076-V1080 VanDerWaalsContact O-CG2 3.24Å; S1076-V1080 WeakPolarHBondContact O-CG2 3.42Å; S1076-V1080 PolarHBondContact O-N 2.94Å; F1077-V1080 PolarHBondContact O-N 2.88Å; L1078-V1080 VanDerWaalsContact C-N 3.3Å; L1078-V1080 PolarHBondContact O-N 3.07Å; V1080-E1082 VanDerWaalsContact C-N 3.3Å; V1080-E1082 PolarHBondContact O-N 3.18Å; V1080-N1083 WeakPolarHBondContact O-CB 3.41Å; V1080-N1083 PolarHBondContact O-N 2.9Å; V1080-N1083 VanDerWaalsContact O-N 3.16Å; V1080-Y1084 HydrophobicContact CG1-CD2 3.95Å; V1080-Y1084 HydrophobicContact CG1-CE2 4.32Å; V1080-Y1084 WeakPolarHBondContact O-CD2 3.2Å; V1080-Y1084 PolarHBondContact O-N 3.15Å
1081	L	88.2	Confident	88.8	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-71.4	-20.6	177.1	-71.2	-170.3	0	0	0	114.2	F990 L1052 F1077 L1078 M1087 R1088	F990-L1081 HydrophobicContact CE2-CD2 4.28Å; L1052-L1081 HydrophobicContact CD2-CD1 4.01Å; F1077-L1081 HydrophobicContact CD1-CD1 4.16Å; F1077-L1081 HydrophobicContact CD2-CD1 4.36Å; F1077-L1081 HydrophobicContact CE1-CD1 3.58Å; F1077-L1081 HydrophobicContact CE2-CD1 3.82Å; F1077-L1081 HydrophobicContact CE2-CG 4.36Å; F1077-L1081 HydrophobicContact CZ-CD1 3.41Å; F1077-L1081 VanDerWaalsContact CZ-CD1 3.41Å; F1077-L1081 HydrophobicContact CZ-CG 4.4Å; F1077-L1081 WeakPolarHBondContact O-CB 3.39Å; F1077-L1081 WeakPolarHBondContact O-CG 3.39Å; F1077-L1081 PolarHBondContact O-N 2.92Å; L1078-L1081 CarbonylContact O-C 3.55Å; L1078-L1081 PolarHBondContact O-N 3.41Å; L1078-L1081 VanDerWaalsContact O-N 3.12Å; L1081-M1087 HydrophobicContact CD2-CB 4.43Å; L1081-R1088 HydrophobicContact CB-CB 4.19Å; L1081-R1088 HydrophobicContact CB-CG 4.47Å; L1081-R1088 HydrophobicContact CD1-CB 4.29Å; L1081-R1088 HydrophobicContact CD1-CG 4.25Å; L1081-R1088 HydrophobicContact CD2-CB 4.13Å; L1081-R1088 HydrophobicContact CG-CB 4.44Å
1082	E	89.1	Confident	88.3	Confident	107 Å²	107	47.4 Å²	47.4	50%	0.5	24%	0.235	S	C	.	.	H	α-helix	trans	-67	-40.2	167.3	-76.3	170.1	-163.1	0	0	110.7	S120 L1078 V1080	S120-E1082 PolarHBondContact OG-OE1 3.04Å; S120-E1082 VanDerWaalsContact OG-OE1 3.06Å; L1078-E1082 WeakPolarHBondContact O-CB 3.47Å; L1078-E1082 WeakPolarHBondContact O-CG 3.15Å; L1078-E1082 PolarHBondContact O-N 2.93Å; V1080-E1082 VanDerWaalsContact C-N 3.3Å; V1080-E1082 PolarHBondContact O-N 3.18Å
1083	N	88.3	Confident	87.8	Confident	97 Å²	97	47.5 Å²	47.5	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-70.3	-37.4	175.1	-68.4	-19	0	0	0	113.1	E993 V1080 P1085	E993-N1083 PolarHBondContact OE1-ND2 2.74Å; E993-N1083 PolarHBondContact OE2-ND2 2.98Å; V1080-N1083 WeakPolarHBondContact O-CB 3.41Å; V1080-N1083 PolarHBondContact O-N 2.9Å; V1080-N1083 VanDerWaalsContact O-N 3.16Å; N1083-P1085 VanDerWaalsContact C-CD 3.44Å; N1083-P1085 WeakPolarHBondContact O-CD 3.27Å
1084	Y	88.5	Confident	87.3	Confident	58 Å²	58	48.5 Å²	48.5	23%	0.227	24%	0.242	C	C	.	.			trans	-119.1	69.7	-173	-60.1	-88.5	0	0	0	112.9	D989 F990 E993 V1080 L1086 M1087 R1088	D989-Y1084 WeakPolarHBondContact CB-OH 3.48Å; F990-Y1084 HydrophobicContact CB-CD1 3.9Å; F990-Y1084 HydrophobicContact CB-CD2 4Å; F990-Y1084 HydrophobicContact CB-CE1 3.84Å; F990-Y1084 HydrophobicContact CB-CE2 3.95Å; F990-Y1084 HydrophobicContact CB-CG 3.98Å; F990-Y1084 HydrophobicContact CD2-CD1 4.48Å; F990-Y1084 AromaticContact CD2-CD2 3.59Å; F990-Y1084 HydrophobicContact CD2-CD2 3.59Å; F990-Y1084 HydrophobicContact CD2-CE2 4.22Å; F990-Y1084 AromaticContact CD2-CG 3.74Å; F990-Y1084 HydrophobicContact CD2-CG 3.74Å; F990-Y1084 HydrophobicContact CG-CD2 4.28Å; F990-Y1084 HydrophobicContact CG-CG 4.28Å; F990-Y1084 PolarHBondContact N-OH 3.27Å; E993-Y1084 WeakPolarHBondContact OE2-CE2 3.46Å; V1080-Y1084 HydrophobicContact CG1-CD2 3.95Å; V1080-Y1084 HydrophobicContact CG1-CE2 4.32Å; V1080-Y1084 WeakPolarHBondContact O-CD2 3.2Å; V1080-Y1084 PolarHBondContact O-N 3.15Å; Y1084-L1086 VanDerWaalsContact C-N 3.26Å; Y1084-L1086 PolarHBondContact O-N 3.33Å; Y1084-L1086 VanDerWaalsContact O-N 3.16Å; Y1084-M1087 WeakPolarHBondContact O-CB 3.19Å; Y1084-M1087 PolarHBondContact O-N 2.97Å; Y1084-R1088 PolarHBondContact O-N 3.05Å
1085	P	85.7	Confident	87	Confident	76 Å²	76	45.9 Å²	45.9	49%	0.494	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-19.8	-172.1	26.4	-36.2	0	0	0	114.7	N1083 R1089	N1083-P1085 VanDerWaalsContact C-CD 3.44Å; N1083-P1085 WeakPolarHBondContact O-CD 3.27Å; P1085-R1089 PolarHBondContact O-N 2.91Å
1086	L	84.8	Confident	86.6	Confident	135 Å²	135	43.6 Å²	43.6	71%	0.707	22%	0.221	S	C	*	.	H	α-helix	trans	-64.9	-45.6	170	176.6	61.4	0	0	0	110.9	Y1084 R1088 R1089 T1090	Y1084-L1086 VanDerWaalsContact C-N 3.26Å; Y1084-L1086 PolarHBondContact O-N 3.33Å; Y1084-L1086 VanDerWaalsContact O-N 3.16Å; L1086-R1088 VanDerWaalsContact C-N 3.28Å; L1086-R1088 PolarHBondContact O-N 3.14Å; L1086-R1089 WeakPolarHBondContact O-CB 3.25Å; L1086-R1089 PolarHBondContact O-N 2.87Å; L1086-T1090 PolarHBondContact O-N 3Å; L1086-T1090 PolarHBondContact O-OG1 2.85Å
1087	M	83.9	Confident	86.1	Confident	23 Å²	23	45.7 Å²	45.7	11%	0.113	23%	0.229	C	C	.	.	H	α-helix	trans	-67.5	-33.1	-178.7	-164.2	56.7	63.2	0	0	111.6	F982 A986 F990 L1081 Y1084 T1090 M1091	F982-M1087 HydrophobicContact CD2-SD 3.78Å; F982-M1087 HydrophobicContact CE1-CG 4.31Å; F982-M1087 HydrophobicContact CE1-SD 4.3Å; F982-M1087 HydrophobicContact CE2-CG 3.7Å; F982-M1087 HydrophobicContact CE2-SD 3.31Å; F982-M1087 WeakPolarHBondContact CE2-SD 2.96Å; F982-M1087 HydrophobicContact CG-SD 4.45Å; F982-M1087 HydrophobicContact CZ-CG 3.48Å; F982-M1087 VanDerWaalsContact CZ-CG 3.48Å; F982-M1087 HydrophobicContact CZ-SD 3.62Å; A986-M1087 HydrophobicContact CB-CE 3.47Å; A986-M1087 VanDerWaalsContact CB-CE 3.47Å; F990-M1087 HydrophobicContact CD1-CG 4.45Å; F990-M1087 HydrophobicContact CD2-CG 4.38Å; F990-M1087 HydrophobicContact CE1-CG 3.83Å; F990-M1087 HydrophobicContact CE1-SD 4.45Å; F990-M1087 HydrophobicContact CE2-CB 4.23Å; F990-M1087 HydrophobicContact CE2-CG 3.77Å; F990-M1087 HydrophobicContact CZ-CB 4.41Å; F990-M1087 HydrophobicContact CZ-CG 3.47Å; F990-M1087 VanDerWaalsContact CZ-CG 3.47Å; L1081-M1087 HydrophobicContact CD2-CB 4.43Å; Y1084-M1087 WeakPolarHBondContact O-CB 3.19Å; Y1084-M1087 PolarHBondContact O-N 2.97Å; M1087-T1090 PolarHBondContact O-N 2.95Å; M1087-M1091 PolarHBondContact O-N 3.48Å
1088	R	86.1	Confident	85.8	Confident	85 Å²	85	48.1 Å²	48.1	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-56.7	-47.5	170.6	-179.6	173	172.4	144	8.5	112	L1081 Y1084 L1086 T1090 M1091 E1092	L1081-R1088 HydrophobicContact CB-CB 4.19Å; L1081-R1088 HydrophobicContact CB-CG 4.47Å; L1081-R1088 HydrophobicContact CD1-CB 4.29Å; L1081-R1088 HydrophobicContact CD1-CG 4.25Å; L1081-R1088 HydrophobicContact CD2-CB 4.13Å; L1081-R1088 HydrophobicContact CG-CB 4.44Å; Y1084-R1088 PolarHBondContact O-N 3.05Å; L1086-R1088 VanDerWaalsContact C-N 3.28Å; L1086-R1088 PolarHBondContact O-N 3.14Å; R1088-T1090 PolarHBondContact O-N 3.29Å; R1088-M1091 PolarHBondContact O-N 2.89Å; R1088-E1092 HydrophobicContact CG-CG 4.47Å; R1088-E1092 WeakPolarHBondContact CG-OE1 3.41Å; R1088-E1092 IonicContact CZ-OE1 3.88Å; R1088-E1092 IonicContact NE-OE1 3.09Å; R1088-E1092 PolarHBondContact NE-OE1 3.14Å; R1088-E1092 IonicContact NH2-OE1 3.53Å; R1088-E1092 PolarHBondContact NH2-OE1 3.29Å; R1088-E1092 VanDerWaalsContact NH2-OE1 3.13Å; R1088-E1092 WeakPolarHBondContact O-CG 3.46Å; R1088-E1092 PolarHBondContact O-N 3.44Å
1089	R	83.6	Confident	85.4	Confident	115 Å²	115	46.9 Å²	46.9	43%	0.434	23%	0.232	S	C	.	.	H	α-helix	trans	-60.5	-46	177.3	-63.4	-177.8	-165.6	-163.5	3.1	111.8	P1085 L1086 M1091 E1092 S1093	P1085-R1089 PolarHBondContact O-N 2.91Å; L1086-R1089 WeakPolarHBondContact O-CB 3.25Å; L1086-R1089 PolarHBondContact O-N 2.87Å; R1089-M1091 PolarHBondContact O-N 3.38Å; R1089-E1092 PolarHBondContact O-N 2.9Å; R1089-E1092 VanDerWaalsContact O-N 3.17Å; R1089-S1093 PolarHBondContact O-N 3.22Å; R1089-S1093 PolarHBondContact O-OG 3.49Å
1090	T	83.7	Confident	85	Confident	65 Å²	65	49.2 Å²	49.2	40%	0.399	24%	0.241	S	C	.	.	H	α-helix	trans	-55	-40.8	176	-52.6	0	0	0	0	111.7	F982 L1086 M1087 R1088 V1094	F982-T1090 HydrophobicContact CD2-CG2 4.46Å; L1086-T1090 PolarHBondContact O-N 3Å; L1086-T1090 PolarHBondContact O-OG1 2.85Å; M1087-T1090 PolarHBondContact O-N 2.95Å; R1088-T1090 PolarHBondContact O-N 3.29Å; T1090-V1094 WeakPolarHBondContact O-CG2 3.4Å; T1090-V1094 PolarHBondContact O-N 3.27Å; T1090-V1094 VanDerWaalsContact O-N 3.13Å
1091	M	83.2	Confident	84.4	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-76	-34	179.7	-145.7	163.2	-164.4	0	0	113.3	F982 M1019 Y1045 E1048 L1052 F1077 M1087 R1088 R1089 A1095	F982-M1091 HydrophobicContact CE1-CE 4.43Å; F982-M1091 HydrophobicContact CE1-SD 4.42Å; F982-M1091 HydrophobicContact CE2-CB 4.1Å; F982-M1091 HydrophobicContact CE2-CG 4.1Å; F982-M1091 HydrophobicContact CE2-SD 3.97Å; F982-M1091 HydrophobicContact CZ-CE 4.14Å; F982-M1091 HydrophobicContact CZ-CG 4.37Å; F982-M1091 HydrophobicContact CZ-SD 3.62Å; M1019-M1091 HydrophobicContact CE-CE 3.69Å; M1019-M1091 HydrophobicContact SD-CE 3.89Å; Y1045-M1091 HydrophobicContact CD2-CE 4.11Å; Y1045-M1091 HydrophobicContact CE2-CE 3.7Å; E1048-M1091 HydrophobicContact CB-CE 3.96Å; E1048-M1091 HydrophobicContact CG-CE 4.44Å; L1052-M1091 HydrophobicContact CD1-CB 4.33Å; L1052-M1091 HydrophobicContact CD1-CG 4.31Å; F1077-M1091 HydrophobicContact CE2-CE 3.93Å; F1077-M1091 HydrophobicContact CE2-SD 3.47Å; F1077-M1091 WeakPolarHBondContact CE2-SD 3.41Å; F1077-M1091 HydrophobicContact CZ-CE 4.26Å; F1077-M1091 HydrophobicContact CZ-SD 3.55Å; F1077-M1091 VanDerWaalsContact CZ-SD 3.55Å; M1087-M1091 PolarHBondContact O-N 3.48Å; R1088-M1091 PolarHBondContact O-N 2.89Å; R1089-M1091 PolarHBondContact O-N 3.38Å; M1091-A1095 VanDerWaalsContact O-CB 3.26Å; M1091-A1095 WeakPolarHBondContact O-CB 3.49Å; M1091-A1095 PolarHBondContact O-N 3.48Å
1092	E	84.8	Confident	83.8	Confident	16 Å²	16	58.7 Å²	58.7	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-44.8	170.3	-74	173.5	-176.1	0	0	111.1	L1052 R1088 R1089 A1095 A1096 V1109	L1052-E1092 HydrophobicContact CD1-CG 4.21Å; L1052-E1092 HydrophobicContact CD2-CG 4.26Å; R1088-E1092 HydrophobicContact CG-CG 4.47Å; R1088-E1092 WeakPolarHBondContact CG-OE1 3.41Å; R1088-E1092 IonicContact CZ-OE1 3.88Å; R1088-E1092 IonicContact NE-OE1 3.09Å; R1088-E1092 PolarHBondContact NE-OE1 3.14Å; R1088-E1092 IonicContact NH2-OE1 3.53Å; R1088-E1092 PolarHBondContact NH2-OE1 3.29Å; R1088-E1092 VanDerWaalsContact NH2-OE1 3.13Å; R1088-E1092 WeakPolarHBondContact O-CG 3.46Å; R1088-E1092 PolarHBondContact O-N 3.44Å; R1089-E1092 PolarHBondContact O-N 2.9Å; R1089-E1092 VanDerWaalsContact O-N 3.17Å; E1092-A1095 PolarHBondContact O-N 3Å; E1092-A1096 WeakPolarHBondContact O-CB 3.39Å; E1092-A1096 PolarHBondContact O-N 3.41Å; E1092-V1109 HydrophobicContact CB-CG1 3.82Å; E1092-V1109 HydrophobicContact CG-CG1 4.02Å; E1092-V1109 WeakPolarHBondContact O-CG1 3.5Å
1093	S	83.3	Confident	83	Confident	5 Å²	5	57.1 Å²	57.1	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-41.8	177.1	-59.7	0	0	0	0	113	R1089 A1096 E1097	R1089-S1093 PolarHBondContact O-N 3.22Å; R1089-S1093 PolarHBondContact O-OG 3.49Å; S1093-A1096 PolarHBondContact O-N 3.2Å; S1093-E1097 PolarHBondContact O-N 3.09Å
1094	V	83.6	Confident	82.1	Confident	30 Å²	30	54.9 Å²	54.9	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-38	175	173.6	0	0	0	0	111.7	T1090 E1097 R1098	T1090-V1094 WeakPolarHBondContact O-CG2 3.4Å; T1090-V1094 PolarHBondContact O-N 3.27Å; T1090-V1094 VanDerWaalsContact O-N 3.13Å; V1094-E1097 PolarHBondContact O-N 3.48Å; V1094-R1098 HydrophobicContact CG1-CG 4.44Å; V1094-R1098 WeakPolarHBondContact O-CB 3.47Å; V1094-R1098 VanDerWaalsContact O-CG 3.26Å; V1094-R1098 WeakPolarHBondContact O-CG 3.3Å; V1094-R1098 PolarHBondContact O-N 3.47Å
1095	A	84.9	Confident	81.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-39.1	174.6	0	0	0	0	0	112	I1049 L1052 M1091 E1092 R1098 L1099 V1109	I1049-A1095 HydrophobicContact CG1-CB 4.07Å; L1052-A1095 HydrophobicContact CD1-CB 3.92Å; M1091-A1095 VanDerWaalsContact O-CB 3.26Å; M1091-A1095 WeakPolarHBondContact O-CB 3.49Å; M1091-A1095 PolarHBondContact O-N 3.48Å; E1092-A1095 PolarHBondContact O-N 3Å; A1095-R1098 PolarHBondContact O-N 2.85Å; A1095-L1099 PolarHBondContact O-N 3.19Å; A1095-V1109 HydrophobicContact CB-CG1 4.17Å; A1095-V1109 HydrophobicContact CB-CG2 3.94Å
1096	A	82.8	Confident	80.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-41.4	174.8	0	0	0	0	0	112.3	E1092 S1093 R1098 L1099 N1100 P1106 V1109 L1115 L1119	E1092-A1096 WeakPolarHBondContact O-CB 3.39Å; E1092-A1096 PolarHBondContact O-N 3.41Å; S1093-A1096 PolarHBondContact O-N 3.2Å; A1096-R1098 VanDerWaalsContact C-N 3.34Å; A1096-R1098 PolarHBondContact O-N 3.41Å; A1096-L1099 PolarHBondContact O-N 3.07Å; A1096-N1100 WeakPolarHBondContact O-CB 3.09Å; A1096-N1100 PolarHBondContact O-N 2.84Å; A1096-N1100 VanDerWaalsContact O-N 3.12Å; A1096-P1106 HydrophobicContact CB-CB 4.13Å; A1096-V1109 HydrophobicContact CB-CB 4.36Å; A1096-L1115 HydrophobicContact CB-CD1 4.42Å; A1096-L1115 HydrophobicContact CB-CD2 4.03Å; A1096-L1119 HydrophobicContact CB-CD1 4.16Å
1097	E	83.1	Confident	79.3	Confident	59 Å²	59	52.1 Å²	52.1	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-61	-42.9	173.2	-164.3	-157.9	156.2	0	0	111.6	S1093 V1094 N1100 K1101	S1093-E1097 PolarHBondContact O-N 3.09Å; V1094-E1097 PolarHBondContact O-N 3.48Å; E1097-N1100 PolarHBondContact O-N 2.83Å; E1097-K1101 WeakPolarHBondContact O-CG 3.42Å; E1097-K1101 PolarHBondContact O-N 2.85Å; E1097-K1101 VanDerWaalsContact O-N 3.11Å; E1097-K1101 WeakPolarHBondContact OE1-CE 3.16Å; E1097-K1101 IonicContact OE1-NZ 3.13Å; E1097-K1101 PolarHBondContact OE1-NZ 2.72Å
1098	R	84.1	Confident	78.4	Confident	59 Å²	59	54.6 Å²	54.6	22%	0.223	29%	0.288	C	S	.	.	H	α-helix	trans	-66	-40.6	177.9	-74	171.3	172.5	-150.8	-5.7	112.7	Y1045 E1048 I1049 V1094 A1095 A1096 N1100 K1101 I1102	Y1045-R1098 PolarHBondContact O-NH1 2.96Å; Y1045-R1098 PolarHBondContact O-NH2 2.84Å; Y1045-R1098 VanDerWaalsContact O-NH2 3.1Å; E1048-R1098 WeakPolarHBondContact OE1-CD 3.46Å; E1048-R1098 IonicContact OE1-CZ 3.89Å; E1048-R1098 IonicContact OE1-NE 3.14Å; E1048-R1098 IonicContact OE1-NH1 3.68Å; E1048-R1098 PolarHBondContact OE1-NH1 2.69Å; E1048-R1098 IonicContact OE2-NH1 3.26Å; E1048-R1098 PolarHBondContact OE2-NH1 2.89Å; I1049-R1098 HydrophobicContact CD1-CB 4.2Å; V1094-R1098 HydrophobicContact CG1-CG 4.44Å; V1094-R1098 WeakPolarHBondContact O-CB 3.47Å; V1094-R1098 VanDerWaalsContact O-CG 3.26Å; V1094-R1098 WeakPolarHBondContact O-CG 3.3Å; V1094-R1098 PolarHBondContact O-N 3.47Å; A1095-R1098 PolarHBondContact O-N 2.85Å; A1096-R1098 VanDerWaalsContact C-N 3.34Å; A1096-R1098 PolarHBondContact O-N 3.41Å; R1098-N1100 VanDerWaalsContact C-N 3.35Å; R1098-K1101 PolarHBondContact O-N 2.88Å; R1098-I1102 WeakPolarHBondContact O-CD1 3.35Å; R1098-I1102 WeakPolarHBondContact O-CG1 3.35Å; R1098-I1102 PolarHBondContact O-N 3.3Å
1099	L	81.3	Confident	77.4	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-44.9	172.7	-78.3	-174	0	0	0	112	I1049 T1058 A1095 A1096 K1101 I1102 G1103 Q1104 I1108 V1109	I1049-L1099 HydrophobicContact CD1-CD2 4.01Å; I1049-L1099 HydrophobicContact CD1-CG 4.29Å; I1049-L1099 HydrophobicContact CG2-CD2 3.95Å; I1049-L1099 HydrophobicContact CG2-CG 4.26Å; T1058-L1099 HydrophobicContact CG2-CD2 3.99Å; A1095-L1099 PolarHBondContact O-N 3.19Å; A1096-L1099 PolarHBondContact O-N 3.07Å; L1099-K1101 VanDerWaalsContact C-N 3.32Å; L1099-K1101 PolarHBondContact O-N 3.5Å; L1099-I1102 CarbonylContact O-C 3.41Å; L1099-I1102 WeakPolarHBondContact O-CA 3.28Å; L1099-I1102 PolarHBondContact O-N 2.62Å; L1099-G1103 PolarHBondContact O-N 3.12Å; L1099-Q1104 CarbonylContact C-O 3.58Å; L1099-Q1104 HydrophobicContact CB-CB 4.35Å; L1099-Q1104 HydrophobicContact CD2-CB 4.03Å; L1099-Q1104 PolarHBondContact O-N 3.05Å; L1099-I1108 HydrophobicContact CD1-CB 3.98Å; L1099-I1108 HydrophobicContact CD1-CG2 4.39Å; L1099-V1109 HydrophobicContact CD1-CG2 3.63Å; L1099-V1109 HydrophobicContact CG-CG2 4.36Å
1100	N	81.6	Confident	76.4	Confident	95 Å²	95	46.8 Å²	46.8	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-60.4	-42.1	-179.9	-165.5	2.4	0	0	0	111.3	A1096 E1097 R1098 I1102 G1103	A1096-N1100 WeakPolarHBondContact O-CB 3.09Å; A1096-N1100 PolarHBondContact O-N 2.84Å; A1096-N1100 VanDerWaalsContact O-N 3.12Å; E1097-N1100 PolarHBondContact O-N 2.83Å; R1098-N1100 VanDerWaalsContact C-N 3.35Å; N1100-I1102 PolarHBondContact O-N 2.96Å; N1100-G1103 PolarHBondContact O-N 3.37Å
1101	K	78.8	Confident	75	Confident	152 Å²	152	50.7 Å²	50.7	66%	0.661	28%	0.282	S	S	*	.	H	α-helix	trans	-63.9	-21.9	173.4	-70.4	177	-174.7	172.6	0	114.4	E1097 R1098 L1099	E1097-K1101 WeakPolarHBondContact O-CG 3.42Å; E1097-K1101 PolarHBondContact O-N 2.85Å; E1097-K1101 VanDerWaalsContact O-N 3.11Å; E1097-K1101 WeakPolarHBondContact OE1-CE 3.16Å; E1097-K1101 IonicContact OE1-NZ 3.13Å; E1097-K1101 PolarHBondContact OE1-NZ 2.72Å; R1098-K1101 PolarHBondContact O-N 2.88Å; L1099-K1101 VanDerWaalsContact C-N 3.32Å; L1099-K1101 PolarHBondContact O-N 3.5Å
1102	I	75.1	Confident	73.9	Confident	54 Å²	54	54.6 Å²	54.6	28%	0.277	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7	177	-60.1	164.7	0	0	0	110.7	R1098 L1099 N1100 Q1104	R1098-I1102 WeakPolarHBondContact O-CD1 3.35Å; R1098-I1102 WeakPolarHBondContact O-CG1 3.35Å; R1098-I1102 PolarHBondContact O-N 3.3Å; L1099-I1102 CarbonylContact O-C 3.41Å; L1099-I1102 WeakPolarHBondContact O-CA 3.28Å; L1099-I1102 PolarHBondContact O-N 2.62Å; N1100-I1102 PolarHBondContact O-N 2.96Å; I1102-Q1104 VanDerWaalsContact C-N 3.3Å; I1102-Q1104 HydrophobicContact CG2-CG 4.4Å; I1102-Q1104 PolarHBondContact O-N 2.94Å
1103	G	71.4	Confident	72.4	Confident	73 Å²	73	62.5 Å²	62.5	75%	0.753	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	20.9	179.6	0	0	0	0	0	114.2	L1099 N1100	L1099-G1103 PolarHBondContact O-N 3.12Å; N1100-G1103 PolarHBondContact O-N 3.37Å
1104	Q	70.7	Confident	71.3	Confident	50 Å²	50	64.7 Å²	64.7	23%	0.234	34%	0.344	C	S	.	.	S	Bend	trans	-107.1	145.6	179.4	-64.5	-176.9	23.6	0	0	111	T1058 L1099 I1102 P1106	T1058-Q1104 VanDerWaalsContact CG2-OE1 3.27Å; T1058-Q1104 PolarHBondContact O-NE2 2.71Å; L1099-Q1104 CarbonylContact C-O 3.58Å; L1099-Q1104 HydrophobicContact CB-CB 4.35Å; L1099-Q1104 HydrophobicContact CD2-CB 4.03Å; L1099-Q1104 PolarHBondContact O-N 3.05Å; I1102-Q1104 VanDerWaalsContact C-N 3.3Å; I1102-Q1104 HydrophobicContact CG2-CG 4.4Å; I1102-Q1104 PolarHBondContact O-N 2.94Å; Q1104-P1106 WeakPolarHBondContact O-CD 3.4Å
1105	N	67.2	Low	70.2	Confident	114 Å²	114	64.1 Å²	64.1	61%	0.61	34%	0.34	S	S	*	.			trans	-58.7	118.2	-175.4	-75.9	-22.2	0	0	0	111.7	S1107 I1108	N1105-S1107 PolarHBondContact O-N 2.92Å; N1105-I1108 HydrophobicContact CB-CD1 4.13Å; N1105-I1108 HydrophobicContact CB-CG1 4.27Å; N1105-I1108 WeakPolarHBondContact O-CB 3.41Å; N1105-I1108 WeakPolarHBondContact O-CD1 3.38Å; N1105-I1108 VanDerWaalsContact O-CG1 3.26Å; N1105-I1108 WeakPolarHBondContact O-CG1 3.14Å; N1105-I1108 PolarHBondContact O-N 3.37Å
1106	P	68.8	Low	68.9	Low	40 Å²	40	72.5 Å²	72.5	26%	0.26	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-67.9	-21.3	-175.5	25.8	-34.2	0	0	0	113.5	A1096 Q1104 I1108 V1109	A1096-P1106 HydrophobicContact CB-CB 4.13Å; Q1104-P1106 WeakPolarHBondContact O-CD 3.4Å; P1106-I1108 PolarHBondContact O-N 2.99Å; P1106-I1108 VanDerWaalsContact O-N 3.11Å; P1106-V1109 PolarHBondContact O-N 3.15Å; P1106-V1109 VanDerWaalsContact O-N 3.12Å
1107	S	63.8	Low	67.8	Low	57 Å²	57	79 Å²	79	40%	0.399	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-59.9	-16.8	173.9	47.8	0	0	0	0	114.2	N1105 V1109 S1110 N1111	N1105-S1107 PolarHBondContact O-N 2.92Å; S1107-V1109 PolarHBondContact O-N 2.89Å; S1107-S1110 CarbonylContact O-C 3.19Å; S1107-S1110 PolarHBondContact O-N 3.22Å; S1107-N1111 PolarHBondContact O-OD1 3.25Å
1108	I	65.2	Low	66.9	Low	76 Å²	76	78.7 Å²	78.7	39%	0.39	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-62.4	-23.9	174.2	-63.3	169.9	0	0	0	111.9	T1053 T1055 L1099 N1105 P1106	T1053-I1108 HydrophobicContact CG2-CG2 4.04Å; T1055-I1108 HydrophobicContact CG2-CG2 3.95Å; L1099-I1108 HydrophobicContact CD1-CB 3.98Å; L1099-I1108 HydrophobicContact CD1-CG2 4.39Å; N1105-I1108 HydrophobicContact CB-CD1 4.13Å; N1105-I1108 HydrophobicContact CB-CG1 4.27Å; N1105-I1108 WeakPolarHBondContact O-CB 3.41Å; N1105-I1108 WeakPolarHBondContact O-CD1 3.38Å; N1105-I1108 VanDerWaalsContact O-CG1 3.26Å; N1105-I1108 WeakPolarHBondContact O-CG1 3.14Å; N1105-I1108 PolarHBondContact O-N 3.37Å; P1106-I1108 PolarHBondContact O-N 2.99Å; P1106-I1108 VanDerWaalsContact O-N 3.11Å
1109	V	63.8	Low	65.7	Low	15 Å²	15	78 Å²	78	9%	0.091	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-39	175.1	179.3	0	0	0	0	112.5	T1053 E1092 A1095 A1096 L1099 P1106 S1107	T1053-V1109 HydrophobicContact CG2-CB 4.34Å; T1053-V1109 HydrophobicContact CG2-CG2 3.62Å; E1092-V1109 HydrophobicContact CB-CG1 3.82Å; E1092-V1109 HydrophobicContact CG-CG1 4.02Å; E1092-V1109 WeakPolarHBondContact O-CG1 3.5Å; A1095-V1109 HydrophobicContact CB-CG1 4.17Å; A1095-V1109 HydrophobicContact CB-CG2 3.94Å; A1096-V1109 HydrophobicContact CB-CB 4.36Å; L1099-V1109 HydrophobicContact CD1-CG2 3.63Å; L1099-V1109 HydrophobicContact CG-CG2 4.36Å; P1106-V1109 PolarHBondContact O-N 3.15Å; P1106-V1109 VanDerWaalsContact O-N 3.12Å; S1107-V1109 PolarHBondContact O-N 2.89Å
1110	S	63	Low	64.7	Low	21 Å²	21	81.4 Å²	81.4	15%	0.147	43%	0.432	C	S	.	.			trans	-158.2	129.6	178.8	-136.1	0	0	0	0	111.2	S1107 R1112 L1115	S1107-S1110 CarbonylContact O-C 3.19Å; S1107-S1110 PolarHBondContact O-N 3.22Å; S1110-R1112 PolarHBondContact O-N 3.09Å; S1110-R1112 VanDerWaalsContact OG-CD 3.25Å; S1110-R1112 WeakPolarHBondContact OG-CD 3.39Å; S1110-R1112 WeakPolarHBondContact OG-CG 3.38Å; S1110-L1115 WeakPolarHBondContact O-CD2 3.49Å
1111	N	55.5	Low	63.9	Low	147 Å²	147	81 Å²	81	79%	0.786	43%	0.429	S	S	*	.			trans	-83	26.3	169.7	-73.7	-31.2	0	0	0	112.2	S1107	S1107-N1111 PolarHBondContact O-OD1 3.25Å
1112	R	60.1	Low	63	Low	83 Å²	83	76.1 Å²	76.1	31%	0.313	41%	0.412	S	S	.	.			trans	-81.1	128.2	-174.8	-81.8	-178.7	78.3	155.7	7.2	110.7	S1110 D1114 L1115	S1110-R1112 PolarHBondContact O-N 3.09Å; S1110-R1112 VanDerWaalsContact OG-CD 3.25Å; S1110-R1112 WeakPolarHBondContact OG-CD 3.39Å; S1110-R1112 WeakPolarHBondContact OG-CG 3.38Å; R1112-D1114 VanDerWaalsContact C-N 3.27Å; R1112-D1114 WeakPolarHBondContact CB-OD1 3.32Å; R1112-D1114 IonicContact CZ-OD1 2.66Å; R1112-D1114 IonicContact CZ-OD2 3.54Å; R1112-D1114 IonicContact NE-OD1 3.75Å; R1112-D1114 PolarHBondContact NE-OD1 3.43Å; R1112-D1114 IonicContact NE-OD2 3.61Å; R1112-D1114 PolarHBondContact NE-OD2 3Å; R1112-D1114 IonicContact NH2-OD1 2.76Å; R1112-D1114 IonicContact NH2-OD2 2.74Å; R1112-D1114 PolarHBondContact NH2-OD2 2.79Å; R1112-D1114 PolarHBondContact O-N 2.65Å; R1112-L1115 HydrophobicContact CB-CB 4Å; R1112-L1115 WeakPolarHBondContact O-CB 3.41Å; R1112-L1115 PolarHBondContact O-N 3.4Å
1113	E	52.7	Low	62	Low	181 Å²	181	81.1 Å²	81.1	85%	0.846	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-38.9	174.4	-60.8	-172.1	138.9	0	0	110.6	L1115 K1116	E1113-L1115 PolarHBondContact O-N 3.46Å; E1113-K1116 PolarHBondContact O-N 3.2Å
1114	D	59.8	Low	61.1	Low	51 Å²	51	82.2 Å²	82.2	27%	0.273	42%	0.417	S	S	.	.	H	α-helix	trans	-66.2	-12.7	173.6	64.4	-49.7	0	0	0	113.7	R1112 K1116 E1117 D1118	R1112-D1114 VanDerWaalsContact C-N 3.27Å; R1112-D1114 WeakPolarHBondContact CB-OD1 3.32Å; R1112-D1114 IonicContact CZ-OD1 2.66Å; R1112-D1114 IonicContact CZ-OD2 3.54Å; R1112-D1114 IonicContact NE-OD1 3.75Å; R1112-D1114 PolarHBondContact NE-OD1 3.43Å; R1112-D1114 IonicContact NE-OD2 3.61Å; R1112-D1114 PolarHBondContact NE-OD2 3Å; R1112-D1114 IonicContact NH2-OD1 2.76Å; R1112-D1114 IonicContact NH2-OD2 2.74Å; R1112-D1114 PolarHBondContact NH2-OD2 2.79Å; R1112-D1114 PolarHBondContact O-N 2.65Å; D1114-K1116 PolarHBondContact O-N 3.48Å; D1114-E1117 PolarHBondContact O-N 2.71Å; D1114-D1118 WeakPolarHBondContact O-CB 3.3Å; D1114-D1118 PolarHBondContact O-N 3.13Å
1115	L	60.4	Low	60.5	Low	19 Å²	19	84.7 Å²	84.7	10%	0.099	43%	0.431	C	S	.	.	H	α-helix	trans	-63.9	-30.5	172.5	-168	74.5	0	0	0	111.8	A1096 S1110 R1112 E1113 L1119	A1096-L1115 HydrophobicContact CB-CD1 4.42Å; A1096-L1115 HydrophobicContact CB-CD2 4.03Å; S1110-L1115 WeakPolarHBondContact O-CD2 3.49Å; R1112-L1115 HydrophobicContact CB-CB 4Å; R1112-L1115 WeakPolarHBondContact O-CB 3.41Å; R1112-L1115 PolarHBondContact O-N 3.4Å; E1113-L1115 PolarHBondContact O-N 3.46Å; L1115-L1119 HydrophobicContact CD1-CD1 4.46Å; L1115-L1119 HydrophobicContact CG-CD1 4.36Å; L1115-L1119 VanDerWaalsContact O-CB 3.31Å; L1115-L1119 WeakPolarHBondContact O-CB 3.46Å; L1115-L1119 PolarHBondContact O-N 2.96Å
1116	K	58.3	Low	59.8	Low	175 Å²	175	83 Å²	83	76%	0.761	42%	0.424	S	S	*	.	H	α-helix	trans	-70.5	-36.4	175.6	-78.7	-178	178	173.6	0	112.1	E1113 D1114 S1120	E1113-K1116 PolarHBondContact O-N 3.2Å; D1114-K1116 PolarHBondContact O-N 3.48Å; K1116-S1120 PolarHBondContact O-N 3.22Å
1117	E	60	Low	58.5	Low	137 Å²	137	84.4 Å²	84.4	64%	0.64	44%	0.435	S	S	*	.	H	α-helix	trans	-73	-46.1	176.8	-58.8	-171	157.6	0	0	110.4	D1114 L1119 S1120 L1121	D1114-E1117 PolarHBondContact O-N 2.71Å; E1117-L1119 VanDerWaalsContact C-N 3.31Å; E1117-L1119 PolarHBondContact O-N 3.29Å; E1117-S1120 PolarHBondContact O-N 3.38Å; E1117-S1120 VanDerWaalsContact O-N 3.16Å; E1117-S1120 PolarHBondContact O-OG 3.33Å; E1117-L1121 VanDerWaalsContact O-CB 3.28Å; E1117-L1121 WeakPolarHBondContact O-CB 3.4Å; E1117-L1121 PolarHBondContact O-N 2.98Å
1118	D	62.6	Low	57.5	Low	52 Å²	52	85.8 Å²	85.8	28%	0.278	45%	0.445	S	S	.	.	H	α-helix	trans	-60.3	-38.2	172.6	-88.3	-9.8	0	0	0	111.6	D1114 V1122	D1114-D1118 WeakPolarHBondContact O-CB 3.3Å; D1114-D1118 PolarHBondContact O-N 3.13Å; D1118-V1122 VanDerWaalsContact O-CB 3.25Å; D1118-V1122 WeakPolarHBondContact O-CB 3.24Å; D1118-V1122 WeakPolarHBondContact O-CG2 3.22Å; D1118-V1122 PolarHBondContact O-N 3.38Å
1119	L	59.8	Low	56.5	Low	44 Å²	44	86 Å²	86	23%	0.23	46%	0.459	C	S	.	.	H	α-helix	trans	-66.7	-39.1	174.2	-115.9	71.3	0	0	0	112.7	A1096 L1115 E1117 K1123	A1096-L1119 HydrophobicContact CB-CD1 4.16Å; L1115-L1119 HydrophobicContact CD1-CD1 4.46Å; L1115-L1119 HydrophobicContact CG-CD1 4.36Å; L1115-L1119 VanDerWaalsContact O-CB 3.31Å; L1115-L1119 WeakPolarHBondContact O-CB 3.46Å; L1115-L1119 PolarHBondContact O-N 2.96Å; E1117-L1119 VanDerWaalsContact C-N 3.31Å; E1117-L1119 PolarHBondContact O-N 3.29Å; L1119-K1123 WeakPolarHBondContact O-CB 3.49Å; L1119-K1123 PolarHBondContact O-N 3.15Å
1120	S	61	Low	55.3	Low	73 Å²	73	90.6 Å²	90.6	51%	0.51	49%	0.486	S	S	.	.	H	α-helix	trans	-69.9	-40.5	177.9	68.2	0	0	0	0	111.1	K1116 E1117 K1123 E1124	K1116-S1120 PolarHBondContact O-N 3.22Å; E1117-S1120 PolarHBondContact O-N 3.38Å; E1117-S1120 VanDerWaalsContact O-N 3.16Å; E1117-S1120 PolarHBondContact O-OG 3.33Å; S1120-K1123 PolarHBondContact O-N 3.11Å; S1120-E1124 WeakPolarHBondContact O-CB 3.39Å; S1120-E1124 PolarHBondContact O-N 3.09Å
1121	L	64.5	Low	53.7	Low	87 Å²	87	94.7 Å²	94.7	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-69.8	-41.9	179.7	-147.5	167.7	0	0	0	111.7	E1117 E1124 I1125	E1117-L1121 VanDerWaalsContact O-CB 3.28Å; E1117-L1121 WeakPolarHBondContact O-CB 3.4Å; E1117-L1121 PolarHBondContact O-N 2.98Å; L1121-E1124 PolarHBondContact O-N 3.33Å; L1121-I1125 HydrophobicContact CD2-CD1 3.54Å; L1121-I1125 HydrophobicContact CD2-CG1 4.18Å; L1121-I1125 WeakPolarHBondContact O-CB 3.24Å; L1121-I1125 VanDerWaalsContact O-CG1 3.28Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.22Å; L1121-I1125 PolarHBondContact O-N 2.95Å
1122	V	58.9	Low	52.6	Low	49 Å²	49	93.7 Å²	93.7	30%	0.297	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-42.8	170.2	169	0	0	0	0	110.9	D1118 E1124 I1125 V1126	D1118-V1122 VanDerWaalsContact O-CB 3.25Å; D1118-V1122 WeakPolarHBondContact O-CB 3.24Å; D1118-V1122 WeakPolarHBondContact O-CG2 3.22Å; D1118-V1122 PolarHBondContact O-N 3.38Å; V1122-E1124 PolarHBondContact O-N 3.2Å; V1122-I1125 PolarHBondContact O-N 3.46Å; V1122-V1126 HydrophobicContact CG1-CG2 4.31Å; V1122-V1126 WeakPolarHBondContact O-CB 3.43Å; V1122-V1126 VanDerWaalsContact O-CG2 3.31Å; V1122-V1126 WeakPolarHBondContact O-CG2 3.26Å; V1122-V1126 PolarHBondContact O-N 2.98Å
1123	K	53.9	Low	51.2	Low	160 Å²	160	98.8 Å²	98.8	70%	0.696	54%	0.539	S	S	*	.	H	α-helix	trans	-66.1	-36.8	178.4	-168.4	174.5	-175.1	-178.2	0	112.1	L1119 S1120 V1126 S1127	L1119-K1123 WeakPolarHBondContact O-CB 3.49Å; L1119-K1123 PolarHBondContact O-N 3.15Å; S1120-K1123 PolarHBondContact O-N 3.11Å; K1123-V1126 PolarHBondContact O-N 3.4Å; K1123-S1127 WeakPolarHBondContact O-CB 3.08Å; K1123-S1127 PolarHBondContact O-N 3.21Å; K1123-S1127 PolarHBondContact O-OG 3.04Å; K1123-S1127 VanDerWaalsContact O-OG 3.07Å
1124	E	54.2	Low	50.1	Low	96 Å²	96	97.6 Å²	97.6	45%	0.449	54%	0.539	S	S	.	.	H	α-helix	trans	-63.9	-46.9	172.3	-170.8	-176.9	173.9	0	0	111	S1120 L1121 V1122 V1126 S1127 S1128	S1120-E1124 WeakPolarHBondContact O-CB 3.39Å; S1120-E1124 PolarHBondContact O-N 3.09Å; L1121-E1124 PolarHBondContact O-N 3.33Å; V1122-E1124 PolarHBondContact O-N 3.2Å; E1124-V1126 PolarHBondContact O-N 3.21Å; E1124-S1127 WeakPolarHBondContact CA-OG 3.41Å; E1124-S1127 PolarHBondContact O-N 2.68Å; E1124-S1127 PolarHBondContact O-OG 3.46Å; E1124-S1128 WeakPolarHBondContact O-CB 3.22Å; E1124-S1128 PolarHBondContact O-N 2.95Å; E1124-S1128 PolarHBondContact O-OG 3.29Å
1125	I	57.2	Low	48.9	Very low	101 Å²	101	101 Å²	101	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-60.4	-43.6	175.6	-71.4	167	0	0	0	111.5	L1121 V1122 S1128 A1129	L1121-I1125 HydrophobicContact CD2-CD1 3.54Å; L1121-I1125 HydrophobicContact CD2-CG1 4.18Å; L1121-I1125 WeakPolarHBondContact O-CB 3.24Å; L1121-I1125 VanDerWaalsContact O-CG1 3.28Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.22Å; L1121-I1125 PolarHBondContact O-N 2.95Å; V1122-I1125 PolarHBondContact O-N 3.46Å; I1125-S1128 PolarHBondContact O-OG 2.91Å; I1125-A1129 WeakPolarHBondContact O-CB 3.43Å; I1125-A1129 PolarHBondContact O-N 3.49Å; I1125-A1129 VanDerWaalsContact O-N 3.13Å
1126	V	52.9	Low	47.5	Very low	78 Å²	78	105.5 Å²	105.5	47%	0.473	60%	0.6	S	S	.	*	H	α-helix	trans	-68.5	-43.1	178.6	171.1	0	0	0	0	111	V1122 K1123 E1124 A1129 V1130	V1122-V1126 HydrophobicContact CG1-CG2 4.31Å; V1122-V1126 WeakPolarHBondContact O-CB 3.43Å; V1122-V1126 VanDerWaalsContact O-CG2 3.31Å; V1122-V1126 WeakPolarHBondContact O-CG2 3.26Å; V1122-V1126 PolarHBondContact O-N 2.98Å; K1123-V1126 PolarHBondContact O-N 3.4Å; E1124-V1126 PolarHBondContact O-N 3.21Å; V1126-A1129 PolarHBondContact O-N 3.43Å; V1126-V1130 WeakPolarHBondContact O-CG2 3.47Å; V1126-V1130 PolarHBondContact O-N 3.4Å
1127	S	41.9	Very low	46.4	Very low	70 Å²	70	103.1 Å²	103.1	49%	0.49	61%	0.605	S	S	.	*	H	α-helix	trans	-66.6	-37.3	176.8	64.1	0	0	0	0	113.2	K1123 E1124 A1129 V1130	K1123-S1127 WeakPolarHBondContact O-CB 3.08Å; K1123-S1127 PolarHBondContact O-N 3.21Å; K1123-S1127 PolarHBondContact O-OG 3.04Å; K1123-S1127 VanDerWaalsContact O-OG 3.07Å; E1124-S1127 WeakPolarHBondContact CA-OG 3.41Å; E1124-S1127 PolarHBondContact O-N 2.68Å; E1124-S1127 PolarHBondContact O-OG 3.46Å; S1127-A1129 PolarHBondContact O-N 3.12Å; S1127-V1130 CarbonylContact O-C 3.46Å; S1127-V1130 PolarHBondContact O-N 3.43Å; S1127-V1130 VanDerWaalsContact O-N 3.11Å
1128	S	42.1	Very low	45.2	Very low	87 Å²	87	100.2 Å²	100.2	61%	0.608	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-4.1	177.1	57.5	0	0	0	0	113.9	E1124 I1125	E1124-S1128 WeakPolarHBondContact O-CB 3.22Å; E1124-S1128 PolarHBondContact O-N 2.95Å; E1124-S1128 PolarHBondContact O-OG 3.29Å; I1125-S1128 PolarHBondContact O-OG 2.91Å
1129	A	43.3	Very low	43.9	Very low	81 Å²	81	103 Å²	103	67%	0.669	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-9.4	165.3	0	0	0	0	0	113.3	I1125 V1126 S1127	I1125-A1129 WeakPolarHBondContact O-CB 3.43Å; I1125-A1129 PolarHBondContact O-N 3.49Å; I1125-A1129 VanDerWaalsContact O-N 3.13Å; V1126-A1129 PolarHBondContact O-N 3.43Å; S1127-A1129 PolarHBondContact O-N 3.12Å
1130	V	38.4	Very low	42.5	Very low	110 Å²	110	107.7 Å²	107.7	67%	0.667	66%	0.658	S	S	*	*			trans	-125.7	65.7	-174.2	-170.9	0	0	0	0	111	V1126 S1127	V1126-V1130 WeakPolarHBondContact O-CG2 3.47Å; V1126-V1130 PolarHBondContact O-N 3.4Å; S1127-V1130 CarbonylContact O-C 3.46Å; S1127-V1130 PolarHBondContact O-N 3.43Å; S1127-V1130 VanDerWaalsContact O-N 3.11Å
1131	T	31.1	Very low	41.3	Very low	107 Å²	107	111.5 Å²	111.5	66%	0.656	68%	0.678	S	S	*	*			trans	-132.9	112.6	161.1	54.9	0	0	0	0	108.7
1132	P	32.4	Very low	39.6	Very low	126 Å²	126	116.1 Å²	116.1	82%	0.818	70%	0.697	S	S	*	*			trans	-60.7	144.4	170.2	-20.8	33.2	0	0	0	111	D1134	P1132-D1134 PolarHBondContact O-N 3.36Å
1133	E	29.3	Very low	38.3	Very low	191 Å²	191	121.7 Å²	121.7	89%	0.893	73%	0.725	S	S	*	*			trans	-77.4	111.4	168.4	-65.4	-175.6	175.1	0	0	109
1134	D	29.3	Very low	37.2	Very low	156 Å²	156	123 Å²	123	83%	0.834	73%	0.734	S	S	*	*			trans	-168.2	160.5	156.3	-114.8	-33.7	0	0	0	113.5	P1132	P1132-D1134 PolarHBondContact O-N 3.36Å
1135	S	35	Very low	36	Very low	123 Å²	123	127.2 Å²	127.2	86%	0.86	75%	0.754	S	S	*	*			trans	70.5	161	-179.2	78.2	0	0	0	0	117.4
1136	S	30.6	Very low	34.8	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	76%	0.758	S	S	*	*			trans	-154.8	169.6	-149.6	62.1	0	0	0	0	117
1137	S	35.5	Very low	33.7	Very low	125 Å²	125	133.7 Å²	133.7	87%	0.874	78%	0.78	S	S	*	*			trans	82.3	149.8	162.9	79.9	0	0	0	0	119.7
1138	G	35.4	Very low	33.3	Very low	75 Å²	75	134.6 Å²	134.6	77%	0.773	79%	0.792	S	S	*	*			trans	104	116.3	168.8	0	0	0	0	0	115.7
1139	P	35.4	Very low	33	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	78%	0.783	S	S	*	*			trans	-117.7	-177.8	-175.6	43.8	-34.8	0	0	0	115.5
1140	D	29.7	Very low	32.6	Very low	143 Å²	143	136.6 Å²	136.6	77%	0.765	78%	0.781	S	S	*	*			trans	68.2	99.1	155.5	-52.2	-30.3	0	0	0	120.6
1141	T	35.8	Very low	32.6	Very low	152 Å²	152	137.1 Å²	137.1	93%	0.933	78%	0.78	S	S	*	*				-161.1	148.3	115.2	4.3	0	0	0	0	111.7
1142	E	28.7	Very low	33	Very low	184 Å²	184	135.6 Å²	135.6	86%	0.86	77%	0.767	S	S	*	*			trans	-93.1	148.6	-178.1	-59.8	174	123.9	0	0	111.8
1143	N	32.7	Very low	33.1	Very low	166 Å²	166	136.5 Å²	136.5	89%	0.888	76%	0.758	S	S	*	*			trans	-163.2	158.3	141.7	-107.8	-40.2	0	0	0	112
1144	E	30.2	Very low	33.5	Very low	188 Å²	188	132.7 Å²	132.7	88%	0.879	74%	0.74	S	S	*	*			trans	-93.4	112.8	-163.7	-58.7	179.5	107.8	0	0	113.8
1145	E	30.1	Very low	34	Very low	184 Å²	184	131.1 Å²	131.1	86%	0.86	73%	0.732	S	S	*	*			trans	-165.6	108	155.5	-121.3	176.3	-148.6	0	0	110.2
1146	N	30.7	Very low	34.3	Very low	112 Å²	112	130.1 Å²	130.1	60%	0.599	72%	0.716	S	S	*	*			trans	171.1	86.7	153.4	-106.5	-74.6	0	0	0	113.5	A1148 H1149	N1146-A1148 VanDerWaalsContact C-N 3.31Å; N1146-A1148 PolarHBondContact O-N 2.96Å; N1146-H1149 HydrophobicContact CB-CB 4.29Å
1147	Q	30.6	Very low	34.4	Very low	204 Å²	204	133 Å²	133	95%	0.953	71%	0.714	S	S	*	*	S	Bend	trans	-80	-10.2	174.7	-137	170.5	26	0	0	113.9
1148	A	33.7	Very low	34.4	Very low	88 Å²	88	135.3 Å²	135.3	73%	0.727	71%	0.709	S	S	*	*	S	Bend	trans	-83.4	-25.9	179.1	0	0	0	0	0	114.4	N1146 L1150	N1146-A1148 VanDerWaalsContact C-N 3.31Å; N1146-A1148 PolarHBondContact O-N 2.96Å; A1148-L1150 VanDerWaalsContact C-N 3.3Å; A1148-L1150 PolarHBondContact O-N 3.49Å
1149	H	34.3	Very low	34.3	Very low	93 Å²	93	142.4 Å²	142.4	43%	0.431	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-6.7	-167	-117.2	-57.4	0	0	0	115.6	N1146	N1146-H1149 HydrophobicContact CB-CB 4.29Å
1150	L	35.2	Very low	34	Very low	118 Å²	118	146.2 Å²	146.2	62%	0.618	72%	0.718	S	S	*	*	H	α-helix	trans	-74	-41.5	-168.2	-126.8	73.5	0	0	0	113.8	A1148 Q1154	A1148-L1150 VanDerWaalsContact C-N 3.3Å; A1148-L1150 PolarHBondContact O-N 3.49Å; L1150-Q1154 PolarHBondContact O-N 2.95Å
1151	N	38.9	Very low	33.8	Very low	121 Å²	121	150.3 Å²	150.3	65%	0.647	72%	0.722	S	S	*	*	H	α-helix	trans	-67.4	-40.9	-175	-78.6	-23.3	0	0	0	112.6	Q1154 L1155	N1151-Q1154 PolarHBondContact O-N 3.49Å; N1151-L1155 PolarHBondContact O-N 3.08Å
1152	L	39.6	Very low	33.3	Very low	74 Å²	74	151.1 Å²	151.1	39%	0.387	71%	0.713	S	S	.	*	H	α-helix	trans	-67.8	-40.4	-178.3	-167.8	62.1	0	0	0	111.8	Q1154 L1155 L1156	L1152-Q1154 VanDerWaalsContact C-N 3.28Å; L1152-Q1154 PolarHBondContact O-N 2.98Å; L1152-L1155 PolarHBondContact O-N 2.92Å; L1152-L1156 HydrophobicContact CG-CD1 4.06Å; L1152-L1156 WeakPolarHBondContact O-CB 3.43Å; L1152-L1156 VanDerWaalsContact O-CG 3.31Å; L1152-L1156 WeakPolarHBondContact O-CG 3.35Å; L1152-L1156 PolarHBondContact O-N 2.73Å
1153	K	35	Very low	33.3	Very low	146 Å²	146	148.5 Å²	148.5	64%	0.635	71%	0.712	S	S	*	*	H	α-helix	trans	-66.6	-24.6	173.9	-85.8	178.4	177	169.7	0	113.2	K1157	K1153-K1157 WeakPolarHBondContact O-CB 3.22Å; K1153-K1157 VanDerWaalsContact O-CG 3.32Å; K1153-K1157 WeakPolarHBondContact O-CG 3.33Å; K1153-K1157 PolarHBondContact O-N 3.38Å
1154	Q	38	Very low	33	Very low	110 Å²	110	144.5 Å²	144.5	51%	0.514	70%	0.697	S	S	.	*	H	α-helix	trans	-78	-45.6	171.5	-70.5	-171.7	8	0	0	112.2	L1150 N1151 L1152 L1156 K1157 F1158	L1150-Q1154 PolarHBondContact O-N 2.95Å; N1151-Q1154 PolarHBondContact O-N 3.49Å; L1152-Q1154 VanDerWaalsContact C-N 3.28Å; L1152-Q1154 PolarHBondContact O-N 2.98Å; Q1154-L1156 VanDerWaalsContact C-N 3.33Å; Q1154-L1156 PolarHBondContact O-N 3.3Å; Q1154-K1157 WeakPolarHBondContact O-CB 3.46Å; Q1154-K1157 PolarHBondContact O-N 3.31Å; Q1154-K1157 VanDerWaalsContact O-N 3.1Å; Q1154-F1158 WeakPolarHBondContact O-CD2 3.4Å; Q1154-F1158 PolarHBondContact O-N 2.84Å
1155	L	39.8	Very low	32.9	Very low	124 Å²	124	142.4 Å²	142.4	65%	0.649	69%	0.692	S	S	*	*	H	α-helix	trans	-58.2	-43	174.7	-77.9	163.3	0	0	0	112.2	N1151 L1152 K1157 F1158 R1159	N1151-L1155 PolarHBondContact O-N 3.08Å; L1152-L1155 PolarHBondContact O-N 2.92Å; L1155-K1157 VanDerWaalsContact C-N 3.35Å; L1155-K1157 PolarHBondContact O-N 2.79Å; L1155-F1158 PolarHBondContact O-N 3.04Å; L1155-R1159 PolarHBondContact O-N 3.27Å
1156	L	39.6	Very low	32.8	Very low	102 Å²	102	143.5 Å²	143.5	53%	0.534	69%	0.688	S	S	.	*	H	α-helix	trans	-69.7	-28.1	176	-68.3	171.1	0	0	0	113.2	L1152 Q1154 R1159 K1160	L1152-L1156 HydrophobicContact CG-CD1 4.06Å; L1152-L1156 WeakPolarHBondContact O-CB 3.43Å; L1152-L1156 VanDerWaalsContact O-CG 3.31Å; L1152-L1156 WeakPolarHBondContact O-CG 3.35Å; L1152-L1156 PolarHBondContact O-N 2.73Å; Q1154-L1156 VanDerWaalsContact C-N 3.33Å; Q1154-L1156 PolarHBondContact O-N 3.3Å; L1156-R1159 PolarHBondContact O-N 3.47Å; L1156-K1160 PolarHBondContact O-N 3.12Å
1157	K	34.5	Very low	32.7	Very low	174 Å²	174	143.9 Å²	143.9	76%	0.757	69%	0.69	S	S	*	*	H	α-helix	trans	-67.8	-33.4	172.1	-88.9	179.2	176	-178.5	0	112.7	K1153 Q1154 L1155	K1153-K1157 WeakPolarHBondContact O-CB 3.22Å; K1153-K1157 VanDerWaalsContact O-CG 3.32Å; K1153-K1157 WeakPolarHBondContact O-CG 3.33Å; K1153-K1157 PolarHBondContact O-N 3.38Å; Q1154-K1157 WeakPolarHBondContact O-CB 3.46Å; Q1154-K1157 PolarHBondContact O-N 3.31Å; Q1154-K1157 VanDerWaalsContact O-N 3.1Å; L1155-K1157 VanDerWaalsContact C-N 3.35Å; L1155-K1157 PolarHBondContact O-N 2.79Å
1158	F	34.2	Very low	32.7	Very low	172 Å²	172	141.3 Å²	141.3	75%	0.754	68%	0.675	S	S	*	*	H	α-helix	trans	-72.5	-29	174.5	-83.6	-76.5	0	0	0	113.4	Q1154 L1155	Q1154-F1158 WeakPolarHBondContact O-CD2 3.4Å; Q1154-F1158 PolarHBondContact O-N 2.84Å; L1155-F1158 PolarHBondContact O-N 3.04Å
1159	R	34.4	Very low	32.4	Very low	224 Å²	224	143.5 Å²	143.5	85%	0.845	67%	0.674	S	S	*	*	H	α-helix	trans	-83.8	-14.3	-177.2	-146.8	167.2	-175.3	167.4	-0.5	114.6	L1155 L1156 R1161	L1155-R1159 PolarHBondContact O-N 3.27Å; L1156-R1159 PolarHBondContact O-N 3.47Å; R1159-R1161 VanDerWaalsContact C-N 3.27Å; R1159-R1161 PolarHBondContact O-N 3.49Å
1160	K	28.4	Very low	32.2	Very low	192 Å²	192	146.4 Å²	146.4	84%	0.835	69%	0.686	S	S	*	*			trans	-83.2	32	175.1	-76.8	-165.6	175.3	-176.1	0	115.2	L1156 K1162	L1156-K1160 PolarHBondContact O-N 3.12Å; K1160-K1162 PolarHBondContact O-N 3.07Å
1161	R	25.8	Very low	32	Very low	228 Å²	228	145.2 Å²	145.2	86%	0.86	68%	0.68	S	S	*	*			trans	-84.1	91.3	163	-81.1	-172.3	171.7	-178.9	-1.1	110.4	R1159	R1159-R1161 VanDerWaalsContact C-N 3.27Å; R1159-R1161 PolarHBondContact O-N 3.49Å
1162	K	24.7	Very low	31.5	Very low	170 Å²	170	143.5 Å²	143.5	74%	0.739	67%	0.671	S	S	*	*			trans	-50.8	147.7	167.4	-68.5	-178.5	176.9	179.9	0	110.2	K1160 S1164	K1160-K1162 PolarHBondContact O-N 3.07Å; K1162-S1164 PolarHBondContact O-N 3.45Å
1163	P	29.1	Very low	31.1	Very low	128 Å²	128	143.2 Å²	143.2	83%	0.831	67%	0.673	S	S	*	*			trans	-70.9	45.7	158.6	32.5	-35.3	0	0	0	111.6	N1165	P1163-N1165 PolarHBondContact O-N 2.93Å
1164	S	27	Very low	30.9	Very low	82 Å²	82	141 Å²	141	57%	0.573	67%	0.671	S	S	*	*			trans	-82.3	46.7	-174.6	-175.5	0	0	0	0	112.2	K1162	K1162-S1164 PolarHBondContact O-N 3.45Å
1165	N	27.2	Very low	30.5	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	67%	0.67	S	S	*	*	S	Bend	trans	-170.9	68.8	160.7	-98.5	-15.8	0	0	0	111	P1163	P1163-N1165 PolarHBondContact O-N 2.93Å
1166	R	27.5	Very low	30	Very low	206 Å²	206	141.8 Å²	141.8	78%	0.777	67%	0.674	S	S	*	*	S	Bend	trans	-144.2	-37.5	156	-110.6	168.8	-159.4	-152.5	1.7	114.5	L1169	R1166-L1169 PolarHBondContact O-N 2.94Å
1167	N	30.3	Very low	29.5	Very low	121 Å²	121	144 Å²	144	65%	0.647	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-82.9	-26.3	179.1	-65.2	20.9	0	0	0	113.7	L1169 F1170 D1171	N1167-L1169 PolarHBondContact O-N 3.37Å; N1167-F1170 PolarHBondContact O-N 3.09Å; N1167-D1171 PolarHBondContact O-N 3.14Å
1168	K	28.9	Very low	29.2	Very low	149 Å²	149	139.6 Å²	139.6	65%	0.648	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-69.6	8.5	166.4	-81.7	-166.7	174.4	-172.4	0	114.5	N1172	K1168-N1172 WeakPolarHBondContact O-CB 3.38Å; K1168-N1172 PolarHBondContact O-ND2 3.12Å; K1168-N1172 VanDerWaalsContact O-ND2 3.09Å
1169	L	28.9	Very low	28.8	Very low	135 Å²	135	139.3 Å²	139.3	71%	0.707	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-119.8	26.3	163.4	-157.3	76.5	0	0	0	112.1	R1166 N1167	R1166-L1169 PolarHBondContact O-N 2.94Å; N1167-L1169 PolarHBondContact O-N 3.37Å
1170	F	30.4	Very low	28.4	Very low	153 Å²	153	134.1 Å²	134.1	67%	0.671	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	-47	159.3	-111.9	-98.2	0	0	0	109.5	N1167 T1173 V1174	N1167-F1170 PolarHBondContact O-N 3.09Å; F1170-T1173 CarbonylContact O-C 3.59Å; F1170-T1173 WeakPolarHBondContact O-CA 3.4Å; F1170-T1173 WeakPolarHBondContact O-CB 3.38Å; F1170-T1173 PolarHBondContact O-N 2.89Å; F1170-V1174 PolarHBondContact O-N 3.18Å
1171	D	30.6	Very low	28.5	Very low	93 Å²	93	131.3 Å²	131.3	50%	0.497	67%	0.666	S	S	.	*	H	α-helix	trans	-67.8	-41	179.2	-58.2	-44.9	0	0	0	112	N1167 T1173 V1174 T1175	N1167-D1171 PolarHBondContact O-N 3.14Å; D1171-T1173 PolarHBondContact O-N 3.35Å; D1171-T1173 VanDerWaalsContact O-N 3.14Å; D1171-V1174 PolarHBondContact O-N 2.8Å; D1171-T1175 WeakPolarHBondContact O-CB 3.33Å; D1171-T1175 PolarHBondContact O-N 3.29Å; D1171-T1175 PolarHBondContact O-OG1 3.49Å; D1171-T1175 VanDerWaalsContact O-OG1 3.05Å
1172	N	28.5	Very low	28.5	Very low	86 Å²	86	129.3 Å²	129.3	46%	0.46	67%	0.666	S	S	.	*	H	α-helix	trans	-74.3	3.9	170.8	-65.9	-28.7	0	0	0	113.8	K1168 K1176	K1168-N1172 WeakPolarHBondContact O-CB 3.38Å; K1168-N1172 PolarHBondContact O-ND2 3.12Å; K1168-N1172 VanDerWaalsContact O-ND2 3.09Å; N1172-K1176 WeakPolarHBondContact O-CB 3.23Å
1173	T	31	Very low	28.6	Very low	68 Å²	68	129.6 Å²	129.6	42%	0.417	67%	0.67	S	S	.	*	H	α-helix	trans	-105.1	-24.1	169.8	-53.4	0	0	0	0	111.1	F1170 D1171 L1177	F1170-T1173 CarbonylContact O-C 3.59Å; F1170-T1173 WeakPolarHBondContact O-CA 3.4Å; F1170-T1173 WeakPolarHBondContact O-CB 3.38Å; F1170-T1173 PolarHBondContact O-N 2.89Å; D1171-T1173 PolarHBondContact O-N 3.35Å; D1171-T1173 VanDerWaalsContact O-N 3.14Å; T1173-L1177 VanDerWaalsContact O-CD1 3.32Å; T1173-L1177 WeakPolarHBondContact O-CD1 3.25Å; T1173-L1177 WeakPolarHBondContact O-CG 3.38Å
1174	V	31	Very low	28.6	Very low	98 Å²	98	131.1 Å²	131.1	59%	0.594	67%	0.671	S	S	*	*	H	α-helix	trans	-83.6	-44.5	170.7	175.3	0	0	0	0	110.9	F1170 D1171 L1177	F1170-V1174 PolarHBondContact O-N 3.18Å; D1171-V1174 PolarHBondContact O-N 2.8Å; V1174-L1177 PolarHBondContact O-N 3.41Å
1175	T	29.2	Very low	28.6	Very low	81 Å²	81	135.7 Å²	135.7	50%	0.497	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-5.4	-175.5	-36	0	0	0	0	114	D1171	D1171-T1175 WeakPolarHBondContact O-CB 3.33Å; D1171-T1175 PolarHBondContact O-N 3.29Å; D1171-T1175 PolarHBondContact O-OG1 3.49Å; D1171-T1175 VanDerWaalsContact O-OG1 3.05Å
1176	K	29.3	Very low	28.7	Very low	171 Å²	171	134.9 Å²	134.9	74%	0.743	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	10.2	161.3	-81.9	-161.7	167.5	-164.7	0	113.5	N1172	N1172-K1176 WeakPolarHBondContact O-CB 3.23Å
1177	L	28.6	Very low	28.7	Very low	149 Å²	149	132.3 Å²	132.3	78%	0.78	69%	0.685	S	S	*	*	S	Bend	trans	-114.7	19.4	169.7	-71.7	177.8	0	0	0	112.2	T1173 V1174	T1173-L1177 VanDerWaalsContact O-CD1 3.32Å; T1173-L1177 WeakPolarHBondContact O-CD1 3.25Å; T1173-L1177 WeakPolarHBondContact O-CG 3.38Å; V1174-L1177 PolarHBondContact O-N 3.41Å
1178	S	27.2	Very low	28.6	Very low	81 Å²	81	134.1 Å²	134.1	57%	0.566	69%	0.689	S	S	*	*	S	Bend	trans	-134.6	7.4	179.2	70.3	0	0	0	0	114.8
1179	Q	26.1	Very low	28.6	Very low	166 Å²	166	133.4 Å²	133.4	78%	0.776	69%	0.692	S	S	*	*	S	Bend	trans	-148.7	65.3	179.8	-74.2	-166.6	-36.1	0	0	112.3
1180	T	27.6	Very low	28.6	Very low	114 Å²	114	134.9 Å²	134.9	70%	0.699	70%	0.699	S	S	*	*	S	Bend	trans	-153.9	107.8	150.8	43.8	0	0	0	0	107.6
1181	N	29.1	Very low	28.4	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	70%	0.698	S	S	*	*			trans	62	115.6	154.4	-54.2	41.4	0	0	0	115.1
1182	E	26.4	Very low	28.1	Very low	186 Å²	186	139.7 Å²	139.7	87%	0.869	71%	0.712	S	S	*	*			cis	47.3	73	41.9	-57.4	-174.2	136.9	0	0	111.8
1183	E	26.8	Very low	28	Very low	175 Å²	175	145.6 Å²	145.6	82%	0.818	73%	0.733	S	S	*	*			trans	-165	144.5	131.9	-103.6	153.6	-164.6	0	0	111.3
1184	D	28	Very low	27.8	Very low	161 Å²	161	148.4 Å²	148.4	86%	0.861	76%	0.756	S	S	*	*			trans	62.8	139.1	167	-63.1	-11.9	0	0	0	123.8
1185	E	27.2	Very low	27.5	Very low	177 Å²	177	149.6 Å²	149.6	83%	0.827	77%	0.769	S	S	*	*			trans	-106.4	176.7	-175	-57.6	-176.4	104.4	0	0	112.7
1186	T	29.3	Very low	27.3	Very low	129 Å²	129	155.2 Å²	155.2	79%	0.791	79%	0.786	S	S	*	*			trans	73.1	156.3	169.5	82.6	0	0	0	0	115.6
1187	L	28.3	Very low	27.1	Very low	151 Å²	151	153.4 Å²	153.4	79%	0.791	79%	0.789	S	S	*	*			cis	-133.8	148.2	3.8	-168	70.5	0	0	0	111
1188	H	28.1	Very low	26.9	Very low	159 Å²	159	154.8 Å²	154.8	74%	0.736	79%	0.792	S	S	*	*			trans	-86.6	165.4	174.6	-134.4	-94.8	0	0	0	112
1189	D	28.9	Very low	26.8	Very low	135 Å²	135	156.3 Å²	156.3	72%	0.722	79%	0.792	S	S	*	*			trans	63.7	115	163	-59.2	-21.9	0	0	0	120
1190	I	28	Very low	26.8	Very low	166 Å²	166	152 Å²	152	85%	0.851	78%	0.778	S	S	*	*				-143.6	119.5	121.5	-103.3	157.7	0	0	0	110.3
1191	E	28	Very low	26.8	Very low	138 Å²	138	150.1 Å²	150.1	65%	0.645	77%	0.769	S	S	*	*			trans	41.2	102.6	155.4	-53.5	-148.3	109.6	0	0	123
1192	R	23.6	Very low	26.7	Very low	208 Å²	208	150.3 Å²	150.3	79%	0.785	78%	0.775	S	S	*	*				31.5	100.3	113.5	-72	178.1	-89	141.5	7.5	117.8
1193	K	25.6	Very low	26.7	Very low	211 Å²	211	148.1 Å²	148.1	92%	0.917	77%	0.769	S	S	*	*			trans	-178.8	81	134.5	-100.4	155.1	-173.4	168	0	114.7
1194	S	27.4	Very low	26.8	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	76%	0.761	S	S	*	*			trans	172	88.8	143	53.5	0	0	0	0	110.9
1195	S	25.1	Very low	26.6	Very low	124 Å²	124	147 Å²	147	87%	0.867	76%	0.761	S	S	*	*			trans	-80.3	156.1	173.2	40.2	0	0	0	0	112.5
1196	F	24.6	Very low	26.7	Very low	199 Å²	199	145.1 Å²	145.1	87%	0.873	75%	0.75	S	S	*	*			trans	120.9	47.3	154.8	-145.9	-97	0	0	0	118.6
1197	V	24.5	Very low	26.7	Very low	133 Å²	133	145 Å²	145	81%	0.806	74%	0.743	S	S	*	*			trans	-145.5	107	151.8	-174.1	0	0	0	0	111.4
1198	E	26	Very low	26.8	Very low	177 Å²	177	143.6 Å²	143.6	83%	0.827	74%	0.744	S	S	*	*			trans	-123	133.5	162	-75.5	-172.4	112.4	0	0	108
1199	I	24.9	Very low	26.9	Very low	113 Å²	113	140.5 Å²	140.5	58%	0.579	73%	0.728	S	S	*	*				68.2	120.9	58.4	-59.8	169.1	0	0	0	110.5
1200	T	26.3	Very low	26.9	Very low	77 Å²	77	142.5 Å²	142.5	47%	0.472	73%	0.731	S	S	.	*			cis	-174.2	168.2	-40.9	17.2	0	0	0	0	106	K449	K449-T1200 HydrophobicContact CD-CG2 4.2Å
1201	S	26.1	Very low	26.7	Very low	73 Å²	73	142.2 Å²	142.2	51%	0.51	73%	0.728	S	S	.	*			trans	56.9	94.2	151.5	47.3	0	0	0	0	119.9	T451	T451-S1201 WeakPolarHBondContact CG2-OG 3.45Å
1202	V	28.6	Very low	26.6	Very low	139 Å²	139	146.5 Å²	146.5	84%	0.842	74%	0.738	S	S	*	*			trans	-136.1	153.8	143.8	-178.5	0	0	0	0	108
1203	D	25.6	Very low	26.7	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	74%	0.737	S	S	*	*			trans	-59.9	136.3	-166.8	-58.1	-85.8	0	0	0	117.2
1204	K	28.7	Very low	26.6	Very low	147 Å²	147	144.4 Å²	144.4	64%	0.639	74%	0.737	S	S	*	*				171.8	109.6	119.9	-91.9	146.9	-175.4	160.5	0	110.8	E343 K1206	E343-K1204 WeakPolarHBondContact OE1-CE 3.45Å; E343-K1204 IonicContact OE1-NZ 3.61Å; E343-K1204 PolarHBondContact OE1-NZ 3.3Å; K1204-K1206 PolarHBondContact O-N 3.25Å
1205	L	24.7	Very low	26.3	Very low	166 Å²	166	148.9 Å²	148.9	87%	0.869	74%	0.735	S	S	*	*			trans	-68	94.9	167.8	-87.2	85.8	0	0	0	110.3	L1207	L1205-L1207 HydrophobicContact CD2-CD1 4.18Å
1206	K	28.9	Very low	26.4	Very low	137 Å²	137	147.7 Å²	147.7	60%	0.596	73%	0.726	S	S	*	*			trans	-107	93.2	154.9	-82.1	-171.2	170.6	-176.1	0	108.6	D908 S910 K1204 P1208	D908-K1206 IonicContact OD1-NZ 2.9Å; S910-K1206 PolarHBondContact OG-NZ 3.39Å; K1204-K1206 PolarHBondContact O-N 3.25Å; K1206-P1208 VanDerWaalsContact O-CD 3.3Å; K1206-P1208 WeakPolarHBondContact O-CD 3.2Å
1207	L	28	Very low	26.4	Very low	125 Å²	125	143.5 Å²	143.5	65%	0.654	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-59.3	123.9	164	-84.1	79.9	0	0	0	108.3	L1205 K1209	L1205-L1207 HydrophobicContact CD2-CD1 4.18Å; L1207-K1209 PolarHBondContact O-N 3.46Å
1208	P	30.5	Very low	26.5	Very low	122 Å²	122	140.6 Å²	140.6	79%	0.792	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-70.1	120.9	161.5	-8.5	26	0	0	0	107.2	K1206 F1210	K1206-P1208 VanDerWaalsContact O-CD 3.3Å; K1206-P1208 WeakPolarHBondContact O-CD 3.2Å; P1208-F1210 PolarHBondContact O-N 3.27Å
1209	K	31.9	Very low	26.4	Very low	95 Å²	95	140.1 Å²	140.1	41%	0.413	71%	0.711	S	S	.	*	P	Polyproline II helix	trans	-53.7	134.7	174.1	-58.3	-154.4	-167.8	-165.5	0	109.7	I956 E959 L1207	I956-K1209 HydrophobicContact CG1-CD 4.01Å; I956-K1209 VanDerWaalsContact CG1-NZ 3.27Å; E959-K1209 VanDerWaalsContact OE2-CD 3.24Å; E959-K1209 WeakPolarHBondContact OE2-CD 3.18Å; L1207-K1209 PolarHBondContact O-N 3.46Å
1210	F	27.1	Very low	26.5	Very low	176 Å²	176	140.3 Å²	140.3	77%	0.772	72%	0.716	S	S	*	*	S	Bend	trans	-72.8	168.3	167.2	-135.8	-107.5	0	0	0	109.6	P1208	P1208-F1210 PolarHBondContact O-N 3.27Å
1211	M	24.5	Very low	26.6	Very low	160 Å²	160	144.1 Å²	144.1	79%	0.788	73%	0.727	S	S	*	*			trans	51.8	86.3	176.3	-62.9	-151	174.1	0	0	117.3
1212	R	26.4	Very low	26.7	Very low	228 Å²	228	147 Å²	147	86%	0.86	74%	0.742	S	S	*	*			trans	-121	130.4	140.3	-101.3	-173.3	176.1	-172.1	-1.3	110.6	K1214	R1212-K1214 PolarHBondContact O-N 3.11Å; R1212-K1214 VanDerWaalsContact O-N 3.15Å
1213	Q	24.5	Very low	26.7	Very low	166 Å²	166	147.2 Å²	147.2	78%	0.776	74%	0.738	S	S	*	*			trans	-56.5	117	176.8	-74	-178.4	-8.9	0	0	110.2	R1215	Q1213-R1215 PolarHBondContact O-N 3.26Å
1214	K	24.2	Very low	26.7	Very low	209 Å²	209	147.8 Å²	147.8	91%	0.909	74%	0.74	S	S	*	*			trans	-80.1	56.6	168.6	-154.1	-179.5	-175.6	-173.4	0	110.5	R1212 S1216	R1212-K1214 PolarHBondContact O-N 3.11Å; R1212-K1214 VanDerWaalsContact O-N 3.15Å; K1214-S1216 PolarHBondContact O-N 3.17Å
1215	R	22.1	Very low	26.8	Very low	220 Å²	220	146.7 Å²	146.7	83%	0.83	75%	0.746	S	S	*	*			trans	-76	88.8	172.7	-128.5	-177.9	-179.6	-175.7	-0.9	108.1	Q1213	Q1213-R1215 PolarHBondContact O-N 3.26Å
1216	S	26.3	Very low	27.1	Very low	99 Å²	99	146.7 Å²	146.7	69%	0.692	74%	0.741	S	S	*	*			trans	-146.5	107.3	166.6	-165.5	0	0	0	0	111	K1214	K1214-S1216 PolarHBondContact O-N 3.17Å
1217	S	24.2	Very low	27.3	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	75%	0.747	S	S	*	*	S	Bend	trans	40	88.8	150.6	-54.9	0	0	0	0	120.2
1218	S	26.5	Very low	27.4	Very low	71 Å²	71	148.4 Å²	148.4	50%	0.497	76%	0.757	S	S	.	*				-173.1	58.8	128.5	-177.1	0	0	0	0	112.6	R237	R237-S1218 PolarHBondContact NH1-OG 3.34Å; R237-S1218 PolarHBondContact NH2-OG 3.18Å
1219	N	25.5	Very low	27.6	Very low	168 Å²	168	147.3 Å²	147.3	90%	0.898	75%	0.75	S	S	*	*			trans	-128.2	58.4	171.2	-114.6	6.4	0	0	0	111.4
1220	V	26.5	Very low	27.5	Very low	116 Å²	116	149.6 Å²	149.6	70%	0.703	77%	0.766	S	S	*	*			trans	-147.3	148.8	167.9	-140.8	0	0	0	0	110.8
1221	F	28.7	Very low	27.6	Very low	158 Å²	158	147.9 Å²	147.9	69%	0.693	77%	0.765	S	S	*	*			trans	59.9	80.3	168.5	-71.5	-68.6	0	0	0	119.3	L1224	F1221-L1224 HydrophobicContact CD1-CB 4.45Å; F1221-L1224 HydrophobicContact CE1-CB 4.09Å
1222	T	28.4	Very low	27.8	Very low	133 Å²	133	144.4 Å²	144.4	82%	0.816	76%	0.756	S	S	*	*	S	Bend		-91	161.1	110.5	48.4	0	0	0	0	109.3
1223	N	26.9	Very low	27.9	Very low	144 Å²	144	143 Å²	143	77%	0.77	76%	0.756	S	S	*	*	S	Bend	trans	66.4	65.7	-178.5	-58.2	-2.3	0	0	0	116.5
1224	L	26.4	Very low	28.1	Very low	152 Å²	152	140.2 Å²	140.2	80%	0.796	76%	0.755	S	S	*	*				-160.8	102.1	119.8	-136.1	74.8	0	0	0	111.3	F1221	F1221-L1224 HydrophobicContact CD1-CB 4.45Å; F1221-L1224 HydrophobicContact CE1-CB 4.09Å
1225	T	30.3	Very low	28.3	Very low	123 Å²	123	138.8 Å²	138.8	76%	0.755	75%	0.749	S	S	*	*			trans	-144.4	115.4	166	48.5	0	0	0	0	111.4
1226	Q	31.9	Very low	28.4	Very low	166 Å²	166	135.4 Å²	135.4	78%	0.776	75%	0.745	S	S	*	*			trans	73.7	98.1	145.8	-59.3	-177.9	-65.4	0	0	119.4
1227	N	32.2	Very low	28.5	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	75%	0.751	S	S	*	*				72.7	103	114.5	-59.9	1.9	0	0	0	120.9
1228	L	29.5	Very low	28.6	Very low	165 Å²	165	137.5 Å²	137.5	86%	0.864	75%	0.745	S	S	*	*			trans	69.9	154.5	138.5	-82.7	94.9	0	0	0	119.2
1229	P	34.8	Very low	28.8	Very low	99 Å²	99	141.6 Å²	141.6	64%	0.643	76%	0.761	S	S	*	*			trans	-100.6	168.6	-162.6	40.1	-36.1	0	0	0	113.2
1230	N	30.6	Very low	28.8	Very low	143 Å²	143	140.6 Å²	140.6	77%	0.765	76%	0.756	S	S	*	*				-168	158.3	123.4	-102.3	-31.7	0	0	0	113.7
1231	L	29.4	Very low	29	Very low	140 Å²	140	140.9 Å²	140.9	73%	0.733	76%	0.763	S	S	*	*			trans	31.5	109.8	157.6	-79.7	72.9	0	0	0	118.4
1232	S	28.3	Very low	29	Very low	88 Å²	88	136.6 Å²	136.6	62%	0.615	76%	0.764	S	S	*	*				93.6	144.7	59.9	75.3	0	0	0	0	114.6
1233	K	28.8	Very low	29.1	Very low	198 Å²	198	138.4 Å²	138.4	86%	0.861	76%	0.763	S	S	*	*			trans	70	110.6	167.9	-62.6	174.8	-178.6	175.7	0	114.5
1234	S	28.1	Very low	29	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	76%	0.764	S	S	*	*				102.8	146.3	95.4	-164.6	0	0	0	0	109.7
1235	K	28.6	Very low	29.2	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	76%	0.764	S	S	*	*			cis	-144.6	175.3	19.4	-157.5	169.5	179.4	-175	0	112.1
1236	M	24.9	Very low	29.2	Very low	150 Å²	150	142 Å²	142	74%	0.739	76%	0.756	S	S	*	*			trans	-37.4	158.4	162.6	-49.9	149.2	86.6	0	0	112.8
1237	I	28.8	Very low	29.2	Very low	159 Å²	159	139.5 Å²	139.5	82%	0.815	75%	0.748	S	S	*	*				-145	143.4	67.1	-78.5	156.5	0	0	0	112.1
1238	S	26.5	Very low	29	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	75%	0.751	S	S	*	*			trans	-94.7	146.6	165.6	54	0	0	0	0	110.3
1239	D	29.5	Very low	29	Very low	158 Å²	158	138.6 Å²	138.6	85%	0.845	74%	0.742	S	S	*	*			trans	-133.1	147.7	153.1	-95.9	-48.7	0	0	0	111.1
1240	N	26.3	Very low	28.7	Very low	146 Å²	146	144 Å²	144	78%	0.781	75%	0.75	S	S	*	*			trans	-120.2	175	-175.4	-101.2	-35.2	0	0	0	109.6
1241	S	29.6	Very low	28.7	Very low	122 Å²	122	145.1 Å²	145.1	85%	0.853	75%	0.748	S	S	*	*			trans	81.7	143.9	159.2	81.2	0	0	0	0	119.1
1242	G	29	Very low	28.7	Very low	69 Å²	69	143.1 Å²	143.1	71%	0.711	75%	0.745	S	S	*	*			trans	78.7	141.5	169.6	0	0	0	0	0	116.6
1243	E	30.2	Very low	28.8	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	75%	0.746	S	S	*	*			cis	-144.8	146	-19.7	-77.3	-163.9	98.3	0	0	107.3
1244	R	26.3	Very low	28.8	Very low	211 Å²	211	142.9 Å²	142.9	80%	0.796	75%	0.746	S	S	*	*				28.8	121.6	106.8	-54.1	175.8	178	171	-0.9	113.2
1245	E	30.4	Very low	28.7	Very low	170 Å²	170	146.1 Å²	146.1	79%	0.794	75%	0.749	S	S	*	*				-147.3	134.3	67.5	-73.7	-138.5	104.3	0	0	111.9
1246	I	29.8	Very low	28.8	Very low	113 Å²	113	143.3 Å²	143.3	58%	0.579	75%	0.749	S	S	*	*				69.5	99.3	74.2	-62.1	160.4	0	0	0	111.5
1247	N	31	Very low	28.7	Very low	115 Å²	115	139.7 Å²	139.7	62%	0.615	74%	0.739	S	S	*	*				-166.7	148.5	80.6	-104.8	-66.4	0	0	0	113.4
1248	K	29.6	Very low	28.7	Very low	179 Å²	179	138.9 Å²	138.9	78%	0.778	73%	0.731	S	S	*	*			trans	38.5	137.3	140.3	-63.2	161.6	-170.1	149.3	0	120.3
1249	C	29.5	Very low	28.7	Very low	100 Å²	100	141.3 Å²	141.3	68%	0.676	74%	0.737	S	S	*	*			cis	-148.9	142.6	19.2	-129.2	0	0	0	0	113.4
1250	R	28.2	Very low	28.6	Very low	212 Å²	212	139.6 Å²	139.6	80%	0.8	73%	0.728	S	S	*	*			trans	44.8	122.8	132.9	-82	-177.8	161.2	134.5	-5.1	119.6
1251	K	29.1	Very low	28.6	Very low	167 Å²	167	138 Å²	138	73%	0.726	72%	0.723	S	S	*	*				66.8	139.1	91.7	-72.6	-171.2	164.4	-111.7	0	112.8
1252	S	30.5	Very low	28.4	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	72%	0.718	S	S	*	*			cis	-140.6	152.3	22.7	22.9	0	0	0	0	110.9
1253	D	29.4	Very low	28.4	Very low	119 Å²	119	140.9 Å²	140.9	64%	0.636	72%	0.719	S	S	*	*				52.5	124.9	94.6	-31.3	-47.5	0	0	0	111.7
1254	L	30.4	Very low	27.9	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	72%	0.717	S	S	*	*			cis	-147.7	147.6	28.6	-88.4	99.2	0	0	0	115.6
1255	Q	25.9	Very low	27.9	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	72%	0.715	S	S	*	*			trans	-88.6	173.3	136.6	-70.9	-179.8	-84.2	0	0	108.4
1256	P	29.3	Very low	27.7	Very low	119 Å²	119	134 Å²	134	77%	0.773	71%	0.711	S	S	*	*			cis	-111.9	-114.9	0.4	17.3	9.1	0	0	0	111.5
1257	S	24.5	Very low	27.5	Very low	74 Å²	74	132.7 Å²	132.7	52%	0.517	71%	0.712	S	S	.	*			cis	-163.2	-169.1	-3.7	63.7	0	0	0	0	112.8
1258	E	26.8	Very low	27.3	Very low	142 Å²	142	133.5 Å²	133.5	66%	0.664	72%	0.716	S	S	*	*			trans	11.6	130.9	153.1	-59.3	116.9	-170.1	0	0	118.6
1259	N	28.2	Very low	27.1	Very low	146 Å²	146	130.4 Å²	130.4	78%	0.781	71%	0.713	S	S	*	*			cis	-130.5	140.3	27.8	-64.2	-83.9	0	0	0	110.2
1260	D	26.1	Very low	27	Very low	122 Å²	122	132.6 Å²	132.6	65%	0.652	72%	0.718	S	S	*	*			cis	72.1	155.8	30.5	-134.3	-20	0	0	0	114.4
1261	T	27.7	Very low	26.9	Very low	112 Å²	112	127.8 Å²	127.8	69%	0.687	71%	0.711	S	S	*	*			trans	73	122.7	-168	69.6	0	0	0	0	116.3
1262	N	25.4	Very low	26.8	Very low	138 Å²	138	125 Å²	125	74%	0.738	71%	0.708	S	S	*	*			cis	79.8	152.6	42.1	-65.3	-38.4	0	0	0	113.6
1263	P	27.4	Very low	26.6	Very low	114 Å²	114	126.5 Å²	126.5	74%	0.74	71%	0.709	S	S	*	*			cis	-133.7	-164.9	-24.1	29.8	-7.8	0	0	0	112
1264	C	21.1	Very low	26.5	Very low	111 Å²	111	127.3 Å²	127.3	75%	0.75	71%	0.712	S	S	*	*			trans	-52.9	140.4	150.5	-48.3	0	0	0	0	110.9
1265	H	26.5	Very low	26.3	Very low	162 Å²	162	126.8 Å²	126.8	75%	0.75	71%	0.706	S	S	*	*				-172.2	157.6	123.8	-106.4	-61.7	0	0	0	113
1266	N	25.7	Very low	26.3	Very low	132 Å²	132	123.8 Å²	123.8	71%	0.706	70%	0.704	S	S	*	*			trans	18.9	137.9	136.1	-60.3	18	0	0	0	118.2
1267	S	25.6	Very low	26.2	Very low	87 Å²	87	122.2 Å²	122.2	61%	0.608	70%	0.696	S	S	*	*			cis	179.8	-177	2.9	46.7	0	0	0	0	109.2
1268	N	26.2	Very low	26.3	Very low	132 Å²	132	125 Å²	125	71%	0.706	71%	0.705	S	S	*	*			trans	65	92	149	-67.3	-1	0	0	0	116.1
1269	T	25.9	Very low	26.2	Very low	114 Å²	114	125.5 Å²	125.5	70%	0.699	71%	0.711	S	S	*	*				68.9	107.3	101.1	59.2	0	0	0	0	113.9
1270	N	27	Very low	26.3	Very low	146 Å²	146	125.9 Å²	125.9	78%	0.781	71%	0.714	S	S	*	*				159.7	142.8	123.7	-82.3	-18.7	0	0	0	110.9
1271	V	27.1	Very low	26.6	Very low	110 Å²	110	124.5 Å²	124.5	67%	0.667	71%	0.711	S	S	*	*			cis	-165.6	148.1	-22	92.7	0	0	0	0	106.5
1272	T	27.2	Very low	26.6	Very low	109 Å²	109	126 Å²	126	67%	0.669	72%	0.715	S	S	*	*			trans	45.1	136.2	162.7	61	0	0	0	0	119.1
1273	N	26.1	Very low	26.6	Very low	128 Å²	128	125 Å²	125	68%	0.684	72%	0.718	S	S	*	*			cis	-179.7	165.2	23.8	-102.4	-5	0	0	0	105
1274	L	27.1	Very low	26.7	Very low	136 Å²	136	124.9 Å²	124.9	71%	0.712	72%	0.715	S	S	*	*			cis	-126.4	140.4	-2.1	-86.2	108.6	0	0	0	107.6
1275	Q	26.3	Very low	27	Very low	152 Å²	152	126.3 Å²	126.3	71%	0.71	71%	0.714	S	S	*	*				39.8	103.4	103.2	-65.1	174	-81.9	0	0	114.8
1276	S	25.8	Very low	27	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	71%	0.713	S	S	*	*				101.6	157.7	104.5	78.8	0	0	0	0	112
1277	S	26.3	Very low	27.1	Very low	87 Å²	87	124 Å²	124	61%	0.608	71%	0.71	S	S	*	*			cis	-153.2	169.8	7	65.4	0	0	0	0	110.9
1278	N	26.4	Very low	27.3	Very low	133 Å²	133	126.9 Å²	126.9	71%	0.711	72%	0.717	S	S	*	*			trans	58.8	121.5	147.4	-61.5	-6.5	0	0	0	119.5
1279	L	26	Very low	27.4	Very low	151 Å²	151	126.1 Å²	126.1	79%	0.791	72%	0.716	S	S	*	*				71.3	96	69.1	-77.6	162.4	0	0	0	115.1
1280	N	28.5	Very low	27.6	Very low	154 Å²	154	125.8 Å²	125.8	82%	0.824	71%	0.711	S	S	*	*			trans	60.1	-175.7	149.6	-112.3	-14.4	0	0	0	116.1
1281	P	34	Very low	27.6	Very low	93 Å²	93	129.8 Å²	129.8	60%	0.604	72%	0.716	S	S	*	*			cis	-116.1	-150.5	-37.1	34.6	-16.7	0	0	0	109.2
1282	N	27	Very low	27.7	Very low	144 Å²	144	130 Å²	130	77%	0.77	71%	0.714	S	S	*	*			trans	28.3	119.3	147.3	-63.3	-25.2	0	0	0	121
1283	C	26.4	Very low	28	Very low	118 Å²	118	131 Å²	131	80%	0.797	72%	0.72	S	S	*	*			trans	77.4	153.3	136.7	-105.1	0	0	0	0	122.2
1284	T	28.6	Very low	28.2	Very low	110 Å²	110	131.3 Å²	131.3	68%	0.675	72%	0.722	S	S	*	*			trans	76.4	92.9	142.3	-57.3	0	0	0	0	121
1285	I	27.4	Very low	28.5	Very low	141 Å²	141	132.5 Å²	132.5	72%	0.723	73%	0.729	S	S	*	*				73.5	126.8	111.5	-98.6	169.2	0	0	0	121.7
1286	I	27.3	Very low	28.7	Very low	143 Å²	143	131 Å²	131	73%	0.733	73%	0.73	S	S	*	*			trans	67.1	153.2	144.1	-67.6	179.6	0	0	0	120
1287	T	27.5	Very low	29.2	Very low	104 Å²	104	130.9 Å²	130.9	64%	0.638	73%	0.725	S	S	*	*			cis	-176.1	175.2	-34.7	-64.9	0	0	0	0	105.7
1288	I	29	Very low	29.6	Very low	147 Å²	147	133.4 Å²	133.4	75%	0.754	73%	0.731	S	S	*	*			trans	61.4	169.2	163.6	34	177.6	0	0	0	116.2
1289	T	29	Very low	30	Very low	115 Å²	115	132.8 Å²	132.8	71%	0.706	73%	0.728	S	S	*	*			cis	-149.1	162.6	-2.6	-1.6	0	0	0	0	106.9
1290	N	29.4	Very low	30.5	Very low	108 Å²	108	131.1 Å²	131.1	58%	0.578	72%	0.72	S	S	*	*			cis	-157.4	-178.6	-8.6	-158.3	38.2	0	0	0	109.1	N1292	N1290-N1292 PolarHBondContact ND2-OD1 2.73Å
1291	Y	27	Very low	30.6	Very low	229 Å²	229	130.3 Å²	130.3	90%	0.898	72%	0.716	S	S	*	*			trans	-140.8	138.9	142.8	-117.8	-83.1	0	0	0	110.6
1292	N	29.6	Very low	30.5	Very low	114 Å²	114	135.1 Å²	135.1	61%	0.61	73%	0.727	S	S	*	*			trans	-97.3	149.2	-169.1	-66.5	2.1	0	0	0	113.3	N1290	N1290-N1292 PolarHBondContact ND2-OD1 2.73Å
1293	T	32.9	Very low	30.5	Very low	132 Å²	132	134.6 Å²	134.6	81%	0.81	73%	0.729	S	S	*	*			trans	-142.3	110.3	130.5	49.5	0	0	0	0	108.5
1294	D	31	Very low	30.8	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	73%	0.726	S	S	*	*			trans	14.6	138	136.6	-41.8	-46.6	0	0	0	117.7
1295	D	33.2	Very low	30.7	Very low	161 Å²	161	137.7 Å²	137.7	86%	0.861	73%	0.732	S	S	*	*				-140.6	172	58.3	-107.9	-44.8	0	0	0	116.5
1296	T	29.9	Very low	30.9	Very low	121 Å²	121	136.3 Å²	136.3	74%	0.742	74%	0.735	S	S	*	*			trans	-93.9	164.1	-180	59.8	0	0	0	0	112.2
1297	T	35.6	Very low	30.9	Very low	110 Å²	110	136.8 Å²	136.8	68%	0.675	74%	0.739	S	S	*	*				-172.7	153.8	63.8	54	0	0	0	0	114
1298	N	35.3	Very low	31.2	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	75%	0.75	S	S	*	*			trans	52.5	149.8	142.4	-76.7	-32.4	0	0	0	122.7
1299	N	35.8	Very low	31.2	Very low	120 Å²	120	138.2 Å²	138.2	64%	0.642	75%	0.75	S	S	*	*			cis	-170.6	162.6	-31	-140.7	-35.3	0	0	0	111.1
1300	N	34.9	Very low	31.4	Very low	116 Å²	116	139.6 Å²	139.6	62%	0.62	76%	0.758	S	S	*	*			trans	63.6	112	154.5	-66.2	-46	0	0	0	123
1301	N	31.8	Very low	31.3	Very low	138 Å²	138	141.2 Å²	141.2	74%	0.738	77%	0.767	S	S	*	*				58.4	114.9	122.1	-50.2	-28.8	0	0	0	122
1302	K	32.1	Very low	31.6	Very low	194 Å²	194	138.8 Å²	138.8	84%	0.843	76%	0.764	S	S	*	*				-175.6	139.2	98.3	-102	173.4	-178.7	176.7	0	114.3
1303	T	26.7	Very low	31.6	Very low	133 Å²	133	144.2 Å²	144.2	82%	0.816	78%	0.776	S	S	*	*			trans	-104.9	127.9	166.5	-46.3	0	0	0	0	109.2
1304	I	32.3	Very low	31.5	Very low	143 Å²	143	146.1 Å²	146.1	73%	0.733	78%	0.78	S	S	*	*			trans	-142.6	129.4	164.9	-63.9	-174.4	0	0	0	108.8
1305	N	26.3	Very low	31.3	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	78%	0.784	S	S	*	*			trans	-91.2	146.2	167.6	-70.1	-18.8	0	0	0	110.2
1306	S	31.6	Very low	31.2	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	78%	0.778	S	S	*	*			trans	-156.7	116.5	157.9	57.3	0	0	0	0	111.6
1307	N	27.8	Very low	31.2	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	78%	0.776	S	S	*	*			trans	-80.2	147.6	167.3	-61.2	-11.3	0	0	0	110
1308	T	34	Very low	31.1	Very low	140 Å²	140	142.8 Å²	142.8	86%	0.859	78%	0.778	S	S	*	*			trans	-150.9	118.5	152	43.6	0	0	0	0	110.4
1309	D	29.5	Very low	30.9	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	78%	0.779	S	S	*	*			trans	-76.2	155.6	169.7	-53.2	-91.9	0	0	0	112.6
1310	T	33.3	Very low	30.6	Very low	144 Å²	144	141.5 Å²	141.5	88%	0.883	78%	0.777	S	S	*	*			trans	-154.8	141.8	141.6	5	0	0	0	0	112.9
1311	N	27.6	Very low	30.6	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	78%	0.782	S	S	*	*			trans	-105.7	146.6	-178.3	-78.4	-86.1	0	0	0	112.9
1312	Q	33.5	Very low	30.7	Very low	179 Å²	179	142 Å²	142	84%	0.836	78%	0.784	S	S	*	*			trans	-169.5	125.9	143.6	-102	149.4	81.2	0	0	108.7
1313	R	28.1	Very low	30.9	Very low	228 Å²	228	139.7 Å²	139.7	86%	0.86	78%	0.781	S	S	*	*				63.2	135	83.6	-81.7	-176.1	172.9	176	-1.8	112.9
1314	L	32	Very low	31.2	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	78%	0.777	S	S	*	*			cis	-137.7	-175	23.2	-85.6	103.9	0	0	0	114.3
1315	S	26.1	Very low	31	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	78%	0.78	S	S	*	*			trans	-141.2	129.6	-177.2	57.3	0	0	0	0	113.8
1316	S	31.6	Very low	31.3	Very low	107 Å²	107	139.7 Å²	139.7	75%	0.748	78%	0.784	S	S	*	*			trans	-178	113.1	165	47.7	0	0	0	0	107.4
1317	S	29.6	Very low	31.2	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	80%	0.804	S	S	*	*				67.5	119.8	76.6	74.6	0	0	0	0	114.5
1318	D	32.5	Very low	31.4	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	80%	0.803	S	S	*	*			trans	160.1	124.8	136.9	-79	3.8	0	0	0	110.2
1319	I	32.4	Very low	31.3	Very low	147 Å²	147	146.7 Å²	146.7	75%	0.754	80%	0.8	S	S	*	*				69.3	129.3	98.1	-61.4	167.9	0	0	0	113.1
1320	S	29.7	Very low	31.4	Very low	86 Å²	86	146.9 Å²	146.9	60%	0.601	80%	0.802	S	S	*	*			cis	-163.2	-158.5	-14.2	56.4	0	0	0	0	110.3
1321	D	34.7	Very low	31.2	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	80%	0.797	S	S	*	*			trans	76.5	114.6	166	-50.2	-5.3	0	0	0	115.7
1322	V	33.6	Very low	31.5	Very low	127 Å²	127	147.5 Å²	147.5	77%	0.77	80%	0.8	S	S	*	*				67.3	102.1	53.6	-174.7	0	0	0	0	110
1323	D	36.5	Very low	31.3	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	80%	0.798	S	S	*	*				-161.5	171.3	73.9	-110.9	-30.4	0	0	0	110.2
1324	S	33.6	Very low	31.6	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	79%	0.793	S	S	*	*			cis	-164.5	155.3	-24.9	-126.2	0	0	0	0	107.7
1325	C	27.4	Very low	31.5	Very low	119 Å²	119	137.1 Å²	137.1	80%	0.804	79%	0.785	S	S	*	*			trans	-86.4	131.2	-177.1	-69.8	0	0	0	0	113.9
1326	K	31.5	Very low	32	Very low	201 Å²	201	139.1 Å²	139.1	87%	0.874	79%	0.785	S	S	*	*				157.8	120.8	123.5	-86.5	162.6	-177.2	175.5	0	112.8
1327	H	30.5	Very low	32	Very low	259 Å²	259	142 Å²	142	100%	1.199	79%	0.788	S	S	*	*				-150.8	0	106.6	-141.5	-49.8	0	0	0	111.8

Retrieved 1,327 of 1,327 residues in 181.9 ms (Link to these results)

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