A0A077Z873_TRITR Loading...

FLYWCH and MULE domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z873, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 729 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	28.7	Very low	241 Å²	241	134 Å²	134	100%	1.187	82%	0.819	S	S	*	*				0	129.3	0	-89.2	-179.5	162.1	0	0	108.8
2	M	29.5	Very low	28.2	Very low	172 Å²	172	133.3 Å²	133.3	85%	0.847	82%	0.816	S	S	*	*			trans	34.2	124.5	150.5	-62.5	-177.9	173.5	0	0	120.4
3	N	36.5	Very low	28.3	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	82%	0.821	S	S	*	*				178.8	128.5	99.7	-90.7	-28.4	0	0	0	111.9
4	A	27.7	Very low	27.8	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	82%	0.822	S	S	*	*			trans	-76.6	163.8	149	0	0	0	0	0	108.2
5	P	38	Very low	27.8	Very low	117 Å²	117	132.3 Å²	132.3	76%	0.76	82%	0.818	S	S	*	*				-151.7	151.4	73.8	34.2	-11.9	0	0	0	118.1
6	V	27.3	Very low	27.6	Very low	133 Å²	133	130.8 Å²	130.8	81%	0.806	81%	0.814	S	S	*	*				52.4	107.3	127.9	-169.6	0	0	0	0	121.3
7	A	23.1	Very low	27.3	Very low	78 Å²	78	132.8 Å²	132.8	65%	0.645	82%	0.818	S	S	*	*			trans	11.4	133.7	131.7	0	0	0	0	0	121.3
8	N	28.2	Very low	27.3	Very low	166 Å²	166	131.7 Å²	131.7	89%	0.888	82%	0.817	S	S	*	*				-177.3	138.9	115.8	-94.5	-23.4	0	0	0	112.2
9	G	24.5	Very low	27.4	Very low	72 Å²	72	130.5 Å²	130.5	74%	0.742	81%	0.813	S	S	*	*			trans	101.1	83.8	139.6	0	0	0	0	0	118.2
10	T	20.2	Very low	27.4	Very low	136 Å²	136	133.1 Å²	133.1	83%	0.834	82%	0.815	S	S	*	*			trans	-58.3	146.3	152	12.1	0	0	0	0	111.8
11	P	26.1	Very low	27.4	Very low	117 Å²	117	134.9 Å²	134.9	76%	0.76	82%	0.819	S	S	*	*				-127.6	127.6	128.2	32.3	-20.8	0	0	0	111.3
12	T	22.5	Very low	27	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	80%	0.798	S	S	*	*			trans	-65.9	124.2	166.9	43.7	0	0	0	0	110.9
13	H	29.4	Very low	26.8	Very low	192 Å²	192	128.6 Å²	128.6	89%	0.889	80%	0.798	S	S	*	*			trans	-131.7	118.3	150.3	-99	-74	0	0	0	109
14	A	21.7	Very low	26.2	Very low	101 Å²	101	129.1 Å²	129.1	84%	0.835	80%	0.799	S	S	*	*			trans	-77.9	139.7	174.9	0	0	0	0	0	111.2
15	A	27.3	Very low	26.2	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	80%	0.802	S	S	*	*			trans	-169.4	97.3	146.3	0	0	0	0	0	110.9
16	S	25.1	Very low	25.6	Very low	108 Å²	108	127.9 Å²	127.9	76%	0.755	80%	0.799	S	S	*	*			trans	41.5	106.1	137.7	60.3	0	0	0	0	121.4
17	D	22.5	Very low	25.4	Very low	165 Å²	165	127.2 Å²	127.2	88%	0.882	80%	0.799	S	S	*	*				26.6	117.4	117.2	-67	-30	0	0	0	120.1
18	S	27.8	Very low	25.6	Very low	114 Å²	114	129 Å²	129	80%	0.797	81%	0.806	S	S	*	*				-151.8	114.3	121.2	54.2	0	0	0	0	110.1
19	S	28.3	Very low	25.5	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	80%	0.801	S	S	*	*			trans	-66	123.2	-178.8	50.7	0	0	0	0	112.2	L21	S19-L21 PolarHBondContact O-N 3.29Å
20	H	28.8	Very low	25.8	Very low	182 Å²	182	130.5 Å²	130.5	84%	0.843	80%	0.804	S	S	*	*			trans	-64.2	104.8	163.4	-76.5	-76.3	0	0	0	110.4	T22	H20-T22 PolarHBondContact O-N 3.1Å
21	L	26.5	Very low	26.1	Very low	171 Å²	171	131.2 Å²	131.2	90%	0.895	80%	0.802	S	S	*	*			trans	-75.2	101.8	162.9	-85.7	160.3	0	0	0	108.5	S19	S19-L21 PolarHBondContact O-N 3.29Å
22	T	26.9	Very low	26.2	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	81%	0.806	S	S	*	*			trans	-67.9	140.4	174.7	40.3	0	0	0	0	112.5	H20 I24	H20-T22 PolarHBondContact O-N 3.1Å; T22-I24 PolarHBondContact O-N 3.41Å
23	D	23.8	Very low	26.4	Very low	159 Å²	159	131.5 Å²	131.5	85%	0.85	80%	0.804	S	S	*	*			trans	-43.5	121.6	172.6	-72	-50.9	0	0	0	113.8
24	I	25.1	Very low	26.3	Very low	167 Å²	167	128.1 Å²	128.1	86%	0.856	79%	0.792	S	S	*	*			trans	-103.3	87.9	161.2	-58.7	177.7	0	0	0	107.3	T22 G26	T22-I24 PolarHBondContact O-N 3.41Å; I24-G26 PolarHBondContact O-N 3Å
25	S	26.6	Very low	26.7	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	79%	0.791	S	S	*	*			trans	-82.9	79.9	165.1	47.7	0	0	0	0	109.6	S27	S25-S27 PolarHBondContact O-N 3.41Å
26	G	25.6	Very low	26.7	Very low	66 Å²	66	133.3 Å²	133.3	68%	0.68	80%	0.796	S	S	*	*			trans	-74.9	106.9	168	0	0	0	0	0	110.7	I24 C28	I24-G26 PolarHBondContact O-N 3Å; G26-C28 PolarHBondContact O-N 3.2Å
27	S	24.5	Very low	26.8	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	80%	0.795	S	S	*	*			trans	-66.3	113.6	169.3	51.6	0	0	0	0	110.8	S25	S25-S27 PolarHBondContact O-N 3.41Å
28	C	25.4	Very low	27.3	Very low	117 Å²	117	137.2 Å²	137.2	79%	0.791	79%	0.794	S	S	*	*			trans	-100.5	144.2	162.2	-86.7	0	0	0	0	109.7	G26	G26-C28 PolarHBondContact O-N 3.2Å
29	P	27.1	Very low	27.4	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	78%	0.78	S	S	*	*			trans	-74	135.3	-164.4	-9.9	26.7	0	0	0	112.7	D31	P29-D31 PolarHBondContact O-N 2.71Å
30	D	30.3	Very low	27.4	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	78%	0.783	S	S	*	*	S	Bend	trans	-70.1	70.7	170.4	-72.9	-49.4	0	0	0	110.9
31	D	26	Very low	27.5	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	78%	0.778	S	S	*	*			trans	-154.7	74	168.3	-92.6	-38.9	0	0	0	110.5	P29	P29-D31 PolarHBondContact O-N 2.71Å
32	V	28.9	Very low	27.6	Very low	137 Å²	137	134.3 Å²	134.3	83%	0.83	77%	0.774	S	S	*	*			trans	-108	115.1	154.3	-178.5	0	0	0	0	106	D34	V32-D34 PolarHBondContact O-N 3.49Å
33	P	26.2	Very low	27.8	Very low	112 Å²	112	135.7 Å²	135.7	73%	0.727	78%	0.777	S	S	*	*			trans	-58	134	-177.5	-20.2	30.2	0	0	0	110.5	S35	P33-S35 PolarHBondContact O-N 3.4Å
34	D	27.6	Very low	28.1	Very low	120 Å²	120	136.8 Å²	136.8	64%	0.642	77%	0.774	S	S	*	*			trans	-48.2	103.9	166.8	-89.3	-56.6	0	0	0	108.2	V32 E36 R726	V32-D34 PolarHBondContact O-N 3.49Å; D34-E36 PolarHBondContact O-N 2.75Å; D34-R726 IonicContact OD1-NH2 2.81Å; D34-R726 PolarHBondContact OD1-NH2 3.5Å
35	S	30.3	Very low	28.2	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	77%	0.771	S	S	*	*			trans	-66.5	102.5	174.8	59.4	0	0	0	0	108.1	P33	P33-S35 PolarHBondContact O-N 3.4Å
36	E	27.8	Very low	28.3	Very low	183 Å²	183	135.4 Å²	135.4	86%	0.855	77%	0.772	S	S	*	*			trans	-52.6	162.4	159.7	-65	179.4	149.8	0	0	110.3	D34	D34-E36 PolarHBondContact O-N 2.75Å
37	D	27.1	Very low	28.3	Very low	134 Å²	134	137.5 Å²	137.5	72%	0.717	78%	0.777	S	S	*	*			trans	91.7	79.3	168.6	-127.2	-10.4	0	0	0	118.6	G39	D37-G39 WeakPolarHBondContact OD1-CA 3.12Å; D37-G39 PolarHBondContact OD1-N 2.68Å
38	Y	32.9	Very low	28.6	Very low	221 Å²	221	137.2 Å²	137.2	87%	0.867	77%	0.774	S	S	*	*			trans	-102.1	61	145.5	-78.5	-84.1	0	0	0	108.3
39	G	29.3	Very low	28.5	Very low	50 Å²	50	141.4 Å²	141.4	52%	0.515	78%	0.782	S	S	.	*			trans	-95.3	-16.5	173.9	0	0	0	0	0	115.3	D37	D37-G39 WeakPolarHBondContact OD1-CA 3.12Å; D37-G39 PolarHBondContact OD1-N 2.68Å
40	E	29.3	Very low	28.5	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	78%	0.779	S	S	*	*	S	Bend	trans	-110.7	30.4	-166.4	-67.6	-172.2	158.7	0	0	115.7
41	L	30.7	Very low	28.2	Very low	140 Å²	140	138.7 Å²	138.7	73%	0.733	78%	0.78	S	S	*	*	S	Bend	trans	-101.3	-3	173.9	-111.4	126.1	0	0	0	114.6
42	D	28.4	Very low	28.1	Very low	151 Å²	151	137.9 Å²	137.9	81%	0.807	78%	0.78	S	S	*	*	S	Bend	trans	-92.6	-14.2	179.7	-80.1	-17.7	0	0	0	114.2
43	D	31.4	Very low	27.9	Very low	151 Å²	151	140 Å²	140	81%	0.807	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-7.6	-176.3	-85.2	-5.4	0	0	0	115.1
44	F	30.3	Very low	27.7	Very low	181 Å²	181	140.7 Å²	140.7	79%	0.794	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	3.9	-174	-140.4	-92.3	0	0	0	115.4
45	L	27.5	Very low	27.8	Very low	154 Å²	154	141.4 Å²	141.4	81%	0.806	79%	0.792	S	S	*	*			trans	-120.4	15.7	-179.2	-67.4	176.6	0	0	0	114.3	S47	L45-S47 PolarHBondContact O-N 2.71Å
46	A	27.2	Very low	27.5	Very low	97 Å²	97	144.1 Å²	144.1	80%	0.802	79%	0.791	S	S	*	*			trans	-77.8	65.6	168.6	0	0	0	0	0	111.4
47	S	26.1	Very low	27.3	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	79%	0.792	S	S	*	*			trans	-161.8	70.4	163.7	62.5	0	0	0	0	110.6	L45	L45-S47 PolarHBondContact O-N 2.71Å
48	S	30.1	Very low	27.1	Very low	111 Å²	111	147.7 Å²	147.7	78%	0.776	80%	0.803	S	S	*	*			trans	-146.7	100.5	154.8	62.6	0	0	0	0	107.5	A50	S48-A50 PolarHBondContact O-N 3.15Å
49	E	24.1	Very low	26.8	Very low	205 Å²	205	141.6 Å²	141.6	96%	0.958	80%	0.799	S	S	*	*			trans	-58.5	115.5	176.3	-65.9	172.3	159.1	0	0	109.2
50	A	26.2	Very low	26.6	Very low	84 Å²	84	143.7 Å²	143.7	69%	0.694	81%	0.811	S	S	*	*			trans	-92.2	144.6	164.4	0	0	0	0	0	108.6	S48	S48-A50 PolarHBondContact O-N 3.15Å
51	P	24.9	Very low	26.4	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	81%	0.81	S	S	*	*			trans	-71.3	137.9	-167.1	2.5	10.3	0	0	0	111.8	E53	P51-E53 PolarHBondContact O-N 3.38Å
52	V	24.1	Very low	26.1	Very low	133 Å²	133	141 Å²	141	81%	0.806	81%	0.813	S	S	*	*			trans	-70	102.7	174.9	178.5	0	0	0	0	108.9
53	E	24.7	Very low	26.1	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	81%	0.814	S	S	*	*			trans	-88.4	111.6	160.4	-90.9	-172.1	166.2	0	0	109.9	P51 V55	P51-E53 PolarHBondContact O-N 3.38Å; E53-V55 PolarHBondContact O-N 2.95Å
54	T	22.6	Very low	26	Very low	125 Å²	125	141.1 Å²	141.1	77%	0.767	82%	0.817	S	S	*	*			trans	-70.3	98.1	-178.8	-42.4	0	0	0	0	110.6
55	V	28.4	Very low	26.2	Very low	135 Å²	135	143 Å²	143	82%	0.818	82%	0.819	S	S	*	*			trans	-93.1	118.1	167.4	179.9	0	0	0	0	109.7	E53	E53-V55 PolarHBondContact O-N 2.95Å
56	Q	24.3	Very low	26.9	Very low	175 Å²	175	143.4 Å²	143.4	82%	0.818	82%	0.816	S	S	*	*			trans	-57.2	131	-175.2	-67.1	170.2	-11.6	0	0	113.2	R58	Q56-R58 PolarHBondContact O-N 3.41Å
57	T	23.1	Very low	27.9	Very low	143 Å²	143	143.5 Å²	143.5	88%	0.877	81%	0.811	S	S	*	*			trans	-60.6	112.8	168.2	42.9	0	0	0	0	111.1
58	R	24.4	Very low	29.5	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90.2	130.8	160.2	-92.1	-176.5	164.4	173.1	-3.7	109.9	Q56	Q56-R58 PolarHBondContact O-N 3.41Å
59	A	25	Very low	31.3	Very low	94 Å²	94	139.9 Å²	139.9	78%	0.777	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-55.9	143.6	-167.6	0	0	0	0	0	114.4	T61	A59-T61 PolarHBondContact O-N 2.93Å
60	A	25	Very low	33.3	Very low	93 Å²	93	135.7 Å²	135.7	77%	0.769	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-60.9	116.8	170.9	0	0	0	0	0	111	T62	A60-T62 PolarHBondContact O-N 3.3Å
61	T	25.3	Very low	35.7	Very low	131 Å²	131	135.4 Å²	135.4	80%	0.804	75%	0.746	S	S	*	*			trans	-78.1	101	160.8	-51.8	0	0	0	0	108.1	A59 Q63	A59-T61 PolarHBondContact O-N 2.93Å; T61-Q63 PolarHBondContact O-N 3.1Å
62	T	24.5	Very low	38.6	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	71%	0.707	S	S	*	*			trans	-59.9	108.9	168.7	-41.2	0	0	0	0	109.5	A60	A60-T62 PolarHBondContact O-N 3.3Å
63	Q	28.2	Very low	41.6	Very low	180 Å²	180	126 Å²	126	84%	0.841	68%	0.681	S	S	*	*			trans	-156.1	118.7	158.1	-110	170.3	50.7	0	0	112.9	T61	T61-Q63 PolarHBondContact O-N 3.1Å
64	S	30.1	Very low	44.6	Very low	124 Å²	124	120.4 Å²	120.4	87%	0.867	66%	0.656	S	S	*	*			trans	78.5	131.3	153.8	-156.6	0	0	0	0	120.6
65	R	34.7	Very low	47.7	Very low	219 Å²	219	115.3 Å²	115.3	83%	0.826	62%	0.624	S	S	*	*			trans	-73.2	130.3	-174	-73.7	166	166.1	176.3	-4.5	112.2	S67	R65-S67 PolarHBondContact O-N 3.38Å
66	H	42	Very low	50.3	Low	163 Å²	163	115.5 Å²	115.5	76%	0.755	61%	0.613	S	S	*	*			trans	40	70.8	142.8	-52.8	-56.3	0	0	0	119.2
67	S	49.4	Very low	52.8	Low	100 Å²	100	108.6 Å²	108.6	70%	0.699	58%	0.583	S	S	*	*			trans	-144	143.5	149.5	61.1	0	0	0	0	109.7	R65	R65-S67 PolarHBondContact O-N 3.38Å
68	R	59.2	Low	54.7	Low	109 Å²	109	108.4 Å²	108.4	41%	0.411	57%	0.572	S	S	.	*			trans	-62	133.4	177.9	174.8	-180	-78.7	165.1	1.9	108.6	L72 N122 A123 R124	R68-L72 WeakPolarHBondContact CD-O 3.29Å; R68-L72 HydrophobicContact CG-CB 4.28Å; R68-L72 HydrophobicContact CG-CD2 4.39Å; R68-N122 PolarHBondContact NH2-O 3.47Å; R68-A123 PolarHBondContact NE-O 3.48Å; R68-R124 WeakPolarHBondContact CA-O 3.31Å
69	P	67.2	Low	56.9	Low	36 Å²	36	107.3 Å²	107.3	23%	0.234	57%	0.568	C	S	.	*			trans	-56.6	132.5	174.4	16.3	-25.6	0	0	0	109.8	D71 L72 F86 R124 V126	P69-D71 PolarHBondContact O-N 3.35Å; P69-D71 VanDerWaalsContact O-N 3.07Å; P69-L72 HydrophobicContact CG-CB 3.98Å; P69-L72 HydrophobicContact CG-CD1 4.32Å; P69-L72 PolarHBondContact O-N 3.04Å; P69-F86 HydrophobicContact CB-CE2 4.34Å; P69-F86 HydrophobicContact CG-CE2 4.38Å; P69-R124 WeakPolarHBondContact CD-O 3.47Å; P69-V126 HydrophobicContact CG-CG2 4.01Å
70	P	66.1	Low	59.2	Low	117 Å²	117	105 Å²	105	76%	0.76	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-28.3	-169.9	20.3	-31.9	0	0	0	113.4	L72	P70-L72 VanDerWaalsContact C-N 3.31Å; P70-L72 PolarHBondContact O-N 3.31Å
71	D	76.7	Confident	61.9	Low	78 Å²	78	105.3 Å²	105.3	42%	0.417	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	3.8	-178.4	-51.5	-23.6	0	0	0	113.8	P69 F86	P69-D71 PolarHBondContact O-N 3.35Å; P69-D71 VanDerWaalsContact O-N 3.07Å; D71-F86 HydrophobicContact CB-CD2 4.41Å; D71-F86 HydrophobicContact CB-CE2 4.44Å; D71-F86 WeakPolarHBondContact O-CA 3.42Å
72	L	86.5	Confident	64.8	Low	4 Å²	4	103 Å²	103	2%	0.021	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.1	179.4	-167.2	153.5	0	0	0	110.8	R68 P69 P70 I74 I84 V85 F86 T119 A123 V126	R68-L72 WeakPolarHBondContact CD-O 3.29Å; R68-L72 HydrophobicContact CG-CB 4.28Å; R68-L72 HydrophobicContact CG-CD2 4.39Å; P69-L72 HydrophobicContact CG-CB 3.98Å; P69-L72 HydrophobicContact CG-CD1 4.32Å; P69-L72 PolarHBondContact O-N 3.04Å; P70-L72 VanDerWaalsContact C-N 3.31Å; P70-L72 PolarHBondContact O-N 3.31Å; L72-I74 HydrophobicContact CD2-CG1 4.09Å; L72-I84 HydrophobicContact CD1-CG2 4.18Å; L72-I84 HydrophobicContact CD2-CG2 4.05Å; L72-I84 HydrophobicContact CG-CG2 3.8Å; L72-V85 WeakPolarHBondContact CA-O 3.46Å; L72-F86 HydrophobicContact CB-CD2 3.84Å; L72-F86 HydrophobicContact CB-CE2 4.45Å; L72-F86 HydrophobicContact CD1-CD2 4.26Å; L72-F86 HydrophobicContact CG-CD2 4.29Å; L72-T119 HydrophobicContact CD1-CG2 4.41Å; L72-A123 HydrophobicContact CD1-CB 4.44Å; L72-A123 HydrophobicContact CD2-CB 3.91Å; L72-A123 WeakPolarHBondContact CD2-O 3.49Å; L72-V126 HydrophobicContact CD1-CG2 3.48Å; L72-V126 VanDerWaalsContact CD1-CG2 3.48Å
73	K	86.3	Confident	67.8	Low	59 Å²	59	97 Å²	97	26%	0.257	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.8	176.6	-68.2	179.5	-178.6	167.7	0	111.6	F75 I84 V85 E141 E145	K73-F75 HydrophobicContact CB-CD2 4.42Å; K73-F75 HydrophobicContact CB-CE2 3.54Å; K73-F75 HydrophobicContact CB-CZ 3.83Å; K73-F75 HydrophobicContact CD-CZ 4.22Å; K73-I84 CarbonylContact O-C 3.58Å; K73-I84 WeakPolarHBondContact O-CA 3.35Å; K73-V85 PolarHBondContact N-O 3.47Å; K73-V85 PolarHBondContact O-N 3.24Å; K73-E141 HydrophobicContact CD-CB 4.34Å; K73-E141 HydrophobicContact CD-CG 4.21Å; K73-E141 VanDerWaalsContact CE-OE2 3.27Å; K73-E141 WeakPolarHBondContact CE-OE2 3.36Å; K73-E141 IonicContact NZ-OE2 3.54Å; K73-E141 PolarHBondContact NZ-OE2 3.23Å; K73-E145 WeakPolarHBondContact CD-OE1 3.4Å; K73-E145 VanDerWaalsContact CE-OE1 3.31Å; K73-E145 WeakPolarHBondContact CE-OE1 3.4Å; K73-E145 IonicContact NZ-OE1 3.74Å; K73-E145 PolarHBondContact NZ-OE1 2.75Å
74	I	87.8	Confident	70.8	Confident	66 Å²	66	88.5 Å²	88.5	34%	0.338	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.1	179.8	-53.1	178.4	0	0	0	109.3	L72 L83 I84 A123	L72-I74 HydrophobicContact CD2-CG1 4.09Å; I74-L83 CarbonylContact C-O 3.59Å; I74-L83 WeakPolarHBondContact CA-O 3.42Å; I74-I84 HydrophobicContact CG1-CG1 4.32Å; I74-A123 HydrophobicContact CD1-CB 3.97Å; I74-A123 HydrophobicContact CG1-CB 4.47Å
75	F	88.1	Confident	73.6	Confident	19 Å²	19	82.6 Å²	82.6	8%	0.083	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	171.9	177.4	-58.8	-81.5	0	0	0	111	K73 L83 V85 H144 E145	K73-F75 HydrophobicContact CB-CD2 4.42Å; K73-F75 HydrophobicContact CB-CE2 3.54Å; K73-F75 HydrophobicContact CB-CZ 3.83Å; K73-F75 HydrophobicContact CD-CZ 4.22Å; F75-L83 HydrophobicContact CB-CD2 3.99Å; F75-L83 HydrophobicContact CD2-CD2 3.99Å; F75-L83 HydrophobicContact CG-CD2 4.43Å; F75-L83 PolarHBondContact N-O 2.64Å; F75-L83 PolarHBondContact O-N 3.46Å; F75-V85 HydrophobicContact CD2-CB 4.36Å; F75-V85 HydrophobicContact CD2-CG2 3.71Å; F75-V85 HydrophobicContact CE2-CB 3.94Å; F75-V85 HydrophobicContact CE2-CG2 3.58Å; F75-H144 HydrophobicContact CD1-CB 3.74Å; F75-H144 HydrophobicContact CD2-CB 3.75Å; F75-H144 HydrophobicContact CE1-CB 3.68Å; F75-H144 HydrophobicContact CE2-CB 3.67Å; F75-H144 HydrophobicContact CG-CB 3.77Å; F75-H144 HydrophobicContact CZ-CB 3.63Å; F75-E145 HydrophobicContact CE1-CB 4.42Å; F75-E145 HydrophobicContact CE1-CG 3.7Å; F75-E145 HydrophobicContact CZ-CG 3.82Å
76	K	82.3	Confident	76.3	Confident	139 Å²	139	72.6 Å²	72.6	60%	0.604	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.5	172.3	-67.4	-175.2	178.6	-177.5	0	111.9	N81 R151	K76-N81 CarbonylContact C-O 3.59Å; K76-N81 WeakPolarHBondContact CA-O 3.25Å; K76-R151 PolarHBondContact O-NH1 3.46Å
77	T	77.8	Confident	78.4	Confident	30 Å²	30	72.3 Å²	72.3	18%	0.184	36%	0.359	C	S	.	.			trans	-70.6	170.4	174.1	69.7	0	0	0	0	111.6	R79 G80 N81 L83	T77-R79 PolarHBondContact O-N 3.23Å; T77-R79 PolarHBondContact OG1-N 2.65Å; T77-G80 PolarHBondContact O-N 3.14Å; T77-N81 HydrophobicContact CG2-CB 4.27Å; T77-N81 WeakPolarHBondContact CG2-O 3.35Å; T77-N81 PolarHBondContact N-O 3.43Å; T77-N81 WeakPolarHBondContact OG1-CB 3.47Å; T77-N81 PolarHBondContact OG1-N 2.9Å; T77-N81 PolarHBondContact OG1-O 2.9Å; T77-L83 HydrophobicContact CG2-CB 4.15Å; T77-L83 HydrophobicContact CG2-CD1 4.21Å
78	Q	62.3	Low	80.1	Confident	138 Å²	138	68.2 Å²	68.2	65%	0.645	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.3	176	-66	-177.4	3	0	0	113.4	G80 R151	Q78-G80 VanDerWaalsContact C-N 3.32Å; Q78-R151 VanDerWaalsContact CG-NH2 3.34Å
79	R	70.1	Confident	81.6	Confident	226 Å²	226	64.5 Å²	64.5	85%	0.853	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	1.5	176.2	-65.3	-174.7	179.6	-175.4	-0.8	112.8	T77 N81	T77-R79 PolarHBondContact O-N 3.23Å; T77-R79 PolarHBondContact OG1-N 2.65Å; R79-N81 VanDerWaalsContact C-N 3.33Å
80	G	72.8	Confident	82.7	Confident	45 Å²	45	63.7 Å²	63.7	46%	0.464	31%	0.313	S	S	.	.	S	Bend	trans	88	-8.5	-177.2	0	0	0	0	0	114.9	T77 Q78	T77-G80 PolarHBondContact O-N 3.14Å; Q78-G80 VanDerWaalsContact C-N 3.32Å
81	N	82.3	Confident	83.8	Confident	101 Å²	101	58.1 Å²	58.1	54%	0.54	28%	0.277	S	S	.	.			trans	-64.5	147	179.1	-54.5	-11.9	0	0	0	111.7	K76 T77 R79	K76-N81 CarbonylContact C-O 3.59Å; K76-N81 WeakPolarHBondContact CA-O 3.25Å; T77-N81 HydrophobicContact CG2-CB 4.27Å; T77-N81 WeakPolarHBondContact CG2-O 3.35Å; T77-N81 PolarHBondContact N-O 3.43Å; T77-N81 WeakPolarHBondContact OG1-CB 3.47Å; T77-N81 PolarHBondContact OG1-N 2.9Å; T77-N81 PolarHBondContact OG1-O 2.9Å; R79-N81 VanDerWaalsContact C-N 3.33Å
82	E	85.6	Confident	84.5	Confident	83 Å²	83	56.6 Å²	56.6	39%	0.388	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	140.9	176.3	-61.4	179.2	142.8	0	0	111.7	K93 W105	E82-K93 IonicContact OE2-NZ 3.31Å; E82-W105 HydrophobicContact CB-CH2 4Å; E82-W105 HydrophobicContact CB-CZ3 3.98Å
83	L	88.7	Confident	84.6	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.6	177.4	177.7	144.4	0	0	0	108.9	I74 F75 T77 V85 D90 Y91 V92 H144	I74-L83 CarbonylContact C-O 3.59Å; I74-L83 WeakPolarHBondContact CA-O 3.42Å; F75-L83 HydrophobicContact CB-CD2 3.99Å; F75-L83 HydrophobicContact CD2-CD2 3.99Å; F75-L83 HydrophobicContact CG-CD2 4.43Å; F75-L83 PolarHBondContact N-O 2.64Å; F75-L83 PolarHBondContact O-N 3.46Å; T77-L83 HydrophobicContact CG2-CB 4.15Å; T77-L83 HydrophobicContact CG2-CD1 4.21Å; L83-V85 HydrophobicContact CD2-CG2 3.8Å; L83-D90 HydrophobicContact CD1-CB 4.31Å; L83-D90 HydrophobicContact CD2-CB 4.16Å; L83-D90 HydrophobicContact CG-CB 4.38Å; L83-Y91 WeakPolarHBondContact CA-O 3.24Å; L83-V92 HydrophobicContact CD1-CG1 4.46Å; L83-H144 VanDerWaalsContact CD2-CE1 3.46Å; L83-H144 WeakPolarHBondContact CD2-CE1 3.34Å
84	I	90.8	Very high	84.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135	175.3	-67.5	-174.4	0	0	0	108.9	L72 K73 I74 F86 D90 Y91 W105 L117 T119 A123	L72-I84 HydrophobicContact CD1-CG2 4.18Å; L72-I84 HydrophobicContact CD2-CG2 4.05Å; L72-I84 HydrophobicContact CG-CG2 3.8Å; K73-I84 CarbonylContact O-C 3.58Å; K73-I84 WeakPolarHBondContact O-CA 3.35Å; I74-I84 HydrophobicContact CG1-CG1 4.32Å; I84-F86 HydrophobicContact CG2-CB 4.28Å; I84-D90 CarbonylContact O-C 3.57Å; I84-D90 WeakPolarHBondContact O-CA 3.41Å; I84-Y91 PolarHBondContact N-O 3.16Å; I84-Y91 PolarHBondContact O-N 2.93Å; I84-W105 HydrophobicContact CB-CE3 4.41Å; I84-W105 HydrophobicContact CD1-CD2 3.7Å; I84-W105 HydrophobicContact CD1-CE3 3.97Å; I84-W105 HydrophobicContact CD1-CG 4.41Å; I84-W105 HydrophobicContact CD1-CH2 3.7Å; I84-W105 HydrophobicContact CD1-CZ2 3.36Å; I84-W105 HydrophobicContact CD1-CZ3 3.98Å; I84-W105 HydrophobicContact CG1-CD2 4.16Å; I84-W105 HydrophobicContact CG1-CE3 3.93Å; I84-W105 HydrophobicContact CG1-CH2 3.89Å; I84-W105 HydrophobicContact CG1-CZ2 4.08Å; I84-W105 HydrophobicContact CG1-CZ3 3.79Å; I84-L117 HydrophobicContact CG2-CD2 4Å; I84-T119 HydrophobicContact CD1-CG2 4.41Å; I84-A123 HydrophobicContact CD1-CB 3.53Å
85	V	89.6	Confident	84.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.1	164	179.5	0	0	0	0	108	L72 K73 F75 L83 F89 D90 V140 E141	L72-V85 WeakPolarHBondContact CA-O 3.46Å; K73-V85 PolarHBondContact N-O 3.47Å; K73-V85 PolarHBondContact O-N 3.24Å; F75-V85 HydrophobicContact CD2-CB 4.36Å; F75-V85 HydrophobicContact CD2-CG2 3.71Å; F75-V85 HydrophobicContact CE2-CB 3.94Å; F75-V85 HydrophobicContact CE2-CG2 3.58Å; L83-V85 HydrophobicContact CD2-CG2 3.8Å; V85-F89 CarbonylContact C-O 3.57Å; V85-F89 VanDerWaalsContact CA-O 3.28Å; V85-F89 WeakPolarHBondContact CA-O 3.19Å; V85-D90 HydrophobicContact CG2-CB 4.19Å; V85-V140 HydrophobicContact CG1-CG1 3.63Å; V85-E141 HydrophobicContact CB-CG 4.31Å; V85-E141 HydrophobicContact CG1-CG 3.46Å; V85-E141 VanDerWaalsContact CG1-CG 3.46Å
86	F	90.2	Very high	84.1	Confident	9 Å²	9	68.7 Å²	68.7	4%	0.039	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	126.4	177.4	-178.4	-114.9	0	0	0	109.9	P69 D71 L72 I84 G88 F89 Y91 L117 V126	P69-F86 HydrophobicContact CB-CE2 4.34Å; P69-F86 HydrophobicContact CG-CE2 4.38Å; D71-F86 HydrophobicContact CB-CD2 4.41Å; D71-F86 HydrophobicContact CB-CE2 4.44Å; D71-F86 WeakPolarHBondContact O-CA 3.42Å; L72-F86 HydrophobicContact CB-CD2 3.84Å; L72-F86 HydrophobicContact CB-CE2 4.45Å; L72-F86 HydrophobicContact CD1-CD2 4.26Å; L72-F86 HydrophobicContact CG-CD2 4.29Å; I84-F86 HydrophobicContact CG2-CB 4.28Å; F86-G88 PolarHBondContact O-N 3.27Å; F86-G88 VanDerWaalsContact O-N 3.16Å; F86-F89 PolarHBondContact N-O 3.43Å; F86-F89 PolarHBondContact O-N 3.04Å; F86-Y91 HydrophobicContact CB-CE2 4.1Å; F86-L117 HydrophobicContact CB-CD2 4.15Å; F86-L117 HydrophobicContact CD1-CD1 3.61Å; F86-L117 HydrophobicContact CD1-CD2 4.42Å; F86-L117 HydrophobicContact CE1-CD1 3.98Å; F86-L117 HydrophobicContact CG-CD1 4.39Å; F86-L117 HydrophobicContact CG-CD2 4.45Å; F86-V126 HydrophobicContact CE1-CG1 4.28Å; F86-V126 HydrophobicContact CE1-CG2 4.46Å; F86-V126 HydrophobicContact CE2-CG2 4.18Å; F86-V126 HydrophobicContact CZ-CG1 4.46Å; F86-V126 HydrophobicContact CZ-CG2 4.13Å
87	R	85.8	Confident	83.8	Confident	158 Å²	158	66.1 Å²	66.1	60%	0.596	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	38.5	178.7	-63.2	-178.1	173.2	179	-1.5	114.3	F89	R87-F89 WeakPolarHBondContact O-CD2 3.49Å
88	G	85.6	Confident	83.4	Confident	13 Å²	13	71 Å²	71	13%	0.134	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	7.1	178.5	0	0	0	0	0	115.9	F86 V137 V140	F86-G88 PolarHBondContact O-N 3.27Å; F86-G88 VanDerWaalsContact O-N 3.16Å; G88-V137 PolarHBondContact O-N 2.79Å; G88-V140 WeakPolarHBondContact O-CG1 3.33Å
89	F	90.6	Very high	83.7	Confident	31 Å²	31	67.8 Å²	67.8	14%	0.136	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.6	175.3	-61	-77.6	0	0	0	111.2	V85 F86 R87 Y91 H132 H134 P136	V85-F89 CarbonylContact C-O 3.57Å; V85-F89 VanDerWaalsContact CA-O 3.28Å; V85-F89 WeakPolarHBondContact CA-O 3.19Å; F86-F89 PolarHBondContact N-O 3.43Å; F86-F89 PolarHBondContact O-N 3.04Å; R87-F89 WeakPolarHBondContact O-CD2 3.49Å; F89-Y91 HydrophobicContact CB-CD2 4.5Å; F89-Y91 HydrophobicContact CB-CE2 3.67Å; F89-H132 HydrophobicContact CD1-CB 4.29Å; F89-H132 AromaticContact CD1-CE1 3.61Å; F89-H132 AromaticContact CD1-CG 3.68Å; F89-H132 AromaticContact CD1-ND1 3.41Å; F89-H132 WeakPolarHBondContact CD1-ND1 3.28Å; F89-H132 HydrophobicContact CE1-CB 3.68Å; F89-H132 AromaticContact CE1-CG 3.57Å; F89-H132 AromaticContact CE1-ND1 3.73Å; F89-H132 AromaticContact CG-CE1 3.72Å; F89-H132 AromaticContact CG-ND1 3.99Å; F89-H132 AromaticContact CG-NE2 3.82Å; F89-H132 HydrophobicContact CZ-CB 3.97Å; F89-H132 AromaticContact CZ-CG 3.98Å; F89-H134 AromaticContact CD1-CE1 3.53Å; F89-H134 AromaticContact CE1-CE1 3.6Å; F89-H134 AromaticContact CE1-ND1 3.79Å; F89-H134 WeakPolarHBondContact CE1-O 3.29Å; F89-P136 HydrophobicContact CE1-CB 4.26Å; F89-P136 HydrophobicContact CE1-CG 4.25Å; F89-P136 HydrophobicContact CE2-CB 4.06Å; F89-P136 HydrophobicContact CE2-CG 3.74Å; F89-P136 HydrophobicContact CZ-CB 3.91Å; F89-P136 HydrophobicContact CZ-CG 3.5Å
90	D	89.7	Confident	83.6	Confident	19 Å²	19	63.3 Å²	63.3	10%	0.102	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	133	171.7	72.4	-22.8	0	0	0	112.5	L83 I84 V85 R108 H144	L83-D90 HydrophobicContact CD1-CB 4.31Å; L83-D90 HydrophobicContact CD2-CB 4.16Å; L83-D90 HydrophobicContact CG-CB 4.38Å; I84-D90 CarbonylContact O-C 3.57Å; I84-D90 WeakPolarHBondContact O-CA 3.41Å; V85-D90 HydrophobicContact CG2-CB 4.19Å; D90-R108 PolarHBondContact O-N 3.3Å; D90-R108 WeakPolarHBondContact OD1-CB 3.32Å; D90-R108 WeakPolarHBondContact OD2-CD 3.34Å; D90-R108 IonicContact OD2-CZ 3.39Å; D90-R108 IonicContact OD2-NE 3.42Å; D90-R108 IonicContact OD2-NH1 2.65Å; D90-R108 PolarHBondContact OD2-NH1 3.08Å; D90-H144 IonicContact OD2-NE2 2.73Å
91	Y	91.3	Very high	83.7	Confident	1 Å²	1	68.6 Å²	68.6	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.8	-176.9	-55	-97	0	0	0	110.9	L83 I84 F86 F89 W105 R106 L117 H132	L83-Y91 WeakPolarHBondContact CA-O 3.24Å; I84-Y91 PolarHBondContact N-O 3.16Å; I84-Y91 PolarHBondContact O-N 2.93Å; F86-Y91 HydrophobicContact CB-CE2 4.1Å; F89-Y91 HydrophobicContact CB-CD2 4.5Å; F89-Y91 HydrophobicContact CB-CE2 3.67Å; Y91-W105 HydrophobicContact CD1-CB 4.48Å; Y91-W105 HydrophobicContact CG-CB 4.33Å; Y91-R106 CarbonylContact C-O 3.59Å; Y91-R106 VanDerWaalsContact CA-O 3.28Å; Y91-R106 WeakPolarHBondContact CA-O 3.47Å; Y91-L117 HydrophobicContact CD1-CB 3.84Å; Y91-L117 HydrophobicContact CD2-CB 4.36Å; Y91-L117 HydrophobicContact CD2-CD2 4.16Å; Y91-L117 HydrophobicContact CE1-CB 3.84Å; Y91-L117 HydrophobicContact CE2-CB 4.33Å; Y91-L117 HydrophobicContact CE2-CD2 4.26Å; Y91-L117 HydrophobicContact CG-CB 4.12Å; Y91-H132 AromaticContact CE1-CE1 3.64Å; Y91-H132 AromaticContact CE1-NE2 3.37Å; Y91-H132 WeakPolarHBondContact CE1-NE2 3.48Å; Y91-H132 AromaticContact CZ-CE1 3.78Å; Y91-H132 AromaticContact CZ-NE2 3.33Å; Y91-H132 VanDerWaalsContact CZ-NE2 3.33Å; Y91-H132 PolarHBondContact OH-NE2 2.81Å
92	V	89.4	Confident	83.9	Confident	46 Å²	46	64.9 Å²	64.9	28%	0.279	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.1	172.8	-67.3	0	0	0	0	110	L83 H94 W105 R106 R108	L83-V92 HydrophobicContact CD1-CG1 4.46Å; V92-H94 PolarHBondContact O-N 3.19Å; V92-W105 CarbonylContact O-C 3.6Å; V92-W105 WeakPolarHBondContact O-CA 3.3Å; V92-R106 PolarHBondContact N-O 3.14Å; V92-R106 PolarHBondContact O-N 3.46Å; V92-R108 HydrophobicContact CG1-CG 4.22Å
93	K	88.5	Confident	84.1	Confident	85 Å²	85	61 Å²	61	37%	0.37	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	125.9	178.5	-170.4	171.7	-177.9	174.8	0	110.1	E82 E96 V103 W105	E82-K93 IonicContact OE2-NZ 3.31Å; K93-E96 WeakPolarHBondContact CE-OE2 3.17Å; K93-E96 IonicContact NZ-OE2 3.7Å; K93-E96 PolarHBondContact NZ-OE2 3.19Å; K93-V103 HydrophobicContact CD-CG1 4.27Å; K93-V103 HydrophobicContact CG-CG1 3.92Å; K93-W105 HydrophobicContact CB-CE3 3.93Å; K93-W105 HydrophobicContact CB-CH2 4.29Å; K93-W105 HydrophobicContact CB-CZ3 3.74Å; K93-W105 HydrophobicContact CG-CZ3 4.45Å
94	H	86.5	Confident	84.1	Confident	81 Å²	81	62 Å²	62	38%	0.375	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-51.2	-177.7	-179.2	-125.9	0	0	0	111.7	V92 V104 R106	V92-H94 PolarHBondContact O-N 3.19Å; H94-V104 WeakPolarHBondContact CA-O 3.4Å; H94-V104 WeakPolarHBondContact CB-O 3.45Å; H94-V104 PolarHBondContact N-O 2.88Å; H94-R106 HydrophobicContact CB-CB 3.92Å
95	R	84.6	Confident	84.2	Confident	176 Å²	176	62.3 Å²	62.3	66%	0.664	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	147.2	178.5	-64.7	-178.2	-175.9	-178.5	-2.3	110.2	V104	R95-V104 HydrophobicContact CB-CB 4.38Å; R95-V104 PolarHBondContact N-O 3.45Å; R95-V104 VanDerWaalsContact N-O 3.11Å; R95-V104 PolarHBondContact O-N 3.29Å
96	E	81.7	Confident	84.3	Confident	59 Å²	59	65.8 Å²	65.8	28%	0.276	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.6	171.4	175.9	173.1	-169.6	0	0	107.1	K93 V103 R121	K93-E96 WeakPolarHBondContact CE-OE2 3.17Å; K93-E96 IonicContact NZ-OE2 3.7Å; K93-E96 PolarHBondContact NZ-OE2 3.19Å; E96-V103 HydrophobicContact CB-CG2 4.43Å; E96-V103 HydrophobicContact CG-CG2 4.06Å; E96-R121 IonicContact OE1-CZ 2.74Å; E96-R121 IonicContact OE1-NE 2.62Å; E96-R121 PolarHBondContact OE1-NE 2.83Å; E96-R121 IonicContact OE1-NH2 3.5Å; E96-R121 PolarHBondContact OE1-NH2 2.9Å
97	N	76	Confident	84.3	Confident	85 Å²	85	65.5 Å²	65.5	46%	0.455	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.9	179.5	-160	4.5	0	0	0	108.4	G99 E100 K101 V102	N97-G99 PolarHBondContact O-N 3.5Å; N97-E100 PolarHBondContact ND2-OE2 3.2Å; N97-E100 VanDerWaalsContact ND2-OE2 3.17Å; N97-E100 PolarHBondContact O-N 3.07Å; N97-K101 PolarHBondContact O-N 2.95Å; N97-V102 PolarHBondContact N-O 2.79Å; N97-V102 VanDerWaalsContact N-O 3.09Å
98	N	70.1	Confident	84.3	Confident	133 Å²	133	64.4 Å²	64.4	71%	0.711	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.3	-173.4	-75.2	-16.3	0	0	0	112.9
99	G	68.1	Low	84	Confident	70 Å²	70	67.1 Å²	67.1	72%	0.722	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-45.9	-179.2	0	0	0	0	0	114.2	N97	N97-G99 PolarHBondContact O-N 3.5Å
100	E	66.8	Low	83	Confident	132 Å²	132	67.1 Å²	67.1	62%	0.617	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-4.4	-171.6	-65.6	177.9	146	0	0	114	N97 V102	N97-E100 PolarHBondContact ND2-OE2 3.2Å; N97-E100 VanDerWaalsContact ND2-OE2 3.17Å; N97-E100 PolarHBondContact O-N 3.07Å; E100-V102 HydrophobicContact CB-CB 4.42Å; E100-V102 HydrophobicContact CB-CG2 3.97Å; E100-V102 PolarHBondContact O-N 2.98Å
101	K	76.5	Confident	82.1	Confident	156 Å²	156	74.9 Å²	74.9	68%	0.678	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	27.6	-173.3	-56.2	178	-179	174.1	0	113.3	N97 R121	N97-K101 PolarHBondContact O-N 2.95Å; K101-R121 PolarHBondContact O-N 3.46Å
102	V	86	Confident	81.4	Confident	23 Å²	23	81.7 Å²	81.7	14%	0.139	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133	178.1	-179.4	0	0	0	0	110.1	N97 E100 R118 T119 F127	N97-V102 PolarHBondContact N-O 2.79Å; N97-V102 VanDerWaalsContact N-O 3.09Å; E100-V102 HydrophobicContact CB-CB 4.42Å; E100-V102 HydrophobicContact CB-CG2 3.97Å; E100-V102 PolarHBondContact O-N 2.98Å; V102-R118 HydrophobicContact CG1-CB 4.13Å; V102-T119 WeakPolarHBondContact CA-O 3.4Å; V102-F127 HydrophobicContact CB-CE2 4.48Å; V102-F127 HydrophobicContact CG1-CD2 4.13Å; V102-F127 HydrophobicContact CG1-CE2 4.46Å; V102-F127 HydrophobicContact CG2-CD2 4.03Å; V102-F127 HydrophobicContact CG2-CE2 3.8Å
103	V	89.3	Confident	81.1	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.006	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.4	170.8	-173.9	0	0	0	0	108.8	K93 E96 W105 R118 T119 R121	K93-V103 HydrophobicContact CD-CG1 4.27Å; K93-V103 HydrophobicContact CG-CG1 3.92Å; E96-V103 HydrophobicContact CB-CG2 4.43Å; E96-V103 HydrophobicContact CG-CG2 4.06Å; V103-W105 HydrophobicContact CB-CZ2 4.22Å; V103-W105 HydrophobicContact CG1-CD2 4.18Å; V103-W105 VanDerWaalsContact CG1-CE2 3.44Å; V103-W105 HydrophobicContact CG1-CH2 4.44Å; V103-W105 HydrophobicContact CG1-CZ2 3.59Å; V103-W105 PolarHBondContact O-NE1 3.33Å; V103-R118 WeakPolarHBondContact O-CA 3.1Å; V103-T119 PolarHBondContact N-O 2.78Å; V103-T119 PolarHBondContact O-N 2.8Å; V103-R121 HydrophobicContact CG2-CG 4.47Å
104	V	89.8	Confident	80.9	Confident	23 Å²	23	78.2 Å²	78.2	14%	0.139	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.7	175.3	-174.4	0	0	0	0	108.8	H94 R95 R118	H94-V104 WeakPolarHBondContact CA-O 3.4Å; H94-V104 WeakPolarHBondContact CB-O 3.45Å; H94-V104 PolarHBondContact N-O 2.88Å; R95-V104 HydrophobicContact CB-CB 4.38Å; R95-V104 PolarHBondContact N-O 3.45Å; R95-V104 VanDerWaalsContact N-O 3.11Å; R95-V104 PolarHBondContact O-N 3.29Å; V104-R118 HydrophobicContact CG2-CG 4.32Å
105	W	92.3	Very high	81	Confident	7 Å²	7	74.3 Å²	74.3	3%	0.027	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141	178.9	-47	77.7	0	0	0	109.7	E82 I84 Y91 V92 K93 V103 Q116 L117 T119	E82-W105 HydrophobicContact CB-CH2 4Å; E82-W105 HydrophobicContact CB-CZ3 3.98Å; I84-W105 HydrophobicContact CB-CE3 4.41Å; I84-W105 HydrophobicContact CD1-CD2 3.7Å; I84-W105 HydrophobicContact CD1-CE3 3.97Å; I84-W105 HydrophobicContact CD1-CG 4.41Å; I84-W105 HydrophobicContact CD1-CH2 3.7Å; I84-W105 HydrophobicContact CD1-CZ2 3.36Å; I84-W105 HydrophobicContact CD1-CZ3 3.98Å; I84-W105 HydrophobicContact CG1-CD2 4.16Å; I84-W105 HydrophobicContact CG1-CE3 3.93Å; I84-W105 HydrophobicContact CG1-CH2 3.89Å; I84-W105 HydrophobicContact CG1-CZ2 4.08Å; I84-W105 HydrophobicContact CG1-CZ3 3.79Å; Y91-W105 HydrophobicContact CD1-CB 4.48Å; Y91-W105 HydrophobicContact CG-CB 4.33Å; V92-W105 CarbonylContact O-C 3.6Å; V92-W105 WeakPolarHBondContact O-CA 3.3Å; K93-W105 HydrophobicContact CB-CE3 3.93Å; K93-W105 HydrophobicContact CB-CH2 4.29Å; K93-W105 HydrophobicContact CB-CZ3 3.74Å; K93-W105 HydrophobicContact CG-CZ3 4.45Å; V103-W105 HydrophobicContact CB-CZ2 4.22Å; V103-W105 HydrophobicContact CG1-CD2 4.18Å; V103-W105 VanDerWaalsContact CG1-CE2 3.44Å; V103-W105 HydrophobicContact CG1-CH2 4.44Å; V103-W105 HydrophobicContact CG1-CZ2 3.59Å; V103-W105 PolarHBondContact O-NE1 3.33Å; W105-Q116 CarbonylContact O-C 3.49Å; W105-Q116 WeakPolarHBondContact O-CA 3.36Å; W105-Q116 WeakPolarHBondContact O-CB 3.45Å; W105-L117 HydrophobicContact CB-CB 4.15Å; W105-L117 PolarHBondContact N-O 3.31Å; W105-L117 PolarHBondContact O-N 3.32Å; W105-T119 PolarHBondContact NE1-OG1 3.36Å
106	R	90.4	Very high	81.3	Confident	74 Å²	74	68.6 Å²	68.6	28%	0.279	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.4	179.9	175.1	-176	-173.7	125.4	18.7	110	Y91 V92 H94 R108 G110 K111	Y91-R106 CarbonylContact C-O 3.59Å; Y91-R106 VanDerWaalsContact CA-O 3.28Å; Y91-R106 WeakPolarHBondContact CA-O 3.47Å; V92-R106 PolarHBondContact N-O 3.14Å; V92-R106 PolarHBondContact O-N 3.46Å; H94-R106 HydrophobicContact CB-CB 3.92Å; R106-R108 PolarHBondContact O-N 3.37Å; R106-G110 PolarHBondContact NH2-O 2.97Å; R106-K111 VanDerWaalsContact NH2-CA 3.33Å; R106-K111 PolarHBondContact NH2-O 2.87Å
107	C	90.7	Very high	81.7	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.02	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	136.1	171.5	-178.3	0	0	0	0	111.9	S109 C113 G115 H132 H134	C107-S109 PolarHBondContact O-N 3.43Å; C107-S109 PolarHBondContact SG-N 3.43Å; C107-C113 HydrophobicContact CB-CB 4.26Å; C107-C113 VanDerWaalsContact SG-SG 3.66Å; C107-G115 VanDerWaalsContact CB-O 3.28Å; C107-G115 WeakPolarHBondContact CB-O 3.41Å; C107-G115 PolarHBondContact N-O 2.85Å; C107-H132 VanDerWaalsContact CB-CE1 3.43Å; C107-H132 WeakPolarHBondContact CB-CE1 3.27Å; C107-H132 PolarHBondContact SG-CE1 3.41Å; C107-H132 PolarHBondContact SG-ND1 3.23Å; C107-H132 VanDerWaalsContact SG-ND1 3.36Å; C107-H134 PolarHBondContact SG-NE2 3.19Å
108	R	86.1	Confident	82.4	Confident	135 Å²	135	66.8 Å²	66.8	51%	0.509	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.5	-177.7	-164.3	-175.5	175.4	-163.1	-8.1	114.5	D90 V92 R106 G110	D90-R108 PolarHBondContact O-N 3.3Å; D90-R108 WeakPolarHBondContact OD1-CB 3.32Å; D90-R108 WeakPolarHBondContact OD2-CD 3.34Å; D90-R108 IonicContact OD2-CZ 3.39Å; D90-R108 IonicContact OD2-NE 3.42Å; D90-R108 IonicContact OD2-NH1 2.65Å; D90-R108 PolarHBondContact OD2-NH1 3.08Å; V92-R108 HydrophobicContact CG1-CG 4.22Å; R106-R108 PolarHBondContact O-N 3.37Å; R108-G110 PolarHBondContact O-N 2.9Å
109	S	80.5	Confident	83.3	Confident	70 Å²	70	60.4 Å²	60.4	49%	0.49	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-13.6	-172.8	-59.2	0	0	0	0	115.2	C107 H134	C107-S109 PolarHBondContact O-N 3.43Å; C107-S109 PolarHBondContact SG-N 3.43Å; S109-H134 WeakPolarHBondContact CB-NE2 3.28Å; S109-H134 PolarHBondContact OG-CE1 2.89Å; S109-H134 VanDerWaalsContact OG-CE1 3.25Å; S109-H134 PolarHBondContact OG-NE2 2.98Å
110	G	67.7	Low	84.1	Confident	30 Å²	30	58.4 Å²	58.4	31%	0.309	29%	0.293	S	S	.	.			trans	141.1	-168.9	168.3	0	0	0	0	0	114.4	R106 R108 D112	R106-G110 PolarHBondContact NH2-O 2.97Å; R108-G110 PolarHBondContact O-N 2.9Å; G110-D112 VanDerWaalsContact C-N 3.25Å; G110-D112 PolarHBondContact O-N 3.19Å
111	K	71.7	Confident	84.7	Confident	182 Å²	182	59.9 Å²	59.9	79%	0.791	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.4	-178.6	-72.9	-171.3	178.8	-176.2	0	112.7	R106	R106-K111 VanDerWaalsContact NH2-CA 3.33Å; R106-K111 PolarHBondContact NH2-O 2.87Å
112	D	76.7	Confident	84.9	Confident	145 Å²	145	57 Å²	57	78%	0.775	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.8	-171.2	-45.1	-41.1	0	0	0	112.9	G110 N133	G110-D112 VanDerWaalsContact C-N 3.25Å; G110-D112 PolarHBondContact O-N 3.19Å; D112-N133 PolarHBondContact O-ND2 2.94Å
113	C	82.8	Confident	84.7	Confident	7 Å²	7	56 Å²	56	5%	0.047	28%	0.278	C	S	.	.			trans	-91.5	123.3	173.5	-171	0	0	0	0	111.2	C107 G115 H132 N133 H134	C107-C113 HydrophobicContact CB-CB 4.26Å; C107-C113 VanDerWaalsContact SG-SG 3.66Å; C113-G115 VanDerWaalsContact C-N 3.28Å; C113-G115 PolarHBondContact O-N 3.5Å; C113-G115 PolarHBondContact SG-N 3.1Å; C113-H132 PolarHBondContact SG-ND1 3.39Å; C113-N133 WeakPolarHBondContact CA-OD1 3.45Å; C113-N133 WeakPolarHBondContact CB-OD1 3.17Å; C113-N133 PolarHBondContact SG-OD1 3.28Å; C113-H134 VanDerWaalsContact SG-CD2 3.51Å
114	G	84.8	Confident	84.3	Confident	50 Å²	50	62.7 Å²	62.7	52%	0.515	30%	0.304	S	S	.	.			trans	-79.7	-2.6	175.6	0	0	0	0	0	115	Q116	G114-Q116 PolarHBondContact O-N 3.15Å
115	G	88.8	Confident	83.9	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.			trans	-61.4	123.9	-177.5	0	0	0	0	0	112.4	C107 C113 P131	C107-G115 VanDerWaalsContact CB-O 3.28Å; C107-G115 WeakPolarHBondContact CB-O 3.41Å; C107-G115 PolarHBondContact N-O 2.85Å; C113-G115 VanDerWaalsContact C-N 3.28Å; C113-G115 PolarHBondContact O-N 3.5Å; C113-G115 PolarHBondContact SG-N 3.1Å; G115-P131 WeakPolarHBondContact CA-O 3.4Å; G115-P131 PolarHBondContact N-O 2.96Å
116	Q	89.9	Confident	83.6	Confident	56 Å²	56	66 Å²	66	26%	0.262	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.2	176.3	-61.6	-175.9	-2.2	0	0	110.4	W105 G114 S129 L130	W105-Q116 CarbonylContact O-C 3.49Å; W105-Q116 WeakPolarHBondContact O-CA 3.36Å; W105-Q116 WeakPolarHBondContact O-CB 3.45Å; G114-Q116 PolarHBondContact O-N 3.15Å; Q116-S129 CarbonylContact O-C 3.54Å; Q116-S129 WeakPolarHBondContact O-CA 3.49Å; Q116-L130 HydrophobicContact CB-CB 4.31Å; Q116-L130 HydrophobicContact CB-CD1 3.94Å; Q116-L130 HydrophobicContact CB-CG 4.26Å; Q116-L130 HydrophobicContact CG-CD1 4.24Å; Q116-L130 PolarHBondContact O-N 3.43Å
117	L	91	Very high	83.3	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.1	175	-168.6	74.6	0	0	0	108.1	I84 F86 Y91 W105 T119 V126 Q128	I84-L117 HydrophobicContact CG2-CD2 4Å; F86-L117 HydrophobicContact CB-CD2 4.15Å; F86-L117 HydrophobicContact CD1-CD1 3.61Å; F86-L117 HydrophobicContact CD1-CD2 4.42Å; F86-L117 HydrophobicContact CE1-CD1 3.98Å; F86-L117 HydrophobicContact CG-CD1 4.39Å; F86-L117 HydrophobicContact CG-CD2 4.45Å; Y91-L117 HydrophobicContact CD1-CB 3.84Å; Y91-L117 HydrophobicContact CD2-CB 4.36Å; Y91-L117 HydrophobicContact CD2-CD2 4.16Å; Y91-L117 HydrophobicContact CE1-CB 3.84Å; Y91-L117 HydrophobicContact CE2-CB 4.33Å; Y91-L117 HydrophobicContact CE2-CD2 4.26Å; Y91-L117 HydrophobicContact CG-CB 4.12Å; W105-L117 HydrophobicContact CB-CB 4.15Å; W105-L117 PolarHBondContact N-O 3.31Å; W105-L117 PolarHBondContact O-N 3.32Å; L117-T119 HydrophobicContact CD2-CG2 3.74Å; L117-T119 HydrophobicContact CG-CG2 3.9Å; L117-V126 HydrophobicContact CD1-CG1 3.48Å; L117-V126 VanDerWaalsContact CD1-CG1 3.48Å; L117-V126 HydrophobicContact CD1-CG2 4.4Å; L117-V126 HydrophobicContact CG-CG1 4.26Å; L117-Q128 CarbonylContact C-O 3.58Å; L117-Q128 WeakPolarHBondContact CA-O 3.31Å
118	R	89.9	Confident	83.1	Confident	105 Å²	105	71.9 Å²	71.9	40%	0.396	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.2	170.8	-62.3	-171.5	177.7	-162.6	1	108.3	V102 V103 V104 V126 F127 Q128	V102-R118 HydrophobicContact CG1-CB 4.13Å; V103-R118 WeakPolarHBondContact O-CA 3.1Å; V104-R118 HydrophobicContact CG2-CG 4.32Å; R118-V126 CarbonylContact O-C 3.6Å; R118-F127 HydrophobicContact CB-CB 4.19Å; R118-F127 PolarHBondContact O-N 3.11Å; R118-Q128 HydrophobicContact CB-CB 4.07Å; R118-Q128 HydrophobicContact CG-CB 4.22Å; R118-Q128 PolarHBondContact N-O 3.3Å; R118-Q128 PolarHBondContact O-N 3.49Å
119	T	89.1	Confident	83.2	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	167	178.4	72.5	0	0	0	0	110.8	L72 I84 V102 V103 W105 L117 A123 V125 V126 F127	L72-T119 HydrophobicContact CD1-CG2 4.41Å; I84-T119 HydrophobicContact CD1-CG2 4.41Å; V102-T119 WeakPolarHBondContact CA-O 3.4Å; V103-T119 PolarHBondContact N-O 2.78Å; V103-T119 PolarHBondContact O-N 2.8Å; W105-T119 PolarHBondContact NE1-OG1 3.36Å; L117-T119 HydrophobicContact CD2-CG2 3.74Å; L117-T119 HydrophobicContact CG-CG2 3.9Å; T119-A123 HydrophobicContact CG2-CB 4.43Å; T119-V125 CarbonylContact C-O 3.47Å; T119-V125 WeakPolarHBondContact CA-O 3.43Å; T119-V125 WeakPolarHBondContact CB-O 3.14Å; T119-V126 HydrophobicContact CG2-CG2 4.25Å; T119-F127 VanDerWaalsContact C-CD2 3.43Å; T119-F127 WeakPolarHBondContact O-CE2 3.41Å
120	D	84.6	Confident	83.5	Confident	28 Å²	28	67.3 Å²	67.3	15%	0.15	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	166.5	160.5	73.2	-46.8	0	0	0	110.6	N122 A123 R124 V125 F127	D120-N122 PolarHBondContact O-N 3.4Å; D120-N122 VanDerWaalsContact O-N 3.08Å; D120-N122 PolarHBondContact OD2-N 3.09Å; D120-A123 PolarHBondContact O-N 2.96Å; D120-A123 WeakPolarHBondContact OD1-CA 3.37Å; D120-A123 PolarHBondContact OD1-N 3.33Å; D120-A123 VanDerWaalsContact OD1-N 3.13Å; D120-R124 PolarHBondContact OD1-N 3.38Å; D120-V125 PolarHBondContact N-O 3.39Å; D120-V125 PolarHBondContact OD1-N 2.91Å; D120-F127 HydrophobicContact CB-CE2 3.96Å; D120-F127 HydrophobicContact CB-CZ 3.86Å
121	R	79.9	Confident	84.3	Confident	163 Å²	163	71 Å²	71	62%	0.615	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.5	-179.3	-157.9	177.7	-164.7	-171.6	2.8	114.6	E96 K101 V103	E96-R121 IonicContact OE1-CZ 2.74Å; E96-R121 IonicContact OE1-NE 2.62Å; E96-R121 PolarHBondContact OE1-NE 2.83Å; E96-R121 IonicContact OE1-NH2 3.5Å; E96-R121 PolarHBondContact OE1-NH2 2.9Å; K101-R121 PolarHBondContact O-N 3.46Å; V103-R121 HydrophobicContact CG2-CG 4.47Å
122	N	80.4	Confident	85.1	Confident	95 Å²	95	64 Å²	64	51%	0.508	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	4.9	-177.6	-63.4	-32.1	0	0	0	113.5	R68 D120 R124	R68-N122 PolarHBondContact NH2-O 3.47Å; D120-N122 PolarHBondContact O-N 3.4Å; D120-N122 VanDerWaalsContact O-N 3.08Å; D120-N122 PolarHBondContact OD2-N 3.09Å; N122-R124 HydrophobicContact CB-CG 4.02Å; N122-R124 PolarHBondContact O-N 3.07Å
123	A	82.6	Confident	85.5	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.008	32%	0.317	C	S	.	.	S	Bend	trans	43.9	49.2	-172.4	0	0	0	0	0	112.8	R68 L72 I74 I84 T119 D120	R68-A123 PolarHBondContact NE-O 3.48Å; L72-A123 HydrophobicContact CD1-CB 4.44Å; L72-A123 HydrophobicContact CD2-CB 3.91Å; L72-A123 WeakPolarHBondContact CD2-O 3.49Å; I74-A123 HydrophobicContact CD1-CB 3.97Å; I74-A123 HydrophobicContact CG1-CB 4.47Å; I84-A123 HydrophobicContact CD1-CB 3.53Å; T119-A123 HydrophobicContact CG2-CB 4.43Å; D120-A123 PolarHBondContact O-N 2.96Å; D120-A123 WeakPolarHBondContact OD1-CA 3.37Å; D120-A123 PolarHBondContact OD1-N 3.33Å; D120-A123 VanDerWaalsContact OD1-N 3.13Å
124	R	80.3	Confident	85.5	Confident	143 Å²	143	64.5 Å²	64.5	54%	0.54	33%	0.326	S	S	.	.	S	Bend	trans	-95	-25.2	168.4	-63.8	-178	178.7	-173.6	-0.9	111.6	R68 P69 D120 N122	R68-R124 WeakPolarHBondContact CA-O 3.31Å; P69-R124 WeakPolarHBondContact CD-O 3.47Å; D120-R124 PolarHBondContact OD1-N 3.38Å; N122-R124 HydrophobicContact CB-CG 4.02Å; N122-R124 PolarHBondContact O-N 3.07Å
125	V	81	Confident	85.4	Confident	60 Å²	60	68.9 Å²	68.9	36%	0.364	34%	0.338	S	S	.	.			trans	-129.7	130.5	-179.4	-177.4	0	0	0	0	108.8	T119 D120 F127	T119-V125 CarbonylContact C-O 3.47Å; T119-V125 WeakPolarHBondContact CA-O 3.43Å; T119-V125 WeakPolarHBondContact CB-O 3.14Å; D120-V125 PolarHBondContact N-O 3.39Å; D120-V125 PolarHBondContact OD1-N 2.91Å; V125-F127 HydrophobicContact CB-CE1 4.34Å; V125-F127 HydrophobicContact CG1-CD1 3.97Å; V125-F127 HydrophobicContact CG1-CE1 3.82Å
126	V	86	Confident	85.2	Confident	39 Å²	39	71.9 Å²	71.9	24%	0.236	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	113.9	170.2	176.8	0	0	0	0	107.7	P69 L72 F86 L117 R118 T119	P69-V126 HydrophobicContact CG-CG2 4.01Å; L72-V126 HydrophobicContact CD1-CG2 3.48Å; L72-V126 VanDerWaalsContact CD1-CG2 3.48Å; F86-V126 HydrophobicContact CE1-CG1 4.28Å; F86-V126 HydrophobicContact CE1-CG2 4.46Å; F86-V126 HydrophobicContact CE2-CG2 4.18Å; F86-V126 HydrophobicContact CZ-CG1 4.46Å; F86-V126 HydrophobicContact CZ-CG2 4.13Å; L117-V126 HydrophobicContact CD1-CG1 3.48Å; L117-V126 VanDerWaalsContact CD1-CG1 3.48Å; L117-V126 HydrophobicContact CD1-CG2 4.4Å; L117-V126 HydrophobicContact CG-CG1 4.26Å; R118-V126 CarbonylContact O-C 3.6Å; T119-V126 HydrophobicContact CG2-CG2 4.25Å
127	F	85	Confident	84.8	Confident	117 Å²	117	72.3 Å²	72.3	51%	0.513	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-36.3	177.7	-59	-56.5	0	0	0	112.3	V102 R118 T119 D120 V125	V102-F127 HydrophobicContact CB-CE2 4.48Å; V102-F127 HydrophobicContact CG1-CD2 4.13Å; V102-F127 HydrophobicContact CG1-CE2 4.46Å; V102-F127 HydrophobicContact CG2-CD2 4.03Å; V102-F127 HydrophobicContact CG2-CE2 3.8Å; R118-F127 HydrophobicContact CB-CB 4.19Å; R118-F127 PolarHBondContact O-N 3.11Å; T119-F127 VanDerWaalsContact C-CD2 3.43Å; T119-F127 WeakPolarHBondContact O-CE2 3.41Å; D120-F127 HydrophobicContact CB-CE2 3.96Å; D120-F127 HydrophobicContact CB-CZ 3.86Å; V125-F127 HydrophobicContact CB-CE1 4.34Å; V125-F127 HydrophobicContact CG1-CD1 3.97Å; V125-F127 HydrophobicContact CG1-CE1 3.82Å
128	Q	86	Confident	84.2	Confident	84 Å²	84	76 Å²	76	39%	0.393	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	142	-176.9	-167.7	176.8	39.5	0	0	110.8	L117 R118 L130	L117-Q128 CarbonylContact C-O 3.58Å; L117-Q128 WeakPolarHBondContact CA-O 3.31Å; R118-Q128 HydrophobicContact CB-CB 4.07Å; R118-Q128 HydrophobicContact CG-CB 4.22Å; R118-Q128 PolarHBondContact N-O 3.3Å; R118-Q128 PolarHBondContact O-N 3.49Å; Q128-L130 HydrophobicContact CG-CD2 4.3Å
129	S	88.3	Confident	83.8	Confident	52 Å²	52	74.7 Å²	74.7	36%	0.364	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	114	169.9	-175.7	0	0	0	0	108.2	Q116	Q116-S129 CarbonylContact O-C 3.54Å; Q116-S129 WeakPolarHBondContact O-CA 3.49Å
130	L	86.8	Confident	83.5	Confident	57 Å²	57	75 Å²	75	30%	0.298	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-82.3	148.8	174.3	-65.5	-174	0	0	0	110.6	Q116 Q128	Q116-L130 HydrophobicContact CB-CB 4.31Å; Q116-L130 HydrophobicContact CB-CD1 3.94Å; Q116-L130 HydrophobicContact CB-CG 4.26Å; Q116-L130 HydrophobicContact CG-CD1 4.24Å; Q116-L130 PolarHBondContact O-N 3.43Å; Q128-L130 HydrophobicContact CG-CD2 4.3Å
131	P	84	Confident	83.4	Confident	107 Å²	107	75.5 Å²	75.5	70%	0.695	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-66.1	152.7	-177.9	27.8	-35.1	0	0	0	112.2	G115	G115-P131 WeakPolarHBondContact CA-O 3.4Å; G115-P131 PolarHBondContact N-O 2.96Å
132	H	88.4	Confident	83.6	Confident	34 Å²	34	73.4 Å²	73.4	16%	0.157	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-101.6	155.6	173	-68.6	-115.7	0	0	0	109.6	F89 Y91 C107 C113 H134	F89-H132 HydrophobicContact CD1-CB 4.29Å; F89-H132 AromaticContact CD1-CE1 3.61Å; F89-H132 AromaticContact CD1-CG 3.68Å; F89-H132 AromaticContact CD1-ND1 3.41Å; F89-H132 WeakPolarHBondContact CD1-ND1 3.28Å; F89-H132 HydrophobicContact CE1-CB 3.68Å; F89-H132 AromaticContact CE1-CG 3.57Å; F89-H132 AromaticContact CE1-ND1 3.73Å; F89-H132 AromaticContact CG-CE1 3.72Å; F89-H132 AromaticContact CG-ND1 3.99Å; F89-H132 AromaticContact CG-NE2 3.82Å; F89-H132 HydrophobicContact CZ-CB 3.97Å; F89-H132 AromaticContact CZ-CG 3.98Å; Y91-H132 AromaticContact CE1-CE1 3.64Å; Y91-H132 AromaticContact CE1-NE2 3.37Å; Y91-H132 WeakPolarHBondContact CE1-NE2 3.48Å; Y91-H132 AromaticContact CZ-CE1 3.78Å; Y91-H132 AromaticContact CZ-NE2 3.33Å; Y91-H132 VanDerWaalsContact CZ-NE2 3.33Å; Y91-H132 PolarHBondContact OH-NE2 2.81Å; C107-H132 VanDerWaalsContact CB-CE1 3.43Å; C107-H132 WeakPolarHBondContact CB-CE1 3.27Å; C107-H132 PolarHBondContact SG-CE1 3.41Å; C107-H132 PolarHBondContact SG-ND1 3.23Å; C107-H132 VanDerWaalsContact SG-ND1 3.36Å; C113-H132 PolarHBondContact SG-ND1 3.39Å; H132-H134 VanDerWaalsContact C-N 3.34Å; H132-H134 AromaticContact ND1-CE1 3.84Å; H132-H134 AromaticContact ND1-NE2 3.38Å; H132-H134 PolarHBondContact ND1-NE2 3.34Å
133	N	85.3	Confident	83.8	Confident	110 Å²	110	70.3 Å²	70.3	59%	0.588	36%	0.364	S	S	*	.	S	Bend	trans	-98.2	18.2	172.1	61.9	-15.3	0	0	0	112.6	D112 C113	D112-N133 PolarHBondContact O-ND2 2.94Å; C113-N133 WeakPolarHBondContact CA-OD1 3.45Å; C113-N133 WeakPolarHBondContact CB-OD1 3.17Å; C113-N133 PolarHBondContact SG-OD1 3.28Å
134	H	83.9	Confident	84	Confident	53 Å²	53	71.7 Å²	71.7	25%	0.245	37%	0.371	C	S	.	.	S	Bend	trans	-144.8	158.1	177.7	67.9	80.6	0	0	0	109.2	F89 C107 S109 C113 H132	F89-H134 AromaticContact CD1-CE1 3.53Å; F89-H134 AromaticContact CE1-CE1 3.6Å; F89-H134 AromaticContact CE1-ND1 3.79Å; F89-H134 WeakPolarHBondContact CE1-O 3.29Å; C107-H134 PolarHBondContact SG-NE2 3.19Å; S109-H134 WeakPolarHBondContact CB-NE2 3.28Å; S109-H134 PolarHBondContact OG-CE1 2.89Å; S109-H134 VanDerWaalsContact OG-CE1 3.25Å; S109-H134 PolarHBondContact OG-NE2 2.98Å; C113-H134 VanDerWaalsContact SG-CD2 3.51Å; H132-H134 VanDerWaalsContact C-N 3.34Å; H132-H134 AromaticContact ND1-CE1 3.84Å; H132-H134 AromaticContact ND1-NE2 3.38Å; H132-H134 PolarHBondContact ND1-NE2 3.34Å
135	D	81.3	Confident	84.3	Confident	143 Å²	143	68.4 Å²	68.4	77%	0.765	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-70.8	152.9	-178.9	-62.5	-41.5	0	0	0	112
136	P	84.3	Confident	84.6	Confident	63 Å²	63	65.8 Å²	65.8	41%	0.409	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-58.5	141.8	170.7	-14.4	24.1	0	0	0	110.9	F89 P138	F89-P136 HydrophobicContact CE1-CB 4.26Å; F89-P136 HydrophobicContact CE1-CG 4.25Å; F89-P136 HydrophobicContact CE2-CB 4.06Å; F89-P136 HydrophobicContact CE2-CG 3.74Å; F89-P136 HydrophobicContact CZ-CB 3.91Å; F89-P136 HydrophobicContact CZ-CG 3.5Å; P136-P138 VanDerWaalsContact O-CD 3.29Å; P136-P138 WeakPolarHBondContact O-CD 3.47Å
137	V	81.6	Confident	84.7	Confident	65 Å²	65	65.2 Å²	65.2	39%	0.394	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-79.6	118.6	179	177.8	0	0	0	0	109	G88 F139 V140	G88-V137 PolarHBondContact O-N 2.79Å; V137-F139 PolarHBondContact O-N 3.38Å; V137-V140 HydrophobicContact CB-CB 3.99Å; V137-V140 HydrophobicContact CB-CG2 4.39Å; V137-V140 HydrophobicContact CG1-CB 4.08Å; V137-V140 HydrophobicContact CG1-CG2 4.49Å; V137-V140 WeakPolarHBondContact O-CB 3.44Å; V137-V140 WeakPolarHBondContact O-CG1 3.47Å; V137-V140 PolarHBondContact O-N 2.91Å
138	P	78.3	Confident	84.8	Confident	76 Å²	76	61.3 Å²	61.3	49%	0.494	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	137.4	179	-23	34.2	0	0	0	111.1	P136 V140	P136-P138 VanDerWaalsContact O-CD 3.29Å; P136-P138 WeakPolarHBondContact O-CD 3.47Å; P138-V140 PolarHBondContact O-N 2.85Å; P138-V140 VanDerWaalsContact O-N 3.17Å
139	F	82.1	Confident	84.9	Confident	78 Å²	78	59.2 Å²	59.2	34%	0.342	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.3	177.7	-44.3	-79.5	0	0	0	115.5	V137 E141 Y142 I143 D175 A176 K179	V137-F139 PolarHBondContact O-N 3.38Å; F139-E141 PolarHBondContact O-N 3.3Å; F139-E141 VanDerWaalsContact O-N 3.14Å; F139-Y142 HydrophobicContact CB-CD2 3.91Å; F139-Y142 AromaticContact CD1-CD2 3.95Å; F139-Y142 HydrophobicContact CD1-CD2 3.95Å; F139-Y142 HydrophobicContact CD1-CE2 4.17Å; F139-Y142 HydrophobicContact CG-CD2 4.45Å; F139-Y142 WeakPolarHBondContact O-CB 3.29Å; F139-Y142 PolarHBondContact O-N 3.2Å; F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.46Å; F139-I143 VanDerWaalsContact O-N 3.07Å; F139-D175 HydrophobicContact CE2-CB 4.49Å; F139-D175 HydrophobicContact CZ-CB 4.48Å; F139-A176 HydrophobicContact CD1-CB 4.05Å; F139-A176 HydrophobicContact CE1-CB 4.48Å; F139-A176 HydrophobicContact CG-CB 4.24Å; F139-K179 HydrophobicContact CD2-CG 4.04Å
140	V	83.6	Confident	85	Confident	8 Å²	8	56.7 Å²	56.7	5%	0.048	31%	0.306	C	S	.	.	H	α-helix	trans	-54.6	-36.6	-176.7	64.7	0	0	0	0	113.2	V85 G88 V137 P138 I143 H144	V85-V140 HydrophobicContact CG1-CG1 3.63Å; G88-V140 WeakPolarHBondContact O-CG1 3.33Å; V137-V140 HydrophobicContact CB-CB 3.99Å; V137-V140 HydrophobicContact CB-CG2 4.39Å; V137-V140 HydrophobicContact CG1-CB 4.08Å; V137-V140 HydrophobicContact CG1-CG2 4.49Å; V137-V140 WeakPolarHBondContact O-CB 3.44Å; V137-V140 WeakPolarHBondContact O-CG1 3.47Å; V137-V140 PolarHBondContact O-N 2.91Å; P138-V140 PolarHBondContact O-N 2.85Å; P138-V140 VanDerWaalsContact O-N 3.17Å; V140-I143 PolarHBondContact O-N 3.09Å; V140-H144 PolarHBondContact O-CD2 3.43Å; V140-H144 VanDerWaalsContact O-CD2 3.31Å; V140-H144 PolarHBondContact O-N 3.17Å; V140-H144 VanDerWaalsContact O-N 3.07Å
141	E	82.9	Confident	85	Confident	38 Å²	38	56.8 Å²	56.8	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-50.7	175	-68.8	-180	-161.6	0	0	111.8	K73 V85 F139 I143 H144 E145	K73-E141 HydrophobicContact CD-CB 4.34Å; K73-E141 HydrophobicContact CD-CG 4.21Å; K73-E141 VanDerWaalsContact CE-OE2 3.27Å; K73-E141 WeakPolarHBondContact CE-OE2 3.36Å; K73-E141 IonicContact NZ-OE2 3.54Å; K73-E141 PolarHBondContact NZ-OE2 3.23Å; V85-E141 HydrophobicContact CB-CG 4.31Å; V85-E141 HydrophobicContact CG1-CG 3.46Å; V85-E141 VanDerWaalsContact CG1-CG 3.46Å; F139-E141 PolarHBondContact O-N 3.3Å; F139-E141 VanDerWaalsContact O-N 3.14Å; E141-I143 VanDerWaalsContact C-N 3.27Å; E141-I143 PolarHBondContact O-N 3.23Å; E141-H144 PolarHBondContact O-N 2.9Å; E141-H144 VanDerWaalsContact O-N 3.1Å; E141-E145 WeakPolarHBondContact O-CG 3.33Å; E141-E145 PolarHBondContact O-N 2.87Å
142	Y	83.8	Confident	85.1	Confident	118 Å²	118	56.2 Å²	56.2	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-36.7	178.6	-64.9	-75.9	0	0	0	112.1	F139 A146 M172	F139-Y142 HydrophobicContact CB-CD2 3.91Å; F139-Y142 AromaticContact CD1-CD2 3.95Å; F139-Y142 HydrophobicContact CD1-CD2 3.95Å; F139-Y142 HydrophobicContact CD1-CE2 4.17Å; F139-Y142 HydrophobicContact CG-CD2 4.45Å; F139-Y142 WeakPolarHBondContact O-CB 3.29Å; F139-Y142 PolarHBondContact O-N 3.2Å; Y142-A146 WeakPolarHBondContact O-CB 3.27Å; Y142-A146 PolarHBondContact O-N 2.9Å; Y142-M172 HydrophobicContact CD1-CE 4.32Å; Y142-M172 HydrophobicContact CG-CE 4.35Å
143	I	84.7	Confident	85.1	Confident	31 Å²	31	56.4 Å²	56.4	16%	0.159	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-46.3	175.2	-59.9	168.9	0	0	0	110.1	F139 V140 E141 M147 K179	F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.46Å; F139-I143 VanDerWaalsContact O-N 3.07Å; V140-I143 PolarHBondContact O-N 3.09Å; E141-I143 VanDerWaalsContact C-N 3.27Å; E141-I143 PolarHBondContact O-N 3.23Å; I143-M147 HydrophobicContact CG2-CG 4.46Å; I143-M147 WeakPolarHBondContact O-CB 3.36Å; I143-M147 WeakPolarHBondContact O-CG 3.09Å; I143-M147 PolarHBondContact O-N 3.18Å; I143-K179 HydrophobicContact CD1-CB 3.85Å; I143-K179 WeakPolarHBondContact CD1-O 3.4Å; I143-K179 HydrophobicContact CG1-CB 4.16Å
144	H	86.5	Confident	85.2	Confident	30 Å²	30	51.1 Å²	51.1	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-69.8	-38.9	-179.2	-86	-86.1	0	0	0	112.8	F75 L83 D90 V140 E141 T148	F75-H144 HydrophobicContact CD1-CB 3.74Å; F75-H144 HydrophobicContact CD2-CB 3.75Å; F75-H144 HydrophobicContact CE1-CB 3.68Å; F75-H144 HydrophobicContact CE2-CB 3.67Å; F75-H144 HydrophobicContact CG-CB 3.77Å; F75-H144 HydrophobicContact CZ-CB 3.63Å; L83-H144 VanDerWaalsContact CD2-CE1 3.46Å; L83-H144 WeakPolarHBondContact CD2-CE1 3.34Å; D90-H144 IonicContact OD2-NE2 2.73Å; V140-H144 PolarHBondContact O-CD2 3.43Å; V140-H144 VanDerWaalsContact O-CD2 3.31Å; V140-H144 PolarHBondContact O-N 3.17Å; V140-H144 VanDerWaalsContact O-N 3.07Å; E141-H144 PolarHBondContact O-N 2.9Å; E141-H144 VanDerWaalsContact O-N 3.1Å; H144-T148 VanDerWaalsContact O-CB 3.29Å; H144-T148 WeakPolarHBondContact O-CB 3.39Å; H144-T148 PolarHBondContact O-N 3.01Å; H144-T148 PolarHBondContact O-OG1 3.3Å
145	E	86.4	Confident	85.3	Confident	73 Å²	73	50.8 Å²	50.8	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-50.3	172.2	-74.4	174.3	-176	0	0	111	K73 F75 E141 M147 T148 A149	K73-E145 WeakPolarHBondContact CD-OE1 3.4Å; K73-E145 VanDerWaalsContact CE-OE1 3.31Å; K73-E145 WeakPolarHBondContact CE-OE1 3.4Å; K73-E145 IonicContact NZ-OE1 3.74Å; K73-E145 PolarHBondContact NZ-OE1 2.75Å; F75-E145 HydrophobicContact CE1-CB 4.42Å; F75-E145 HydrophobicContact CE1-CG 3.7Å; F75-E145 HydrophobicContact CZ-CG 3.82Å; E141-E145 WeakPolarHBondContact O-CG 3.33Å; E141-E145 PolarHBondContact O-N 2.87Å; E145-M147 PolarHBondContact O-N 3.36Å; E145-T148 PolarHBondContact O-N 3.3Å; E145-T148 VanDerWaalsContact O-N 3.16Å; E145-A149 WeakPolarHBondContact O-CB 3.32Å; E145-A149 PolarHBondContact O-N 3.27Å
146	A	87.5	Confident	85.5	Confident	5 Å²	5	51.4 Å²	51.4	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-58.9	-46.4	178.5	0	0	0	0	0	111.8	Y142 T148 A150 V168 M172 I180	Y142-A146 WeakPolarHBondContact O-CB 3.27Å; Y142-A146 PolarHBondContact O-N 2.9Å; A146-T148 VanDerWaalsContact C-N 3.31Å; A146-T148 PolarHBondContact O-N 3.18Å; A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.06Å; A146-V168 VanDerWaalsContact CA-CG1 3.44Å; A146-V168 HydrophobicContact CB-CG1 3.47Å; A146-V168 VanDerWaalsContact CB-CG1 3.47Å; A146-V168 VanDerWaalsContact O-CG1 3.23Å; A146-V168 WeakPolarHBondContact O-CG1 3.36Å; A146-M172 HydrophobicContact CB-CE 4.49Å; A146-I180 HydrophobicContact CB-CD1 3.97Å; A146-I180 HydrophobicContact CB-CG1 4.39Å
147	M	86.9	Confident	85.5	Confident	27 Å²	27	50.2 Å²	50.2	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-34.1	178.4	-71.6	-66.4	-73.6	0	0	112.6	I143 E145 R151 P181 L186 M189	I143-M147 HydrophobicContact CG2-CG 4.46Å; I143-M147 WeakPolarHBondContact O-CB 3.36Å; I143-M147 WeakPolarHBondContact O-CG 3.09Å; I143-M147 PolarHBondContact O-N 3.18Å; E145-M147 PolarHBondContact O-N 3.36Å; M147-R151 VanDerWaalsContact O-CG 3.31Å; M147-R151 WeakPolarHBondContact O-CG 3.28Å; M147-R151 PolarHBondContact O-N 3.39Å; M147-P181 HydrophobicContact CE-CG 4.35Å; M147-P181 HydrophobicContact SD-CG 3.89Å; M147-L186 HydrophobicContact SD-CD1 3.98Å; M147-L186 HydrophobicContact SD-CG 4.18Å; M147-M189 HydrophobicContact CE-CE 4.25Å; M147-M189 HydrophobicContact CE-SD 3.62Å
148	T	87.3	Confident	85.6	Confident	36 Å²	36	56.2 Å²	56.2	22%	0.221	27%	0.274	C	S	.	.	H	α-helix	trans	-72.7	-49.3	177.7	-57.2	0	0	0	0	110.5	H144 E145 A146 A150 R151 E152	H144-T148 VanDerWaalsContact O-CB 3.29Å; H144-T148 WeakPolarHBondContact O-CB 3.39Å; H144-T148 PolarHBondContact O-N 3.01Å; H144-T148 PolarHBondContact O-OG1 3.3Å; E145-T148 PolarHBondContact O-N 3.3Å; E145-T148 VanDerWaalsContact O-N 3.16Å; A146-T148 VanDerWaalsContact C-N 3.31Å; A146-T148 PolarHBondContact O-N 3.18Å; T148-A150 VanDerWaalsContact C-N 3.31Å; T148-A150 PolarHBondContact O-N 2.86Å; T148-R151 PolarHBondContact O-N 2.88Å; T148-R151 VanDerWaalsContact O-N 3.1Å; T148-E152 PolarHBondContact O-N 3.25Å
149	A	89	Confident	85.9	Confident	39 Å²	39	56.1 Å²	56.1	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-56.5	-44	174.4	0	0	0	0	0	111.5	E145 R151 E152 M153 V168	E145-A149 WeakPolarHBondContact O-CB 3.32Å; E145-A149 PolarHBondContact O-N 3.27Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 2.89Å; A149-E152 PolarHBondContact O-N 3.35Å; A149-M153 WeakPolarHBondContact O-CB 3.41Å; A149-M153 VanDerWaalsContact O-CG 3.28Å; A149-M153 WeakPolarHBondContact O-CG 3.3Å; A149-M153 PolarHBondContact O-N 3.48Å; A149-V168 HydrophobicContact CB-CG2 4.2Å
150	A	89.4	Confident	86	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-40.1	176.5	0	0	0	0	0	113	A146 T148 A154 I164 V168 L186 M189	A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.06Å; T148-A150 VanDerWaalsContact C-N 3.31Å; T148-A150 PolarHBondContact O-N 2.86Å; A150-A154 WeakPolarHBondContact O-CB 3.28Å; A150-A154 PolarHBondContact O-N 3.02Å; A150-I164 HydrophobicContact CB-CG2 4.41Å; A150-V168 HydrophobicContact CB-CG2 4.06Å; A150-L186 HydrophobicContact CB-CD2 3.63Å; A150-M189 HydrophobicContact CB-CE 3.96Å
151	R	86.7	Confident	86.1	Confident	59 Å²	59	56.6 Å²	56.6	22%	0.223	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-42.8	175.2	-71.4	-179.9	-162.3	155.3	15.6	111.5	K76 Q78 M147 T148 A149 A154 V155 M189 I193	K76-R151 PolarHBondContact O-NH1 3.46Å; Q78-R151 VanDerWaalsContact CG-NH2 3.34Å; M147-R151 VanDerWaalsContact O-CG 3.31Å; M147-R151 WeakPolarHBondContact O-CG 3.28Å; M147-R151 PolarHBondContact O-N 3.39Å; T148-R151 PolarHBondContact O-N 2.88Å; T148-R151 VanDerWaalsContact O-N 3.1Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 2.89Å; R151-A154 PolarHBondContact O-N 2.7Å; R151-V155 WeakPolarHBondContact O-CG2 3.41Å; R151-V155 PolarHBondContact O-N 3.39Å; R151-M189 HydrophobicContact CG-CE 3.85Å; R151-M189 HydrophobicContact CG-SD 4.11Å; R151-I193 HydrophobicContact CB-CD1 4.27Å; R151-I193 HydrophobicContact CG-CD1 3.8Å
152	E	87.6	Confident	86.3	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-47.2	178.1	-71.6	-165.3	-163.5	0	0	112	T148 A149 A154 V155 K156	T148-E152 PolarHBondContact O-N 3.25Å; A149-E152 PolarHBondContact O-N 3.35Å; E152-A154 VanDerWaalsContact C-N 3.31Å; E152-A154 PolarHBondContact O-N 2.86Å; E152-V155 PolarHBondContact O-N 2.99Å; E152-V155 VanDerWaalsContact O-N 3.12Å; E152-K156 HydrophobicContact CB-CD 4.49Å; E152-K156 WeakPolarHBondContact O-CB 3.37Å; E152-K156 WeakPolarHBondContact O-CG 3.35Å; E152-K156 PolarHBondContact O-N 3.27Å; E152-K156 IonicContact OE2-NZ 3.26Å; E152-K156 PolarHBondContact OE2-NZ 3.26Å
153	M	88.9	Confident	86.4	Confident	37 Å²	37	53.8 Å²	53.8	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-35.8	176.8	-70.6	-176.7	79.5	0	0	112.1	A149 V155 T157 L159 I164 E167 V168	A149-M153 WeakPolarHBondContact O-CB 3.41Å; A149-M153 VanDerWaalsContact O-CG 3.28Å; A149-M153 WeakPolarHBondContact O-CG 3.3Å; A149-M153 PolarHBondContact O-N 3.48Å; M153-V155 PolarHBondContact O-N 3.3Å; M153-T157 HydrophobicContact CB-CG2 4.28Å; M153-T157 HydrophobicContact CE-CG2 4.45Å; M153-T157 HydrophobicContact CG-CG2 4.43Å; M153-T157 WeakPolarHBondContact O-CB 3.43Å; M153-T157 PolarHBondContact O-N 3.48Å; M153-T157 PolarHBondContact O-OG1 3Å; M153-L159 HydrophobicContact CE-CD1 3.67Å; M153-I164 HydrophobicContact CB-CD1 4.28Å; M153-I164 HydrophobicContact CB-CG1 4.19Å; M153-I164 HydrophobicContact CB-CG2 3.87Å; M153-I164 HydrophobicContact CE-CG1 4.45Å; M153-I164 HydrophobicContact SD-CG2 4.25Å; M153-E167 HydrophobicContact CE-CB 3.83Å; M153-E167 HydrophobicContact CE-CG 3.79Å; M153-E167 HydrophobicContact SD-CB 4.4Å; M153-E167 HydrophobicContact SD-CG 4.43Å; M153-V168 HydrophobicContact SD-CG2 3.79Å
154	A	87.3	Confident	86.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-32.1	174.9	0	0	0	0	0	112.3	A150 R151 E152 I190 I193 R194	A150-A154 WeakPolarHBondContact O-CB 3.28Å; A150-A154 PolarHBondContact O-N 3.02Å; R151-A154 PolarHBondContact O-N 2.7Å; E152-A154 VanDerWaalsContact C-N 3.31Å; E152-A154 PolarHBondContact O-N 2.86Å; A154-I190 HydrophobicContact CB-CB 4.33Å; A154-I190 HydrophobicContact CB-CG1 4.28Å; A154-I190 HydrophobicContact CB-CG2 3.83Å; A154-I193 HydrophobicContact CB-CB 4.44Å; A154-I193 HydrophobicContact CB-CD1 4.48Å; A154-I193 HydrophobicContact CB-CG2 4.17Å; A154-R194 WeakPolarHBondContact O-CG 3.27Å; A154-R194 PolarHBondContact O-NE 3.12Å; A154-R194 VanDerWaalsContact O-NE 3.07Å
155	V	85.1	Confident	86.6	Confident	45 Å²	45	52.6 Å²	52.6	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-89.4	-46.6	179	177	0	0	0	0	112	R151 E152 M153 I193	R151-V155 WeakPolarHBondContact O-CG2 3.41Å; R151-V155 PolarHBondContact O-N 3.39Å; E152-V155 PolarHBondContact O-N 2.99Å; E152-V155 VanDerWaalsContact O-N 3.12Å; M153-V155 PolarHBondContact O-N 3.3Å; V155-I193 HydrophobicContact CG2-CG2 3.84Å
156	K	85.1	Confident	86.7	Confident	156 Å²	156	54.1 Å²	54.1	68%	0.678	28%	0.276	S	S	*	.	H	α-helix	trans	-83.7	-23.3	-170.2	-67.1	174.5	-179.5	170.3	0	113.7	E152	E152-K156 HydrophobicContact CB-CD 4.49Å; E152-K156 WeakPolarHBondContact O-CB 3.37Å; E152-K156 WeakPolarHBondContact O-CG 3.35Å; E152-K156 PolarHBondContact O-N 3.27Å; E152-K156 IonicContact OE2-NZ 3.26Å; E152-K156 PolarHBondContact OE2-NZ 3.26Å
157	T	85.9	Confident	86.7	Confident	38 Å²	38	58.2 Å²	58.2	23%	0.233	29%	0.294	C	S	.	.			trans	-117.1	153.4	-172	77.2	0	0	0	0	112.4	M153 R194	M153-T157 HydrophobicContact CB-CG2 4.28Å; M153-T157 HydrophobicContact CE-CG2 4.45Å; M153-T157 HydrophobicContact CG-CG2 4.43Å; M153-T157 WeakPolarHBondContact O-CB 3.43Å; M153-T157 PolarHBondContact O-N 3.48Å; M153-T157 PolarHBondContact O-OG1 3Å; T157-R194 PolarHBondContact O-NH2 3.48Å
158	K	82	Confident	86.8	Confident	192 Å²	192	57.8 Å²	57.8	84%	0.835	29%	0.293	S	S	*	.			trans	-92.1	8.6	171.3	-64.4	-176	-179.6	179.2	0	113.4
159	L	84.4	Confident	86.9	Confident	74 Å²	74	57.2 Å²	57.2	39%	0.387	29%	0.289	S	S	.	.			trans	-59.6	150.6	179.1	-69.4	175.2	0	0	0	111.1	M153 A163 I164 R194	M153-L159 HydrophobicContact CE-CD1 3.67Å; L159-A163 HydrophobicContact CB-CB 4.15Å; L159-A163 HydrophobicContact CD2-CB 4.47Å; L159-I164 HydrophobicContact CB-CD1 4.45Å; L159-I164 HydrophobicContact CB-CG1 3.81Å; L159-R194 PolarHBondContact O-NH1 3.16Å; L159-R194 PolarHBondContact O-NH2 2.7Å
160	S	85.6	Confident	86.8	Confident	63 Å²	63	62.2 Å²	62.2	44%	0.441	30%	0.304	S	S	.	.			trans	-63.7	153.3	175.2	75.9	0	0	0	0	110.5	H162 A163 I164	S160-H162 PolarHBondContact O-N 3.38Å; S160-H162 VanDerWaalsContact O-N 3.1Å; S160-A163 PolarHBondContact O-N 3.23Å; S160-A163 WeakPolarHBondContact OG-CB 3.41Å; S160-A163 PolarHBondContact OG-N 3.42Å; S160-I164 PolarHBondContact O-N 3.17Å
161	P	85.4	Confident	86.3	Confident	32 Å²	32	66.3 Å²	66.3	21%	0.208	35%	0.347	C	S	.	.	H	α-helix	trans	-53.5	-31.6	173.9	-27.8	35.9	0	0	0	113.2	Y165 V187 I190	P161-Y165 PolarHBondContact O-N 2.81Å; P161-V187 HydrophobicContact CB-CB 4.45Å; P161-V187 HydrophobicContact CB-CG1 3.92Å; P161-V187 HydrophobicContact CB-CG2 4.36Å; P161-I190 HydrophobicContact CB-CB 4.22Å; P161-I190 HydrophobicContact CB-CG2 3.86Å; P161-I190 HydrophobicContact CG-CG2 4.03Å
162	H	86	Confident	86.1	Confident	74 Å²	74	65.4 Å²	65.4	34%	0.343	35%	0.345	S	S	.	.	H	α-helix	trans	-70.5	-43	174.8	-172.1	14.4	0	0	0	112.5	S160 Y165 Q166 K183	S160-H162 PolarHBondContact O-N 3.38Å; S160-H162 VanDerWaalsContact O-N 3.1Å; H162-Y165 WeakPolarHBondContact O-CB 3.44Å; H162-Y165 PolarHBondContact O-N 3.48Å; H162-Q166 PolarHBondContact CE1-NE2 3.12Å; H162-Q166 PolarHBondContact O-N 3.26Å; H162-K183 WeakPolarHBondContact CE1-CE 3.23Å; H162-K183 PolarHBondContact CE1-NZ 3.4Å; H162-K183 VanDerWaalsContact ND1-CE 3.26Å; H162-K183 WeakPolarHBondContact ND1-CE 3.44Å; H162-K183 PolarHBondContact ND1-NZ 3.02Å; H162-K183 PolarHBondContact NE2-NZ 2.78Å
163	A	85.9	Confident	85.9	Confident	24 Å²	24	63.6 Å²	63.6	20%	0.198	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-38.3	177.3	0	0	0	0	0	111.8	L159 S160 Y165 Q166 E167	L159-A163 HydrophobicContact CB-CB 4.15Å; L159-A163 HydrophobicContact CD2-CB 4.47Å; S160-A163 PolarHBondContact O-N 3.23Å; S160-A163 WeakPolarHBondContact OG-CB 3.41Å; S160-A163 PolarHBondContact OG-N 3.42Å; A163-Y165 VanDerWaalsContact C-N 3.34Å; A163-Y165 PolarHBondContact O-N 3.23Å; A163-Q166 PolarHBondContact O-N 2.82Å; A163-E167 PolarHBondContact O-N 3.06Å
164	I	88.1	Confident	85.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-45.6	172.7	-67.2	171.2	0	0	0	110.5	A150 M153 L159 S160 Q166 E167 V168 I190 R194	A150-I164 HydrophobicContact CB-CG2 4.41Å; M153-I164 HydrophobicContact CB-CD1 4.28Å; M153-I164 HydrophobicContact CB-CG1 4.19Å; M153-I164 HydrophobicContact CB-CG2 3.87Å; M153-I164 HydrophobicContact CE-CG1 4.45Å; M153-I164 HydrophobicContact SD-CG2 4.25Å; L159-I164 HydrophobicContact CB-CD1 4.45Å; L159-I164 HydrophobicContact CB-CG1 3.81Å; S160-I164 PolarHBondContact O-N 3.17Å; I164-Q166 VanDerWaalsContact C-N 3.32Å; I164-Q166 PolarHBondContact O-N 2.98Å; I164-E167 PolarHBondContact O-N 3.14Å; I164-V168 HydrophobicContact CG2-CG2 4.08Å; I164-V168 WeakPolarHBondContact O-CB 3.39Å; I164-V168 WeakPolarHBondContact O-CG2 3.18Å; I164-V168 PolarHBondContact O-N 2.81Å; I164-I190 HydrophobicContact CB-CD1 3.96Å; I164-I190 HydrophobicContact CD1-CG2 3.95Å; I164-I190 HydrophobicContact CG2-CD1 3.68Å; I164-I190 HydrophobicContact CG2-CG1 4.42Å; I164-R194 VanDerWaalsContact CD1-NH2 3.3Å
165	Y	88.4	Confident	85.3	Confident	35 Å²	35	70.7 Å²	70.7	14%	0.137	39%	0.387	C	S	.	.	H	α-helix	trans	-57	-47.6	175.8	174.7	-88.4	0	0	0	111.2	P161 H162 A163 E167 V168 T169 K183 L186	P161-Y165 PolarHBondContact O-N 2.81Å; H162-Y165 WeakPolarHBondContact O-CB 3.44Å; H162-Y165 PolarHBondContact O-N 3.48Å; A163-Y165 VanDerWaalsContact C-N 3.34Å; A163-Y165 PolarHBondContact O-N 3.23Å; Y165-E167 PolarHBondContact O-N 3.02Å; Y165-V168 PolarHBondContact O-N 3.32Å; Y165-T169 HydrophobicContact CD1-CG2 4.5Å; Y165-T169 HydrophobicContact CD2-CG2 4.45Å; Y165-T169 HydrophobicContact CE1-CG2 4.1Å; Y165-T169 HydrophobicContact CE2-CG2 4.06Å; Y165-T169 WeakPolarHBondContact O-CG2 3.08Å; Y165-T169 PolarHBondContact O-N 2.94Å; Y165-T169 PolarHBondContact O-OG1 3.49Å; Y165-K183 HydrophobicContact CD1-CD 4.23Å; Y165-K183 HydrophobicContact CD1-CG 3.98Å; Y165-K183 HydrophobicContact CD2-CB 4.24Å; Y165-K183 HydrophobicContact CD2-CG 4.1Å; Y165-K183 HydrophobicContact CE1-CB 4.21Å; Y165-K183 HydrophobicContact CE1-CD 4.1Å; Y165-K183 HydrophobicContact CE1-CG 3.98Å; Y165-K183 HydrophobicContact CE2-CB 3.78Å; Y165-K183 HydrophobicContact CE2-CG 4.08Å; Y165-K183 HydrophobicContact CG-CG 4.04Å; Y165-L186 HydrophobicContact CD2-CB 4.19Å; Y165-L186 HydrophobicContact CD2-CD1 4.16Å; Y165-L186 HydrophobicContact CD2-CD2 4.41Å; Y165-L186 HydrophobicContact CD2-CG 4.49Å; Y165-L186 HydrophobicContact CE2-CD1 4.39Å
166	Q	87.5	Confident	85.2	Confident	106 Å²	106	68.7 Å²	68.7	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-59.9	-45.6	179	-75.1	175	-32.9	0	0	112.1	H162 A163 I164 T169 K170	H162-Q166 PolarHBondContact CE1-NE2 3.12Å; H162-Q166 PolarHBondContact O-N 3.26Å; A163-Q166 PolarHBondContact O-N 2.82Å; I164-Q166 VanDerWaalsContact C-N 3.32Å; I164-Q166 PolarHBondContact O-N 2.98Å; Q166-T169 PolarHBondContact O-N 3.4Å; Q166-T169 PolarHBondContact O-OG1 2.94Å; Q166-T169 VanDerWaalsContact O-OG1 3.05Å; Q166-K170 PolarHBondContact O-N 3.5Å
167	E	88.5	Confident	85.1	Confident	90 Å²	90	63.1 Å²	63.1	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-41.2	-179.2	-162.5	62.6	-153.3	0	0	112.1	M153 A163 I164 Y165 T169 K170	M153-E167 HydrophobicContact CE-CB 3.83Å; M153-E167 HydrophobicContact CE-CG 3.79Å; M153-E167 HydrophobicContact SD-CB 4.4Å; M153-E167 HydrophobicContact SD-CG 4.43Å; A163-E167 PolarHBondContact O-N 3.06Å; I164-E167 PolarHBondContact O-N 3.14Å; Y165-E167 PolarHBondContact O-N 3.02Å; E167-T169 VanDerWaalsContact C-N 3.27Å; E167-T169 PolarHBondContact O-N 2.95Å; E167-K170 WeakPolarHBondContact O-CB 3.32Å; E167-K170 PolarHBondContact O-N 3.44Å; E167-K170 WeakPolarHBondContact OE1-CD 3.31Å; E167-K170 IonicContact OE1-NZ 2.6Å; E167-K170 PolarHBondContact OE1-NZ 3.17Å; E167-K170 VanDerWaalsContact OE1-NZ 3.13Å; E167-K170 IonicContact OE2-NZ 3.62Å; E167-K170 PolarHBondContact OE2-NZ 3.18Å
168	V	89.1	Confident	84.9	Confident	18 Å²	18	68.8 Å²	68.8	11%	0.109	38%	0.376	C	S	.	.	H	α-helix	trans	-66.8	-31.3	178.1	170.4	0	0	0	0	111.9	A146 A149 A150 M153 I164 Y165 M172	A146-V168 VanDerWaalsContact CA-CG1 3.44Å; A146-V168 HydrophobicContact CB-CG1 3.47Å; A146-V168 VanDerWaalsContact CB-CG1 3.47Å; A146-V168 VanDerWaalsContact O-CG1 3.23Å; A146-V168 WeakPolarHBondContact O-CG1 3.36Å; A149-V168 HydrophobicContact CB-CG2 4.2Å; A150-V168 HydrophobicContact CB-CG2 4.06Å; M153-V168 HydrophobicContact SD-CG2 3.79Å; I164-V168 HydrophobicContact CG2-CG2 4.08Å; I164-V168 WeakPolarHBondContact O-CB 3.39Å; I164-V168 WeakPolarHBondContact O-CG2 3.18Å; I164-V168 PolarHBondContact O-N 2.81Å; Y165-V168 PolarHBondContact O-N 3.32Å; V168-M172 VanDerWaalsContact O-SD 3.4Å
169	T	88.1	Confident	84.9	Confident	24 Å²	24	65.1 Å²	65.1	15%	0.147	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.1	176.7	57.4	0	0	0	0	114	Y165 Q166 E167 G171 M172 V177 I180	Y165-T169 HydrophobicContact CD1-CG2 4.5Å; Y165-T169 HydrophobicContact CD2-CG2 4.45Å; Y165-T169 HydrophobicContact CE1-CG2 4.1Å; Y165-T169 HydrophobicContact CE2-CG2 4.06Å; Y165-T169 WeakPolarHBondContact O-CG2 3.08Å; Y165-T169 PolarHBondContact O-N 2.94Å; Y165-T169 PolarHBondContact O-OG1 3.49Å; Q166-T169 PolarHBondContact O-N 3.4Å; Q166-T169 PolarHBondContact O-OG1 2.94Å; Q166-T169 VanDerWaalsContact O-OG1 3.05Å; E167-T169 VanDerWaalsContact C-N 3.27Å; E167-T169 PolarHBondContact O-N 2.95Å; T169-G171 PolarHBondContact O-N 3.34Å; T169-M172 PolarHBondContact O-N 2.9Å; T169-V177 HydrophobicContact CG2-CG1 4.42Å; T169-I180 HydrophobicContact CG2-CD1 4.03Å
170	K	86.9	Confident	84.8	Confident	144 Å²	144	62 Å²	62	63%	0.626	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	127.6	-173.9	-169.4	179.5	178	-177.3	0	110.2	Q166 E167 M172	Q166-K170 PolarHBondContact O-N 3.5Å; E167-K170 WeakPolarHBondContact O-CB 3.32Å; E167-K170 PolarHBondContact O-N 3.44Å; E167-K170 WeakPolarHBondContact OE1-CD 3.31Å; E167-K170 IonicContact OE1-NZ 2.6Å; E167-K170 PolarHBondContact OE1-NZ 3.17Å; E167-K170 VanDerWaalsContact OE1-NZ 3.13Å; E167-K170 IonicContact OE2-NZ 3.62Å; E167-K170 PolarHBondContact OE2-NZ 3.18Å; K170-M172 VanDerWaalsContact C-N 3.28Å; K170-M172 PolarHBondContact O-N 3.33Å
171	G	79.3	Confident	84.5	Confident	87 Å²	87	61.1 Å²	61.1	90%	0.897	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	-1.3	-179.6	0	0	0	0	0	115.3	T169	T169-G171 PolarHBondContact O-N 3.34Å
172	M	83.9	Confident	84.3	Confident	40 Å²	40	66 Å²	66	20%	0.197	36%	0.356	C	S	.	.			trans	-78.3	145.7	174	-57.3	-177.2	87	0	0	110.6	Y142 A146 V168 T169 K170 A176 V177 I180	Y142-M172 HydrophobicContact CD1-CE 4.32Å; Y142-M172 HydrophobicContact CG-CE 4.35Å; A146-M172 HydrophobicContact CB-CE 4.49Å; V168-M172 VanDerWaalsContact O-SD 3.4Å; T169-M172 PolarHBondContact O-N 2.9Å; K170-M172 VanDerWaalsContact C-N 3.28Å; K170-M172 PolarHBondContact O-N 3.33Å; M172-A176 HydrophobicContact CB-CB 4.42Å; M172-A176 HydrophobicContact CE-CB 4.36Å; M172-V177 HydrophobicContact CB-CG2 3.77Å; M172-I180 HydrophobicContact CE-CD1 3.68Å; M172-I180 HydrophobicContact CE-CG1 4.45Å; M172-I180 HydrophobicContact SD-CD1 3.48Å; M172-I180 WeakPolarHBondContact SD-CD1 3.44Å
173	S	82.8	Confident	84.1	Confident	56 Å²	56	66.9 Å²	66.9	39%	0.392	36%	0.359	S	S	.	.			trans	-64.5	152.3	173.6	74	0	0	0	0	111	D175 A176 V177	S173-D175 PolarHBondContact O-N 3.38Å; S173-D175 VanDerWaalsContact O-N 3.13Å; S173-A176 PolarHBondContact O-N 2.89Å; S173-A176 WeakPolarHBondContact OG-CB 3.06Å; S173-A176 PolarHBondContact OG-N 2.91Å; S173-V177 WeakPolarHBondContact O-CG2 3.49Å; S173-V177 PolarHBondContact O-N 3.31Å
174	P	82.9	Confident	84	Confident	99 Å²	99	74.2 Å²	74.2	64%	0.643	38%	0.382	S	S	*	.	H	α-helix	trans	-54	-34.5	178.5	-27.2	34.8	0	0	0	113.6	K178	P174-K178 WeakPolarHBondContact O-CG 3.45Å; P174-K178 PolarHBondContact O-N 2.95Å
175	D	81.1	Confident	83.8	Confident	87 Å²	87	78.2 Å²	78.2	47%	0.465	40%	0.403	S	S	.	.	H	α-helix	trans	-76.2	-32.3	179.4	-65.3	-37.3	0	0	0	113.2	F139 S173 K178	F139-D175 HydrophobicContact CE2-CB 4.49Å; F139-D175 HydrophobicContact CZ-CB 4.48Å; S173-D175 PolarHBondContact O-N 3.38Å; S173-D175 VanDerWaalsContact O-N 3.13Å; D175-K178 PolarHBondContact O-N 3.14Å; D175-K178 IonicContact OD1-NZ 3.72Å; D175-K178 PolarHBondContact OD1-NZ 3.07Å
176	A	81.6	Confident	83.5	Confident	4 Å²	4	76.7 Å²	76.7	3%	0.033	40%	0.396	C	S	.	.	H	α-helix	trans	-66.6	-40.9	171.1	0	0	0	0	0	111.1	F139 M172 S173 K178 K179 I180	F139-A176 HydrophobicContact CD1-CB 4.05Å; F139-A176 HydrophobicContact CE1-CB 4.48Å; F139-A176 HydrophobicContact CG-CB 4.24Å; M172-A176 HydrophobicContact CB-CB 4.42Å; M172-A176 HydrophobicContact CE-CB 4.36Å; S173-A176 PolarHBondContact O-N 2.89Å; S173-A176 WeakPolarHBondContact OG-CB 3.06Å; S173-A176 PolarHBondContact OG-N 2.91Å; A176-K178 VanDerWaalsContact C-N 3.31Å; A176-K178 PolarHBondContact O-N 3.07Å; A176-K179 PolarHBondContact O-N 3.05Å; A176-I180 PolarHBondContact O-N 3.21Å
177	V	83.3	Confident	83.5	Confident	39 Å²	39	73.6 Å²	73.6	24%	0.236	39%	0.385	C	S	.	.	H	α-helix	trans	-61.6	-38	177.5	177.7	0	0	0	0	111.6	T169 M172 S173 K179 I180	T169-V177 HydrophobicContact CG2-CG1 4.42Å; M172-V177 HydrophobicContact CB-CG2 3.77Å; S173-V177 WeakPolarHBondContact O-CG2 3.49Å; S173-V177 PolarHBondContact O-N 3.31Å; V177-K179 PolarHBondContact O-N 3.23Å; V177-I180 PolarHBondContact O-N 3.32Å
178	K	83	Confident	83.2	Confident	157 Å²	157	71.8 Å²	71.8	68%	0.683	39%	0.386	S	S	*	.	H	α-helix	trans	-61.3	-22.5	175.5	-72.2	172.5	-167.6	158.4	0	113.7	P174 D175 A176	P174-K178 WeakPolarHBondContact O-CG 3.45Å; P174-K178 PolarHBondContact O-N 2.95Å; D175-K178 PolarHBondContact O-N 3.14Å; D175-K178 IonicContact OD1-NZ 3.72Å; D175-K178 PolarHBondContact OD1-NZ 3.07Å; A176-K178 VanDerWaalsContact C-N 3.31Å; A176-K178 PolarHBondContact O-N 3.07Å
179	K	81.1	Confident	83.1	Confident	114 Å²	114	72.2 Å²	72.2	50%	0.496	39%	0.386	S	S	.	.	H	α-helix	trans	-90.8	-14.9	-179.6	-61.9	-64.1	-175.4	177.2	0	113.6	F139 I143 A176 V177	F139-K179 HydrophobicContact CD2-CG 4.04Å; I143-K179 HydrophobicContact CD1-CB 3.85Å; I143-K179 WeakPolarHBondContact CD1-O 3.4Å; I143-K179 HydrophobicContact CG1-CB 4.16Å; A176-K179 PolarHBondContact O-N 3.05Å; V177-K179 PolarHBondContact O-N 3.23Å
180	I	81.7	Confident	83	Confident	10 Å²	10	71 Å²	71	5%	0.051	38%	0.379	C	S	.	.	S	Bend	trans	-70.7	146.3	172.4	-61.5	172	0	0	0	108.8	A146 T169 M172 A176 V177 E182 L186	A146-I180 HydrophobicContact CB-CD1 3.97Å; A146-I180 HydrophobicContact CB-CG1 4.39Å; T169-I180 HydrophobicContact CG2-CD1 4.03Å; M172-I180 HydrophobicContact CE-CD1 3.68Å; M172-I180 HydrophobicContact CE-CG1 4.45Å; M172-I180 HydrophobicContact SD-CD1 3.48Å; M172-I180 WeakPolarHBondContact SD-CD1 3.44Å; A176-I180 PolarHBondContact O-N 3.21Å; V177-I180 PolarHBondContact O-N 3.32Å; I180-E182 PolarHBondContact O-N 2.89Å; I180-L186 HydrophobicContact CG2-CD1 3.5Å
181	P	79.3	Confident	82.8	Confident	43 Å²	43	67.5 Å²	67.5	28%	0.279	37%	0.37	S	S	.	.			trans	-50.7	142.5	173.2	-28.5	35.9	0	0	0	112.2	M147 K183 L185	M147-P181 HydrophobicContact CE-CG 4.35Å; M147-P181 HydrophobicContact SD-CG 3.89Å; P181-K183 PolarHBondContact O-N 3.44Å; P181-L185 HydrophobicContact CB-CB 4.46Å
182	E	80.8	Confident	83	Confident	134 Å²	134	71 Å²	71	63%	0.626	36%	0.356	S	S	*	.			trans	-45.4	137.9	-179.8	-68.3	-176.5	171.2	0	0	112	I180 R184 L185 L186	I180-E182 PolarHBondContact O-N 2.89Å; E182-R184 CarbonylContact O-C 3.46Å; E182-R184 PolarHBondContact O-N 3.5Å; E182-L185 HydrophobicContact CB-CD1 4.47Å; E182-L185 HydrophobicContact CB-CG 4.4Å; E182-L185 WeakPolarHBondContact O-CA 3.42Å; E182-L185 WeakPolarHBondContact O-CB 3.47Å; E182-L185 PolarHBondContact O-N 3.13Å; E182-L186 PolarHBondContact O-N 3.28Å
183	K	83.5	Confident	83	Confident	93 Å²	93	70.9 Å²	70.9	40%	0.404	36%	0.356	S	S	.	.	H	α-helix	trans	-40.5	-42.7	177.9	-179.5	-179	177.6	-177.8	0	113.2	H162 Y165 P181 L185 L186 V187	H162-K183 WeakPolarHBondContact CE1-CE 3.23Å; H162-K183 PolarHBondContact CE1-NZ 3.4Å; H162-K183 VanDerWaalsContact ND1-CE 3.26Å; H162-K183 WeakPolarHBondContact ND1-CE 3.44Å; H162-K183 PolarHBondContact ND1-NZ 3.02Å; H162-K183 PolarHBondContact NE2-NZ 2.78Å; Y165-K183 HydrophobicContact CD1-CD 4.23Å; Y165-K183 HydrophobicContact CD1-CG 3.98Å; Y165-K183 HydrophobicContact CD2-CB 4.24Å; Y165-K183 HydrophobicContact CD2-CG 4.1Å; Y165-K183 HydrophobicContact CE1-CB 4.21Å; Y165-K183 HydrophobicContact CE1-CD 4.1Å; Y165-K183 HydrophobicContact CE1-CG 3.98Å; Y165-K183 HydrophobicContact CE2-CB 3.78Å; Y165-K183 HydrophobicContact CE2-CG 4.08Å; Y165-K183 HydrophobicContact CG-CG 4.04Å; P181-K183 PolarHBondContact O-N 3.44Å; K183-L185 PolarHBondContact O-N 3.47Å; K183-L186 PolarHBondContact O-N 2.93Å; K183-V187 HydrophobicContact CG-CG2 4.38Å; K183-V187 WeakPolarHBondContact O-CB 3.49Å; K183-V187 VanDerWaalsContact O-CG2 3.24Å; K183-V187 WeakPolarHBondContact O-CG2 3.34Å; K183-V187 PolarHBondContact O-N 3.02Å
184	R	83.5	Confident	83.1	Confident	179 Å²	179	69.9 Å²	69.9	68%	0.675	34%	0.344	S	S	*	.	H	α-helix	trans	-54.7	-48.9	175.5	166.3	179.8	123.6	80.6	-1.4	113.1	E182 A188	E182-R184 CarbonylContact O-C 3.46Å; E182-R184 PolarHBondContact O-N 3.5Å; R184-A188 WeakPolarHBondContact O-CB 3.4Å; R184-A188 PolarHBondContact O-N 3.45Å
185	L	83.3	Confident	82.9	Confident	84 Å²	84	75.4 Å²	75.4	44%	0.44	35%	0.351	S	S	.	.	H	α-helix	trans	-69.3	-39.9	-176.8	-63.2	178.2	0	0	0	110.8	P181 E182 K183 A188 M189	P181-L185 HydrophobicContact CB-CB 4.46Å; E182-L185 HydrophobicContact CB-CD1 4.47Å; E182-L185 HydrophobicContact CB-CG 4.4Å; E182-L185 WeakPolarHBondContact O-CA 3.42Å; E182-L185 WeakPolarHBondContact O-CB 3.47Å; E182-L185 PolarHBondContact O-N 3.13Å; K183-L185 PolarHBondContact O-N 3.47Å; L185-A188 PolarHBondContact O-N 2.84Å; L185-M189 WeakPolarHBondContact O-CB 3.47Å; L185-M189 PolarHBondContact O-N 3.05Å
186	L	83	Confident	82.7	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-43.2	179.1	-143	153.3	0	0	0	111	M147 A150 Y165 I180 E182 K183 A188 M189 I190	M147-L186 HydrophobicContact SD-CD1 3.98Å; M147-L186 HydrophobicContact SD-CG 4.18Å; A150-L186 HydrophobicContact CB-CD2 3.63Å; Y165-L186 HydrophobicContact CD2-CB 4.19Å; Y165-L186 HydrophobicContact CD2-CD1 4.16Å; Y165-L186 HydrophobicContact CD2-CD2 4.41Å; Y165-L186 HydrophobicContact CD2-CG 4.49Å; Y165-L186 HydrophobicContact CE2-CD1 4.39Å; I180-L186 HydrophobicContact CG2-CD1 3.5Å; E182-L186 PolarHBondContact O-N 3.28Å; K183-L186 PolarHBondContact O-N 2.93Å; L186-A188 PolarHBondContact O-N 3.28Å; L186-M189 HydrophobicContact CD2-CE 4.36Å; L186-M189 WeakPolarHBondContact O-CB 3.41Å; L186-M189 PolarHBondContact O-N 3.08Å; L186-I190 HydrophobicContact CD2-CD1 3.64Å; L186-I190 HydrophobicContact CD2-CG1 4.26Å; L186-I190 WeakPolarHBondContact O-CD1 3.33Å; L186-I190 VanDerWaalsContact O-CG1 3.3Å; L186-I190 WeakPolarHBondContact O-CG1 3.26Å; L186-I190 PolarHBondContact O-N 3.25Å
187	V	86.1	Confident	82.4	Confident	41 Å²	41	85.3 Å²	85.3	25%	0.248	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-42	171.7	167.3	0	0	0	0	111.7	P161 K183 M189 I190 T191	P161-V187 HydrophobicContact CB-CB 4.45Å; P161-V187 HydrophobicContact CB-CG1 3.92Å; P161-V187 HydrophobicContact CB-CG2 4.36Å; K183-V187 HydrophobicContact CG-CG2 4.38Å; K183-V187 WeakPolarHBondContact O-CB 3.49Å; K183-V187 VanDerWaalsContact O-CG2 3.24Å; K183-V187 WeakPolarHBondContact O-CG2 3.34Å; K183-V187 PolarHBondContact O-N 3.02Å; V187-M189 VanDerWaalsContact C-N 3.35Å; V187-I190 PolarHBondContact O-N 3.1Å; V187-T191 WeakPolarHBondContact O-CB 3.26Å; V187-T191 PolarHBondContact O-N 3.11Å; V187-T191 PolarHBondContact O-OG1 3.32Å
188	A	83.2	Confident	81.5	Confident	53 Å²	53	86.4 Å²	86.4	44%	0.438	41%	0.41	S	S	.	.	H	α-helix	trans	-64.1	-39.8	176.1	0	0	0	0	0	111.9	R184 L185 L186 R192	R184-A188 WeakPolarHBondContact O-CB 3.4Å; R184-A188 PolarHBondContact O-N 3.45Å; L185-A188 PolarHBondContact O-N 2.84Å; L186-A188 PolarHBondContact O-N 3.28Å; A188-R192 WeakPolarHBondContact O-CB 3.38Å; A188-R192 PolarHBondContact O-N 2.97Å
189	M	86	Confident	80.3	Confident	26 Å²	26	82.6 Å²	82.6	13%	0.128	40%	0.395	C	S	.	.	H	α-helix	trans	-60.8	-51.2	173.9	-178.6	-169.1	74.8	0	0	111.4	M147 A150 R151 L185 L186 V187 T191 R192 I193	M147-M189 HydrophobicContact CE-CE 4.25Å; M147-M189 HydrophobicContact CE-SD 3.62Å; A150-M189 HydrophobicContact CB-CE 3.96Å; R151-M189 HydrophobicContact CG-CE 3.85Å; R151-M189 HydrophobicContact CG-SD 4.11Å; L185-M189 WeakPolarHBondContact O-CB 3.47Å; L185-M189 PolarHBondContact O-N 3.05Å; L186-M189 HydrophobicContact CD2-CE 4.36Å; L186-M189 WeakPolarHBondContact O-CB 3.41Å; L186-M189 PolarHBondContact O-N 3.08Å; V187-M189 VanDerWaalsContact C-N 3.35Å; M189-T191 VanDerWaalsContact C-N 3.32Å; M189-T191 PolarHBondContact O-N 3.13Å; M189-R192 WeakPolarHBondContact O-CB 3.14Å; M189-R192 PolarHBondContact O-N 3.38Å; M189-I193 HydrophobicContact CE-CD1 4.5Å; M189-I193 HydrophobicContact CG-CD1 3.96Å; M189-I193 WeakPolarHBondContact O-CG1 3.47Å; M189-I193 PolarHBondContact O-N 3.3Å
190	I	86.2	Confident	78.8	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-58.7	-46.1	179.5	-66.9	159.9	0	0	0	110.6	A154 P161 I164 L186 V187 R192 I193 R194	A154-I190 HydrophobicContact CB-CB 4.33Å; A154-I190 HydrophobicContact CB-CG1 4.28Å; A154-I190 HydrophobicContact CB-CG2 3.83Å; P161-I190 HydrophobicContact CB-CB 4.22Å; P161-I190 HydrophobicContact CB-CG2 3.86Å; P161-I190 HydrophobicContact CG-CG2 4.03Å; I164-I190 HydrophobicContact CB-CD1 3.96Å; I164-I190 HydrophobicContact CD1-CG2 3.95Å; I164-I190 HydrophobicContact CG2-CD1 3.68Å; I164-I190 HydrophobicContact CG2-CG1 4.42Å; L186-I190 HydrophobicContact CD2-CD1 3.64Å; L186-I190 HydrophobicContact CD2-CG1 4.26Å; L186-I190 WeakPolarHBondContact O-CD1 3.33Å; L186-I190 VanDerWaalsContact O-CG1 3.3Å; L186-I190 WeakPolarHBondContact O-CG1 3.26Å; L186-I190 PolarHBondContact O-N 3.25Å; V187-I190 PolarHBondContact O-N 3.1Å; I190-R192 VanDerWaalsContact C-N 3.33Å; I190-R192 PolarHBondContact O-N 3Å; I190-I193 PolarHBondContact O-N 3.26Å; I190-R194 PolarHBondContact O-N 2.78Å; I190-R194 VanDerWaalsContact O-N 3.11Å
191	T	83.8	Confident	77.2	Confident	70 Å²	70	90.5 Å²	90.5	43%	0.429	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-41.4	179.1	-52.6	0	0	0	0	111.2	V187 M189 R194 R195	V187-T191 WeakPolarHBondContact O-CB 3.26Å; V187-T191 PolarHBondContact O-N 3.11Å; V187-T191 PolarHBondContact O-OG1 3.32Å; M189-T191 VanDerWaalsContact C-N 3.32Å; M189-T191 PolarHBondContact O-N 3.13Å; T191-R194 PolarHBondContact O-N 3.26Å; T191-R195 WeakPolarHBondContact O-CB 3.31Å; T191-R195 PolarHBondContact O-N 3.44Å
192	R	83.2	Confident	75.5	Confident	161 Å²	161	97.6 Å²	97.6	61%	0.608	47%	0.471	S	S	*	.	H	α-helix	trans	-63	-45.1	175.9	-179.1	-177.5	174.3	-142.1	-2.7	112.1	A188 M189 I190 R194 R195 L196	A188-R192 WeakPolarHBondContact O-CB 3.38Å; A188-R192 PolarHBondContact O-N 2.97Å; M189-R192 WeakPolarHBondContact O-CB 3.14Å; M189-R192 PolarHBondContact O-N 3.38Å; I190-R192 VanDerWaalsContact C-N 3.33Å; I190-R192 PolarHBondContact O-N 3Å; R192-R194 VanDerWaalsContact C-N 3.33Å; R192-R194 PolarHBondContact O-N 2.88Å; R192-R195 PolarHBondContact O-N 3.19Å; R192-L196 HydrophobicContact CG-CD1 4.08Å; R192-L196 HydrophobicContact CG-CG 4.48Å; R192-L196 WeakPolarHBondContact O-CG 3.14Å; R192-L196 PolarHBondContact O-N 3.24Å
193	I	84.1	Confident	73.6	Confident	36 Å²	36	97.1 Å²	97.1	19%	0.185	48%	0.476	C	S	.	.	H	α-helix	trans	-59.8	-44.9	179.4	-70.3	167.4	0	0	0	110.7	R151 A154 V155 M189 I190 L196 R197	R151-I193 HydrophobicContact CB-CD1 4.27Å; R151-I193 HydrophobicContact CG-CD1 3.8Å; A154-I193 HydrophobicContact CB-CB 4.44Å; A154-I193 HydrophobicContact CB-CD1 4.48Å; A154-I193 HydrophobicContact CB-CG2 4.17Å; V155-I193 HydrophobicContact CG2-CG2 3.84Å; M189-I193 HydrophobicContact CE-CD1 4.5Å; M189-I193 HydrophobicContact CG-CD1 3.96Å; M189-I193 WeakPolarHBondContact O-CG1 3.47Å; M189-I193 PolarHBondContact O-N 3.3Å; I190-I193 PolarHBondContact O-N 3.26Å; I193-L196 PolarHBondContact O-N 3.2Å; I193-R197 PolarHBondContact O-N 2.74Å
194	R	84	Confident	71.4	Confident	36 Å²	36	98 Å²	98	14%	0.136	49%	0.492	C	S	.	.	H	α-helix	trans	-65.5	-42.9	178.1	-74.3	-177.5	171.8	171.1	-2.4	112.9	A154 T157 L159 I164 I190 T191 R192 L196 R197 G198 M199	A154-R194 WeakPolarHBondContact O-CG 3.27Å; A154-R194 PolarHBondContact O-NE 3.12Å; A154-R194 VanDerWaalsContact O-NE 3.07Å; T157-R194 PolarHBondContact O-NH2 3.48Å; L159-R194 PolarHBondContact O-NH1 3.16Å; L159-R194 PolarHBondContact O-NH2 2.7Å; I164-R194 VanDerWaalsContact CD1-NH2 3.3Å; I190-R194 PolarHBondContact O-N 2.78Å; I190-R194 VanDerWaalsContact O-N 3.11Å; T191-R194 PolarHBondContact O-N 3.26Å; R192-R194 VanDerWaalsContact C-N 3.33Å; R192-R194 PolarHBondContact O-N 2.88Å; R194-L196 PolarHBondContact O-N 3.36Å; R194-R197 PolarHBondContact O-N 2.67Å; R194-G198 PolarHBondContact O-N 2.85Å; R194-M199 HydrophobicContact CB-CB 4.17Å; R194-M199 HydrophobicContact CG-SD 4.23Å; R194-M199 PolarHBondContact O-N 2.59Å
195	R	79.6	Confident	69.2	Low	214 Å²	214	96.9 Å²	96.9	81%	0.808	50%	0.498	S	S	*	.	H	α-helix	trans	-60.6	-44.4	176.1	-174.5	-179.8	176.9	-173.2	-0.6	112.1	T191 R192 R197 G198	T191-R195 WeakPolarHBondContact O-CB 3.31Å; T191-R195 PolarHBondContact O-N 3.44Å; R192-R195 PolarHBondContact O-N 3.19Å; R195-R197 PolarHBondContact O-N 2.99Å; R195-G198 PolarHBondContact O-N 3.4Å; R195-G198 VanDerWaalsContact O-N 3.16Å
196	L	76.5	Confident	66.9	Low	128 Å²	128	98.6 Å²	98.6	67%	0.67	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-23.4	179.1	-74.7	173.5	0	0	0	113.3	R192 I193 R194	R192-L196 HydrophobicContact CG-CD1 4.08Å; R192-L196 HydrophobicContact CG-CG 4.48Å; R192-L196 WeakPolarHBondContact O-CG 3.14Å; R192-L196 PolarHBondContact O-N 3.24Å; I193-L196 PolarHBondContact O-N 3.2Å; R194-L196 PolarHBondContact O-N 3.36Å
197	R	74.8	Confident	64.5	Low	171 Å²	171	102.9 Å²	102.9	65%	0.645	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	8.8	175.9	-71.7	-169.1	171.5	-134.1	-1.2	113.8	I193 R194 R195 M199	I193-R197 PolarHBondContact O-N 2.74Å; R194-R197 PolarHBondContact O-N 2.67Å; R195-R197 PolarHBondContact O-N 2.99Å; R197-M199 HydrophobicContact CB-CG 4.42Å; R197-M199 PolarHBondContact O-N 3.42Å
198	G	64.3	Low	62.1	Low	63 Å²	63	106.8 Å²	106.8	65%	0.649	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.8	15.4	-179.4	0	0	0	0	0	114.4	R194 R195 E200	R194-G198 PolarHBondContact O-N 2.85Å; R195-G198 PolarHBondContact O-N 3.4Å; R195-G198 VanDerWaalsContact O-N 3.16Å; G198-E200 PolarHBondContact O-N 3.39Å; G198-E200 VanDerWaalsContact O-N 3.12Å
199	M	58.2	Low	59.7	Low	76 Å²	76	113.1 Å²	113.1	37%	0.374	59%	0.591	S	S	.	*			trans	-75.3	104	173	-61.2	-178.5	101.8	0	0	107.8	R194 R197	R194-M199 HydrophobicContact CB-CB 4.17Å; R194-M199 HydrophobicContact CG-SD 4.23Å; R194-M199 PolarHBondContact O-N 2.59Å; R197-M199 HydrophobicContact CB-CG 4.42Å; R197-M199 PolarHBondContact O-N 3.42Å
200	E	49.4	Very low	57.4	Low	174 Å²	174	117.9 Å²	117.9	81%	0.813	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.5	-176.3	-72	-173.5	156.4	0	0	112.3	G198 K202	G198-E200 PolarHBondContact O-N 3.39Å; G198-E200 VanDerWaalsContact O-N 3.12Å; E200-K202 PolarHBondContact O-N 3.36Å
201	P	48.3	Very low	54.8	Low	117 Å²	117	123.7 Å²	123.7	76%	0.76	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.3	170.2	-11.8	24.9	0	0	0	109.3	V203	P201-V203 PolarHBondContact O-N 2.97Å
202	K	43.8	Very low	52.5	Low	192 Å²	192	129.1 Å²	129.1	84%	0.835	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-49.6	117.4	168.4	-95	-174.6	172.6	-176.2	0	108.5	E200	E200-K202 PolarHBondContact O-N 3.36Å
203	V	41.6	Very low	50.3	Low	123 Å²	123	130.3 Å²	130.3	75%	0.745	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-49.7	129	166.3	-179.4	0	0	0	0	106.9	P201 L205	P201-V203 PolarHBondContact O-N 2.97Å; V203-L205 PolarHBondContact O-N 2.95Å; V203-L205 VanDerWaalsContact O-N 3.17Å
204	P	37.4	Very low	48.1	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-53.5	126.1	176.2	-23.7	33.2	0	0	0	109
205	L	35.8	Very low	46.2	Very low	156 Å²	156	139 Å²	139	82%	0.817	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-50.8	138.6	169	-78	163.1	0	0	0	108.3	V203 S207	V203-L205 PolarHBondContact O-N 2.95Å; V203-L205 VanDerWaalsContact O-N 3.17Å; L205-S207 PolarHBondContact O-N 3.26Å; L205-S207 VanDerWaalsContact O-N 3.11Å
206	P	35	Very low	44.8	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-52.9	125	176.7	4.1	-6.1	0	0	0	108.4
207	S	33.5	Very low	43.6	Very low	91 Å²	91	136.6 Å²	136.6	64%	0.636	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-62.6	142	173.4	-60.3	0	0	0	0	108.1	L205	L205-S207 PolarHBondContact O-N 3.26Å; L205-S207 VanDerWaalsContact O-N 3.11Å
208	P	34.6	Very low	42.7	Very low	124 Å²	124	129.6 Å²	129.6	81%	0.805	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-56.5	147.9	179.2	23.3	-31.6	0	0	0	110.3
209	E	34.4	Very low	42.2	Very low	185 Å²	185	131.3 Å²	131.3	86%	0.864	71%	0.707	S	S	*	*			trans	-43	139.1	-172.1	-73.5	171.1	156.2	0	0	113.1	T211	E209-T211 PolarHBondContact O-N 3.23Å
210	V	36.8	Very low	41.9	Very low	127 Å²	127	133.1 Å²	133.1	77%	0.77	73%	0.727	S	S	*	*			trans	-61.8	98.6	-179.9	179.7	0	0	0	0	108	E212	V210-E212 PolarHBondContact O-N 2.65Å
211	T	31.5	Very low	42.8	Very low	121 Å²	121	126.7 Å²	126.7	74%	0.742	70%	0.701	S	S	*	*			trans	-70.3	107.2	157.1	15.3	0	0	0	0	105.9	E209 K213	E209-T211 PolarHBondContact O-N 3.23Å; T211-K213 PolarHBondContact O-N 2.73Å
212	E	35.5	Very low	44.4	Very low	184 Å²	184	122.3 Å²	122.3	86%	0.86	67%	0.671	S	S	*	*			trans	-57.5	86.9	167.1	-68	-176.7	164.2	0	0	108.1	V210 E214	V210-E212 PolarHBondContact O-N 2.65Å; E212-E214 PolarHBondContact O-N 3.09Å
213	K	36.5	Very low	46.2	Very low	186 Å²	186	117.3 Å²	117.3	81%	0.809	65%	0.65	S	S	*	*			trans	-72.2	127.4	163.4	-74	-169.8	174.7	-171.5	0	106.7	T211	T211-K213 PolarHBondContact O-N 2.73Å
214	E	37.8	Very low	48.2	Very low	173 Å²	173	116.1 Å²	116.1	81%	0.808	64%	0.639	S	S	*	*			trans	-46.7	140.8	177.5	-71.5	-179.6	153.7	0	0	111.4	E212 V216	E212-E214 PolarHBondContact O-N 3.09Å; E214-V216 PolarHBondContact O-N 3.5Å
215	P	44.1	Very low	50.3	Low	83 Å²	83	112.2 Å²	112.2	54%	0.539	61%	0.611	S	S	.	*			trans	-65.2	111.5	-174.7	26.2	-32.8	0	0	0	110.2	E217	P215-E217 PolarHBondContact O-N 3.38Å
216	V	50.7	Low	52.4	Low	106 Å²	106	110.5 Å²	110.5	64%	0.642	60%	0.597	S	S	*	*			trans	-57.8	125.7	167.1	-176.5	0	0	0	0	107.6	E214 L218	E214-V216 PolarHBondContact O-N 3.5Å; V216-L218 HydrophobicContact CB-CD1 3.96Å; V216-L218 HydrophobicContact CB-CG 4.5Å; V216-L218 HydrophobicContact CG1-CD1 3.65Å; V216-L218 HydrophobicContact CG1-CG 3.93Å; V216-L218 PolarHBondContact O-N 3.17Å
217	E	50.7	Low	54.3	Low	184 Å²	184	106.2 Å²	106.2	86%	0.86	57%	0.569	S	S	*	*	S	Bend	trans	-64	67.5	179.8	-70.3	-173.2	150.7	0	0	112.6	P215	P215-E217 PolarHBondContact O-N 3.38Å
218	L	56.1	Low	55.7	Low	24 Å²	24	110.1 Å²	110.1	13%	0.126	58%	0.577	C	S	.	*			trans	-99.4	3.5	-179.3	-87.2	157	0	0	0	112.9	V216 S220 S221 A237 L279	V216-L218 HydrophobicContact CB-CD1 3.96Å; V216-L218 HydrophobicContact CB-CG 4.5Å; V216-L218 HydrophobicContact CG1-CD1 3.65Å; V216-L218 HydrophobicContact CG1-CG 3.93Å; V216-L218 PolarHBondContact O-N 3.17Å; L218-S220 VanDerWaalsContact C-N 3.26Å; L218-S220 PolarHBondContact O-N 3.19Å; L218-S221 WeakPolarHBondContact O-CB 3.27Å; L218-S221 PolarHBondContact O-N 3.43Å; L218-A237 HydrophobicContact CD2-CB 3.52Å; L218-L279 HydrophobicContact CD1-CD2 3.82Å
219	N	54	Low	57.4	Low	99 Å²	99	114.3 Å²	114.3	53%	0.529	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-60.3	-33	-172.4	-66.7	-16.7	0	0	0	112.9	S221 T274	N219-S221 PolarHBondContact O-N 2.82Å; N219-T274 PolarHBondContact OD1-O 3.26Å
220	S	52.1	Low	59.3	Low	115 Å²	115	110 Å²	110	80%	0.804	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-70.7	-11.8	177.6	53.7	0	0	0	0	114	L218	L218-S220 VanDerWaalsContact C-N 3.26Å; L218-S220 PolarHBondContact O-N 3.19Å
221	S	69.1	Low	61.4	Low	38 Å²	38	109.1 Å²	109.1	27%	0.266	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-105	2.7	-176	-54.1	0	0	0	0	114	L218 N219 W235	L218-S221 WeakPolarHBondContact O-CB 3.27Å; L218-S221 PolarHBondContact O-N 3.43Å; N219-S221 PolarHBondContact O-N 2.82Å; S221-W235 VanDerWaalsContact O-CD1 3.22Å; S221-W235 VanDerWaalsContact O-O 3.12Å
222	L	80.7	Confident	64.1	Low	26 Å²	26	105.2 Å²	105.2	14%	0.136	53%	0.53	C	S	.	.			trans	-87.6	116.9	-176.6	-69	164.9	0	0	0	111	L234 W235 C236 T274 V276	L222-L234 HydrophobicContact CD2-CD1 4.08Å; L222-L234 HydrophobicContact CD2-CD2 4.28Å; L222-L234 HydrophobicContact CD2-CG 4.45Å; L222-W235 WeakPolarHBondContact CA-O 3.05Å; L222-C236 HydrophobicContact CD2-CB 3.78Å; L222-T274 WeakPolarHBondContact CD1-O 2.98Å; L222-V276 HydrophobicContact CD1-CG2 4.08Å; L222-V276 HydrophobicContact CD2-CG2 3.73Å; L222-V276 HydrophobicContact CG-CG2 4.38Å
223	K	82	Confident	66.6	Low	87 Å²	87	96.6 Å²	96.6	38%	0.378	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.6	170	-65.3	-178.1	173.7	-176.1	0	110.4	W235 P291 E295	K223-W235 HydrophobicContact CB-CB 4.07Å; K223-W235 PolarHBondContact N-O 3.48Å; K223-W235 WeakPolarHBondContact O-CB 3.2Å; K223-W235 PolarHBondContact O-N 3.31Å; K223-P291 HydrophobicContact CD-CB 3.96Å; K223-P291 HydrophobicContact CD-CG 4.42Å; K223-E295 IonicContact NZ-OE1 3.93Å; K223-E295 PolarHBondContact NZ-OE1 3.24Å
224	L	84.1	Confident	69.1	Low	98 Å²	98	87.8 Å²	87.8	51%	0.513	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127.3	171.3	-170	68.7	0	0	0	109.5	W255	L224-W255 HydrophobicContact CD1-CH2 3.74Å; L224-W255 HydrophobicContact CD1-CZ2 4.44Å; L224-W255 HydrophobicContact CD1-CZ3 4.45Å
225	L	81.6	Confident	71.3	Confident	29 Å²	29	80 Å²	80	15%	0.152	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	168.6	-176.8	-59.7	174.8	0	0	0	109.9	M233 W235	L225-M233 CarbonylContact C-O 3.58Å; L225-M233 WeakPolarHBondContact CA-O 3.41Å; L225-M233 HydrophobicContact CB-CB 4.35Å; L225-M233 HydrophobicContact CB-CE 3.78Å; L225-M233 HydrophobicContact CD1-CE 3.81Å; L225-M233 HydrophobicContact CG-CE 4.47Å; L225-M233 PolarHBondContact N-O 2.99Å; L225-M233 PolarHBondContact O-N 2.83Å; L225-M233 VanDerWaalsContact O-O 3.06Å; L225-W235 HydrophobicContact CD1-CB 4.15Å
226	K	79.1	Confident	73.2	Confident	121 Å²	121	76 Å²	76	53%	0.526	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139.5	172.7	-65.7	-73.8	-172.9	167.9	0	110.1	Q231 D232	K226-Q231 CarbonylContact C-O 3.59Å; K226-Q231 WeakPolarHBondContact CA-O 3.19Å; K226-D232 WeakPolarHBondContact CE-OD1 3.45Å; K226-D232 IonicContact NZ-OD1 3.15Å; K226-D232 PolarHBondContact NZ-OD1 3.28Å
227	T	75.9	Confident	74.6	Confident	29 Å²	29	72 Å²	72	18%	0.178	37%	0.366	C	S	.	.			trans	-72	168.1	169.7	65.8	0	0	0	0	111.1	R229 S230 Q231 M233 L242	T227-R229 PolarHBondContact O-N 3.15Å; T227-R229 PolarHBondContact OG1-N 3.13Å; T227-S230 WeakPolarHBondContact O-CA 2.88Å; T227-S230 PolarHBondContact O-N 2.86Å; T227-Q231 HydrophobicContact CG2-CB 4.21Å; T227-Q231 PolarHBondContact N-O 3.26Å; T227-Q231 VanDerWaalsContact OG1-CB 3.31Å; T227-Q231 WeakPolarHBondContact OG1-CB 3.37Å; T227-Q231 PolarHBondContact OG1-N 3.08Å; T227-Q231 PolarHBondContact OG1-O 3.34Å; T227-M233 HydrophobicContact CG2-CB 4.14Å; T227-M233 HydrophobicContact CG2-SD 4.15Å; T227-L242 HydrophobicContact CG2-CD2 3.56Å
228	Q	62.2	Low	76	Confident	174 Å²	174	67 Å²	67	81%	0.813	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-15.6	171.1	-65.1	179.7	-1.2	0	0	114.2
229	R	70.6	Confident	77.4	Confident	211 Å²	211	67.5 Å²	67.5	80%	0.796	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	17.6	175	-63.4	-177	-179.8	176.6	-0.4	112.5	T227 Q231	T227-R229 PolarHBondContact O-N 3.15Å; T227-R229 PolarHBondContact OG1-N 3.13Å; R229-Q231 HydrophobicContact CB-CG 4.25Å; R229-Q231 PolarHBondContact O-N 3.38Å; R229-Q231 VanDerWaalsContact O-N 3.12Å
230	S	74.6	Confident	79	Confident	96 Å²	96	63 Å²	63	67%	0.671	32%	0.322	S	S	*	.	S	Bend	trans	60.3	19.1	-177.6	-52.3	0	0	0	0	114.9	T227	T227-S230 WeakPolarHBondContact O-CA 2.88Å; T227-S230 PolarHBondContact O-N 2.86Å
231	Q	81.1	Confident	80.8	Confident	107 Å²	107	57.5 Å²	57.5	50%	0.5	28%	0.283	S	S	.	.			trans	-80.3	144	173.9	-54.1	-170.4	-49.9	0	0	111.1	K226 T227 R229	K226-Q231 CarbonylContact C-O 3.59Å; K226-Q231 WeakPolarHBondContact CA-O 3.19Å; T227-Q231 HydrophobicContact CG2-CB 4.21Å; T227-Q231 PolarHBondContact N-O 3.26Å; T227-Q231 VanDerWaalsContact OG1-CB 3.31Å; T227-Q231 WeakPolarHBondContact OG1-CB 3.37Å; T227-Q231 PolarHBondContact OG1-N 3.08Å; T227-Q231 PolarHBondContact OG1-O 3.34Å; R229-Q231 HydrophobicContact CB-CG 4.25Å; R229-Q231 PolarHBondContact O-N 3.38Å; R229-Q231 VanDerWaalsContact O-N 3.12Å
232	D	87.6	Confident	81.8	Confident	40 Å²	40	56.9 Å²	56.9	21%	0.214	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130.7	176	-61	-26.8	0	0	0	111.6	K226 K243 W255	K226-D232 WeakPolarHBondContact CE-OD1 3.45Å; K226-D232 IonicContact NZ-OD1 3.15Å; K226-D232 PolarHBondContact NZ-OD1 3.28Å; D232-K243 HydrophobicContact CB-CB 3.99Å; D232-K243 HydrophobicContact CB-CD 4.01Å; D232-K243 PolarHBondContact O-N 3.38Å; D232-K243 WeakPolarHBondContact OD2-CD 3.42Å; D232-K243 IonicContact OD2-NZ 3.57Å; D232-W255 HydrophobicContact CB-CH2 4.12Å; D232-W255 HydrophobicContact CB-CZ3 4.1Å
233	M	88.1	Confident	82.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.6	178.4	-173.1	172.2	73	0	0	109.4	L225 T227 E240 Y241 L242	L225-M233 CarbonylContact C-O 3.58Å; L225-M233 WeakPolarHBondContact CA-O 3.41Å; L225-M233 HydrophobicContact CB-CB 4.35Å; L225-M233 HydrophobicContact CB-CE 3.78Å; L225-M233 HydrophobicContact CD1-CE 3.81Å; L225-M233 HydrophobicContact CG-CE 4.47Å; L225-M233 PolarHBondContact N-O 2.99Å; L225-M233 PolarHBondContact O-N 2.83Å; L225-M233 VanDerWaalsContact O-O 3.06Å; T227-M233 HydrophobicContact CG2-CB 4.14Å; T227-M233 HydrophobicContact CG2-SD 4.15Å; M233-E240 HydrophobicContact CE-CG 4.47Å; M233-E240 HydrophobicContact SD-CB 4.23Å; M233-E240 HydrophobicContact SD-CG 4.2Å; M233-Y241 CarbonylContact C-O 3.58Å; M233-Y241 WeakPolarHBondContact CA-O 3.47Å; M233-Y241 WeakPolarHBondContact CG-O 3.33Å; M233-L242 HydrophobicContact CB-CD2 4.36Å; M233-L242 HydrophobicContact CG-CD2 4.26Å; M233-L242 HydrophobicContact SD-CD2 4.47Å
234	L	89.2	Confident	82.6	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.7	175.9	-178	71	0	0	0	109.4	L222 C236 Y241 W255 V267 T269 C273	L222-L234 HydrophobicContact CD2-CD1 4.08Å; L222-L234 HydrophobicContact CD2-CD2 4.28Å; L222-L234 HydrophobicContact CD2-CG 4.45Å; L234-C236 HydrophobicContact CD2-CB 4.3Å; L234-C236 HydrophobicContact CG-CB 4.37Å; L234-Y241 PolarHBondContact N-O 2.88Å; L234-Y241 PolarHBondContact O-N 3.32Å; L234-W255 HydrophobicContact CB-CD2 3.65Å; L234-W255 HydrophobicContact CB-CE3 3.49Å; L234-W255 VanDerWaalsContact CB-CE3 3.49Å; L234-W255 HydrophobicContact CB-CG 4.27Å; L234-W255 HydrophobicContact CB-CH2 4.16Å; L234-W255 HydrophobicContact CB-CZ2 4.29Å; L234-W255 HydrophobicContact CB-CZ3 3.75Å; L234-W255 HydrophobicContact CD2-CD2 3.94Å; L234-W255 HydrophobicContact CD2-CG 3.86Å; L234-W255 HydrophobicContact CG-CD2 4.42Å; L234-V267 HydrophobicContact CD2-CG1 3.75Å; L234-T269 HydrophobicContact CD2-CG2 3.56Å; L234-C273 HydrophobicContact CD1-CB 4.27Å
235	W	83.6	Confident	82.9	Confident	9 Å²	9	61.7 Å²	61.7	3%	0.034	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.7	163.3	179	-99	0	0	0	108.8	S221 L222 K223 L225 N238 Y239 E240 F287 L290 P291	S221-W235 VanDerWaalsContact O-CD1 3.22Å; S221-W235 VanDerWaalsContact O-O 3.12Å; L222-W235 WeakPolarHBondContact CA-O 3.05Å; K223-W235 HydrophobicContact CB-CB 4.07Å; K223-W235 PolarHBondContact N-O 3.48Å; K223-W235 WeakPolarHBondContact O-CB 3.2Å; K223-W235 PolarHBondContact O-N 3.31Å; L225-W235 HydrophobicContact CD1-CB 4.15Å; W235-N238 VanDerWaalsContact CH2-C 3.42Å; W235-N238 VanDerWaalsContact CH2-CA 3.5Å; W235-N238 HydrophobicContact CH2-CB 4.19Å; W235-N238 WeakPolarHBondContact CH2-O 3.13Å; W235-N238 HydrophobicContact CZ2-CB 4.02Å; W235-N238 WeakPolarHBondContact CZ2-OD1 3.45Å; W235-Y239 WeakPolarHBondContact CA-O 3.46Å; W235-E240 HydrophobicContact CE3-CG 3.9Å; W235-E240 HydrophobicContact CZ3-CG 3.99Å; W235-F287 HydrophobicContact CH2-CB 4.09Å; W235-F287 WeakPolarHBondContact CH2-O 3.39Å; W235-F287 HydrophobicContact CZ3-CB 4.32Å; W235-L290 HydrophobicContact CE3-CB 4.23Å; W235-L290 HydrophobicContact CH2-CB 3.56Å; W235-L290 HydrophobicContact CH2-CD1 4.21Å; W235-L290 HydrophobicContact CH2-CG 4.25Å; W235-L290 HydrophobicContact CZ2-CB 4.38Å; W235-L290 HydrophobicContact CZ3-CB 3.5Å; W235-L290 VanDerWaalsContact CZ3-CB 3.5Å; W235-L290 HydrophobicContact CZ3-CD1 3.69Å; W235-L290 HydrophobicContact CZ3-CG 4.12Å; W235-P291 HydrophobicContact CD2-CG 3.66Å; W235-P291 VanDerWaalsContact CE2-CD 3.43Å; W235-P291 HydrophobicContact CE3-CG 4.46Å; W235-P291 HydrophobicContact CG-CG 3.88Å; W235-P291 HydrophobicContact CH2-CG 4.46Å; W235-P291 HydrophobicContact CZ2-CG 3.62Å; W235-P291 VanDerWaalsContact NE1-CG 3.27Å
236	C	84.3	Confident	83.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	134.3	177.8	179.6	0	0	0	0	109.3	L222 L234 N238 Y239 Y241	L222-C236 HydrophobicContact CD2-CB 3.78Å; L234-C236 HydrophobicContact CD2-CB 4.3Å; L234-C236 HydrophobicContact CG-CB 4.37Å; C236-N238 PolarHBondContact O-N 2.63Å; C236-N238 VanDerWaalsContact O-N 3.12Å; C236-Y239 PolarHBondContact N-O 3.4Å; C236-Y239 VanDerWaalsContact N-O 3.11Å; C236-Y239 PolarHBondContact O-N 3.03Å; C236-Y241 HydrophobicContact CB-CD2 4.34Å; C236-Y241 HydrophobicContact CB-CE2 3.89Å
237	A	80.2	Confident	83.7	Confident	22 Å²	22	60.3 Å²	60.3	18%	0.182	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	51	36.3	175.4	0	0	0	0	0	114.4	L218 Y239	L218-A237 HydrophobicContact CD2-CB 3.52Å; A237-Y239 VanDerWaalsContact C-N 3.34Å; A237-Y239 HydrophobicContact CB-CD2 4.45Å; A237-Y239 WeakPolarHBondContact O-CD2 3.41Å; A237-Y239 WeakPolarHBondContact O-CE2 3.49Å; A237-Y239 PolarHBondContact O-N 3.48Å
238	N	79.6	Confident	84.1	Confident	79 Å²	79	64 Å²	64	42%	0.422	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	20.1	-175.6	-55.5	-39.8	0	0	0	117.1	W235 C236 P286 F287	W235-N238 VanDerWaalsContact CH2-C 3.42Å; W235-N238 VanDerWaalsContact CH2-CA 3.5Å; W235-N238 HydrophobicContact CH2-CB 4.19Å; W235-N238 WeakPolarHBondContact CH2-O 3.13Å; W235-N238 HydrophobicContact CZ2-CB 4.02Å; W235-N238 WeakPolarHBondContact CZ2-OD1 3.45Å; C236-N238 PolarHBondContact O-N 2.63Å; C236-N238 VanDerWaalsContact O-N 3.12Å; N238-P286 HydrophobicContact CB-CB 3.5Å; N238-F287 PolarHBondContact O-N 3.05Å
239	Y	86	Confident	85	Confident	35 Å²	35	64.3 Å²	64.3	14%	0.137	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.2	176.6	-64.5	-77.8	0	0	0	112.2	W235 C236 A237 Y241 H282 H284 P285 P286	W235-Y239 WeakPolarHBondContact CA-O 3.46Å; C236-Y239 PolarHBondContact N-O 3.4Å; C236-Y239 VanDerWaalsContact N-O 3.11Å; C236-Y239 PolarHBondContact O-N 3.03Å; A237-Y239 VanDerWaalsContact C-N 3.34Å; A237-Y239 HydrophobicContact CB-CD2 4.45Å; A237-Y239 WeakPolarHBondContact O-CD2 3.41Å; A237-Y239 WeakPolarHBondContact O-CE2 3.49Å; A237-Y239 PolarHBondContact O-N 3.48Å; Y239-Y241 WeakPolarHBondContact O-CD2 3.22Å; Y239-Y241 WeakPolarHBondContact O-CE2 3.28Å; Y239-H282 HydrophobicContact CD1-CB 4.13Å; Y239-H282 AromaticContact CD1-CD2 3.91Å; Y239-H282 AromaticContact CD1-CE1 3.6Å; Y239-H282 AromaticContact CD1-CG 3.54Å; Y239-H282 AromaticContact CD1-ND1 3.34Å; Y239-H282 VanDerWaalsContact CD1-ND1 3.34Å; Y239-H282 WeakPolarHBondContact CD1-ND1 3.23Å; Y239-H282 AromaticContact CD1-NE2 3.98Å; Y239-H282 AromaticContact CD2-CD2 3.79Å; Y239-H282 HydrophobicContact CE1-CB 3.51Å; Y239-H282 AromaticContact CE1-CG 3.46Å; Y239-H282 VanDerWaalsContact CE1-CG 3.46Å; Y239-H282 AromaticContact CE1-ND1 3.66Å; Y239-H282 HydrophobicContact CE2-CB 4.34Å; Y239-H282 AromaticContact CE2-CD2 3.98Å; Y239-H282 AromaticContact CG-CD2 3.75Å; Y239-H282 AromaticContact CG-CE1 3.64Å; Y239-H282 AromaticContact CG-CG 3.89Å; Y239-H282 AromaticContact CG-ND1 3.83Å; Y239-H282 AromaticContact CG-NE2 3.64Å; Y239-H282 AromaticContact CZ-CG 3.79Å; Y239-H284 AromaticContact CD1-CE1 3.52Å; Y239-H284 AromaticContact CE1-CE1 3.56Å; Y239-H284 AromaticContact CE1-ND1 3.65Å; Y239-H284 WeakPolarHBondContact CE1-O 3.4Å; Y239-H284 PolarHBondContact OH-O 3.37Å; Y239-P285 WeakPolarHBondContact CE1-O 3.41Å; Y239-P286 VanDerWaalsContact CE1-CA 3.49Å; Y239-P286 HydrophobicContact CE1-CB 4.24Å; Y239-P286 HydrophobicContact CE2-CB 4.11Å; Y239-P286 WeakPolarHBondContact OH-CD 3.46Å
240	E	87	Confident	85.7	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.019	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.3	172.5	-69	-175.4	149.8	0	0	111.3	M233 W235 C257 R258 L290 H294	M233-E240 HydrophobicContact CE-CG 4.47Å; M233-E240 HydrophobicContact SD-CB 4.23Å; M233-E240 HydrophobicContact SD-CG 4.2Å; W235-E240 HydrophobicContact CE3-CG 3.9Å; W235-E240 HydrophobicContact CZ3-CG 3.99Å; E240-C257 WeakPolarHBondContact O-CA 3.37Å; E240-R258 HydrophobicContact CB-CB 4.09Å; E240-R258 PolarHBondContact O-N 2.84Å; E240-R258 IonicContact OE1-NH1 3.9Å; E240-R258 PolarHBondContact OE1-NH1 2.97Å; E240-R258 WeakPolarHBondContact OE2-CD 3.18Å; E240-R258 IonicContact OE2-CZ 2.75Å; E240-R258 IonicContact OE2-NE 3.91Å; E240-R258 IonicContact OE2-NH1 2.87Å; E240-R258 PolarHBondContact OE2-NH1 3.26Å; E240-L290 HydrophobicContact CG-CD1 3.87Å; E240-H294 IonicContact OE1-CD2 2.76Å; E240-H294 IonicContact OE1-CE1 3.86Å; E240-H294 IonicContact OE1-NE2 2.7Å; E240-H294 PolarHBondContact OE1-NE2 3.06Å
241	Y	89.5	Confident	86.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.3	175.9	-52	-103.4	0	0	0	111.4	M233 L234 C236 Y239 W255 R256 V267 L279 H282	M233-Y241 CarbonylContact C-O 3.58Å; M233-Y241 WeakPolarHBondContact CA-O 3.47Å; M233-Y241 WeakPolarHBondContact CG-O 3.33Å; L234-Y241 PolarHBondContact N-O 2.88Å; L234-Y241 PolarHBondContact O-N 3.32Å; C236-Y241 HydrophobicContact CB-CD2 4.34Å; C236-Y241 HydrophobicContact CB-CE2 3.89Å; Y239-Y241 WeakPolarHBondContact O-CD2 3.22Å; Y239-Y241 WeakPolarHBondContact O-CE2 3.28Å; Y241-W255 HydrophobicContact CD1-CB 4.38Å; Y241-W255 HydrophobicContact CG-CB 4.22Å; Y241-R256 CarbonylContact C-O 3.59Å; Y241-R256 WeakPolarHBondContact CA-O 3.46Å; Y241-R256 WeakPolarHBondContact CB-O 3.41Å; Y241-V267 HydrophobicContact CD1-CB 4.04Å; Y241-V267 HydrophobicContact CD1-CG2 4.02Å; Y241-V267 HydrophobicContact CD2-CG2 4.32Å; Y241-V267 HydrophobicContact CE1-CB 3.93Å; Y241-V267 HydrophobicContact CE1-CG2 3.41Å; Y241-V267 VanDerWaalsContact CE1-CG2 3.41Å; Y241-V267 HydrophobicContact CE2-CB 4.49Å; Y241-V267 HydrophobicContact CE2-CG2 3.77Å; Y241-V267 HydrophobicContact CG-CB 4.38Å; Y241-V267 HydrophobicContact CG-CG2 4.44Å; Y241-V267 WeakPolarHBondContact OH-CG2 3.19Å; Y241-L279 WeakPolarHBondContact OH-CD1 3.29Å; Y241-H282 AromaticContact CE1-CE1 3.79Å; Y241-H282 AromaticContact CE1-NE2 3.25Å; Y241-H282 VanDerWaalsContact CE1-NE2 3.25Å; Y241-H282 WeakPolarHBondContact CE1-NE2 3.41Å; Y241-H282 AromaticContact CZ-CE1 3.87Å; Y241-H282 AromaticContact CZ-NE2 3.19Å; Y241-H282 PolarHBondContact OH-NE2 3.28Å
242	L	90.3	Very high	86.8	Confident	25 Å²	25	55.1 Å²	55.1	13%	0.131	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.3	171.7	-63.6	173.9	0	0	0	109.7	T227 M233 R244 R256 R258	T227-L242 HydrophobicContact CG2-CD2 3.56Å; M233-L242 HydrophobicContact CB-CD2 4.36Å; M233-L242 HydrophobicContact CG-CD2 4.26Å; M233-L242 HydrophobicContact SD-CD2 4.47Å; L242-R244 PolarHBondContact O-N 3.25Å; L242-R256 PolarHBondContact N-O 2.9Å; L242-R256 PolarHBondContact O-N 3.11Å; L242-R258 HydrophobicContact CD1-CG 4.42Å
243	K	91.9	Very high	87	Confident	65 Å²	65	53.5 Å²	53.5	28%	0.283	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	126.3	173	-170.4	170.5	-178.7	175.9	0	109.8	D232 E246 I253 W255	D232-K243 HydrophobicContact CB-CB 3.99Å; D232-K243 HydrophobicContact CB-CD 4.01Å; D232-K243 PolarHBondContact O-N 3.38Å; D232-K243 WeakPolarHBondContact OD2-CD 3.42Å; D232-K243 IonicContact OD2-NZ 3.57Å; K243-E246 WeakPolarHBondContact CE-OE2 3.45Å; K243-E246 IonicContact NZ-OE2 3.64Å; K243-E246 PolarHBondContact NZ-OE2 3.36Å; K243-I253 HydrophobicContact CD-CG2 4.24Å; K243-I253 HydrophobicContact CG-CG2 3.87Å; K243-W255 HydrophobicContact CB-CE3 3.96Å; K243-W255 HydrophobicContact CB-CH2 4.18Å; K243-W255 HydrophobicContact CB-CZ3 3.63Å; K243-W255 HydrophobicContact CD-CH2 4.47Å; K243-W255 HydrophobicContact CG-CH2 4.45Å; K243-W255 HydrophobicContact CG-CZ3 4.34Å
244	R	88.7	Confident	87.2	Confident	138 Å²	138	54.8 Å²	54.8	52%	0.521	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-56.8	177.7	-170.5	-169.2	174.2	-163.2	-2.5	110.3	L242 D254 R256	L242-R244 PolarHBondContact O-N 3.25Å; R244-D254 WeakPolarHBondContact CA-O 3.37Å; R244-D254 VanDerWaalsContact CB-O 3.27Å; R244-D254 WeakPolarHBondContact CB-O 3.49Å; R244-D254 PolarHBondContact N-O 3.44Å; R244-R256 HydrophobicContact CB-CG 4.39Å
245	Y	89.6	Confident	87.4	Confident	108 Å²	108	54.9 Å²	54.9	42%	0.424	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	162.1	172.6	68.6	-80.6	0	0	0	109.4	N247 D254	Y245-N247 HydrophobicContact CE2-CB 4.29Å; Y245-D254 HydrophobicContact CD1-CB 3.88Å; Y245-D254 HydrophobicContact CE1-CB 3.5Å; Y245-D254 WeakPolarHBondContact CE1-OD2 3.16Å; Y245-D254 HydrophobicContact CG-CB 4.5Å; Y245-D254 PolarHBondContact O-N 3.03Å; Y245-D254 PolarHBondContact OH-OD2 3.45Å
246	E	90.3	Very high	87.9	Confident	84 Å²	84	58.4 Å²	58.4	39%	0.393	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.6	176.8	176.3	172.5	169	0	0	108	K243 T248 I253 L271	K243-E246 WeakPolarHBondContact CE-OE2 3.45Å; K243-E246 IonicContact NZ-OE2 3.64Å; K243-E246 PolarHBondContact NZ-OE2 3.36Å; E246-T248 HydrophobicContact CG-CG2 4.45Å; E246-I253 HydrophobicContact CB-CG1 4.39Å; E246-I253 HydrophobicContact CG-CG1 4.08Å; E246-L271 HydrophobicContact CG-CD2 3.68Å; E246-L271 WeakPolarHBondContact OE1-CD2 3.29Å
247	N	87.4	Confident	88.2	Confident	37 Å²	37	58.5 Å²	58.5	20%	0.198	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	100.8	175.2	-175.2	-32.4	0	0	0	107.9	Y245 E249 R250 G251 T252	Y245-N247 HydrophobicContact CE2-CB 4.29Å; N247-E249 PolarHBondContact OD1-N 3.02Å; N247-R250 PolarHBondContact OD1-N 2.8Å; N247-G251 PolarHBondContact O-N 2.9Å; N247-T252 PolarHBondContact N-O 3.37Å; N247-T252 PolarHBondContact O-N 3.19Å
248	T	84.1	Confident	88.4	Confident	106 Å²	106	63.6 Å²	63.6	65%	0.65	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-34	-178.7	44.8	0	0	0	0	112.5	E246 G251	E246-T248 HydrophobicContact CG-CG2 4.45Å; T248-G251 PolarHBondContact O-N 3.09Å
249	E	82.2	Confident	88.7	Confident	182 Å²	182	61.1 Å²	61.1	85%	0.85	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-40.4	179.7	-63.6	174.8	-179.8	0	0	112.2	N247	N247-E249 PolarHBondContact OD1-N 3.02Å
250	R	84	Confident	88.5	Confident	188 Å²	188	66.8 Å²	66.8	71%	0.709	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-7.7	176.2	-63.4	-173.4	-178	-158.7	-1.7	113.4	N247 T252	N247-R250 PolarHBondContact OD1-N 2.8Å; R250-T252 VanDerWaalsContact C-N 3.32Å; R250-T252 HydrophobicContact CB-CG2 4.15Å; R250-T252 WeakPolarHBondContact O-CG2 3.42Å; R250-T252 PolarHBondContact O-N 3.25Å
251	G	87	Confident	88.2	Confident	22 Å²	22	72.7 Å²	72.7	23%	0.227	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	33.4	-173.8	0	0	0	0	0	113.9	N247 T248 N270 L271	N247-G251 PolarHBondContact O-N 2.9Å; T248-G251 PolarHBondContact O-N 3.09Å; G251-N270 WeakPolarHBondContact O-CA 3.46Å; G251-L271 PolarHBondContact O-N 3.4Å
252	T	91.4	Very high	88	Confident	10 Å²	10	78.6 Å²	78.6	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.7	-175.2	69.7	0	0	0	0	113.7	N247 R250 Q268 T269 Y277	N247-T252 PolarHBondContact N-O 3.37Å; N247-T252 PolarHBondContact O-N 3.19Å; R250-T252 VanDerWaalsContact C-N 3.32Å; R250-T252 HydrophobicContact CB-CG2 4.15Å; R250-T252 WeakPolarHBondContact O-CG2 3.42Å; R250-T252 PolarHBondContact O-N 3.25Å; T252-Q268 HydrophobicContact CG2-CG 4.48Å; T252-Q268 PolarHBondContact OG1-NE2 2.79Å; T252-T269 CarbonylContact C-O 3.59Å; T252-T269 WeakPolarHBondContact CA-O 3.41Å; T252-T269 WeakPolarHBondContact CB-O 2.98Å; T252-Y277 HydrophobicContact CG2-CD2 3.66Å; T252-Y277 HydrophobicContact CG2-CE2 3.67Å
253	I	92.2	Very high	87.8	Confident	6 Å²	6	77.7 Å²	77.7	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.1	171.2	-55.5	173.2	0	0	0	109.1	K243 E246 W255 Q268 T269 L271	K243-I253 HydrophobicContact CD-CG2 4.24Å; K243-I253 HydrophobicContact CG-CG2 3.87Å; E246-I253 HydrophobicContact CB-CG1 4.39Å; E246-I253 HydrophobicContact CG-CG1 4.08Å; I253-W255 HydrophobicContact CB-CZ2 4.05Å; I253-W255 HydrophobicContact CD1-CZ2 3.97Å; I253-W255 HydrophobicContact CG2-CD2 4.04Å; I253-W255 HydrophobicContact CG2-CG 4.43Å; I253-W255 HydrophobicContact CG2-CH2 4.29Å; I253-W255 HydrophobicContact CG2-CZ2 3.5Å; I253-W255 VanDerWaalsContact CG2-CZ2 3.5Å; I253-W255 PolarHBondContact O-NE1 3.12Å; I253-Q268 WeakPolarHBondContact O-CA 3.16Å; I253-T269 PolarHBondContact N-O 3.03Å; I253-T269 PolarHBondContact O-N 3.12Å; I253-L271 HydrophobicContact CD1-CD2 4.4Å; I253-L271 HydrophobicContact CG1-CD2 3.84Å
254	D	92.9	Very high	87.6	Confident	29 Å²	29	81.1 Å²	81.1	16%	0.155	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.3	173.1	-98.3	10.1	0	0	0	110.3	R244 Y245 Q268	R244-D254 WeakPolarHBondContact CA-O 3.37Å; R244-D254 VanDerWaalsContact CB-O 3.27Å; R244-D254 WeakPolarHBondContact CB-O 3.49Å; R244-D254 PolarHBondContact N-O 3.44Å; Y245-D254 HydrophobicContact CD1-CB 3.88Å; Y245-D254 HydrophobicContact CE1-CB 3.5Å; Y245-D254 WeakPolarHBondContact CE1-OD2 3.16Å; Y245-D254 HydrophobicContact CG-CB 4.5Å; Y245-D254 PolarHBondContact O-N 3.03Å; Y245-D254 PolarHBondContact OH-OD2 3.45Å; D254-Q268 VanDerWaalsContact OD1-CG 3.31Å; D254-Q268 WeakPolarHBondContact OD1-CG 3.43Å
255	W	93.7	Very high	87.6	Confident	4 Å²	4	74.6 Å²	74.6	2%	0.015	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	145.7	179.7	-51.4	87.7	0	0	0	110.2	L224 D232 L234 Y241 K243 I253 K266 V267 T269 C273	L224-W255 HydrophobicContact CD1-CH2 3.74Å; L224-W255 HydrophobicContact CD1-CZ2 4.44Å; L224-W255 HydrophobicContact CD1-CZ3 4.45Å; D232-W255 HydrophobicContact CB-CH2 4.12Å; D232-W255 HydrophobicContact CB-CZ3 4.1Å; L234-W255 HydrophobicContact CB-CD2 3.65Å; L234-W255 HydrophobicContact CB-CE3 3.49Å; L234-W255 VanDerWaalsContact CB-CE3 3.49Å; L234-W255 HydrophobicContact CB-CG 4.27Å; L234-W255 HydrophobicContact CB-CH2 4.16Å; L234-W255 HydrophobicContact CB-CZ2 4.29Å; L234-W255 HydrophobicContact CB-CZ3 3.75Å; L234-W255 HydrophobicContact CD2-CD2 3.94Å; L234-W255 HydrophobicContact CD2-CG 3.86Å; L234-W255 HydrophobicContact CG-CD2 4.42Å; Y241-W255 HydrophobicContact CD1-CB 4.38Å; Y241-W255 HydrophobicContact CG-CB 4.22Å; K243-W255 HydrophobicContact CB-CE3 3.96Å; K243-W255 HydrophobicContact CB-CH2 4.18Å; K243-W255 HydrophobicContact CB-CZ3 3.63Å; K243-W255 HydrophobicContact CD-CH2 4.47Å; K243-W255 HydrophobicContact CG-CH2 4.45Å; K243-W255 HydrophobicContact CG-CZ3 4.34Å; I253-W255 HydrophobicContact CB-CZ2 4.05Å; I253-W255 HydrophobicContact CD1-CZ2 3.97Å; I253-W255 HydrophobicContact CG2-CD2 4.04Å; I253-W255 HydrophobicContact CG2-CG 4.43Å; I253-W255 HydrophobicContact CG2-CH2 4.29Å; I253-W255 HydrophobicContact CG2-CZ2 3.5Å; I253-W255 VanDerWaalsContact CG2-CZ2 3.5Å; I253-W255 PolarHBondContact O-NE1 3.12Å; W255-K266 VanDerWaalsContact O-CA 3.28Å; W255-K266 WeakPolarHBondContact O-CA 3.41Å; W255-V267 WeakPolarHBondContact CA-O 3.43Å; W255-V267 HydrophobicContact CB-CB 4.15Å; W255-V267 VanDerWaalsContact CB-O 3.26Å; W255-V267 WeakPolarHBondContact CB-O 3.49Å; W255-V267 PolarHBondContact N-O 3.36Å; W255-V267 PolarHBondContact O-N 2.95Å; W255-T269 PolarHBondContact NE1-OG1 3.16Å; W255-C273 VanDerWaalsContact CZ2-SG 3.54Å
256	R	92.6	Very high	87.8	Confident	82 Å²	82	73.6 Å²	73.6	31%	0.309	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146.9	177.4	63.5	177	176.9	-174.9	-7.6	110.7	Y241 L242 R244 R258 K266	Y241-R256 CarbonylContact C-O 3.59Å; Y241-R256 WeakPolarHBondContact CA-O 3.46Å; Y241-R256 WeakPolarHBondContact CB-O 3.41Å; L242-R256 PolarHBondContact N-O 2.9Å; L242-R256 PolarHBondContact O-N 3.11Å; R244-R256 HydrophobicContact CB-CG 4.39Å; R256-R258 PolarHBondContact O-N 3.2Å; R256-K266 HydrophobicContact CB-CG 4.48Å
257	C	91.5	Very high	87.8	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	139.2	177.6	-179.2	0	0	0	0	111.8	E240 S259 R260 C263 G265 H282 H284	E240-C257 WeakPolarHBondContact O-CA 3.37Å; C257-S259 VanDerWaalsContact C-N 3.27Å; C257-S259 PolarHBondContact O-N 3.31Å; C257-S259 PolarHBondContact SG-N 2.96Å; C257-R260 PolarHBondContact O-N 3.42Å; C257-C263 HydrophobicContact CB-CB 4.08Å; C257-C263 VanDerWaalsContact SG-SG 3.68Å; C257-G265 WeakPolarHBondContact CB-O 3.33Å; C257-G265 PolarHBondContact N-O 2.84Å; C257-H282 VanDerWaalsContact CB-CE1 3.48Å; C257-H282 WeakPolarHBondContact CB-CE1 3.25Å; C257-H282 PolarHBondContact SG-CE1 3.12Å; C257-H284 PolarHBondContact SG-NE2 2.8Å
258	R	85.4	Confident	88.1	Confident	130 Å²	130	69.6 Å²	69.6	49%	0.491	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-38.1	174.5	-173.5	178.7	179.3	-175.6	-3.3	112.3	E240 L242 R256 R260	E240-R258 HydrophobicContact CB-CB 4.09Å; E240-R258 PolarHBondContact O-N 2.84Å; E240-R258 IonicContact OE1-NH1 3.9Å; E240-R258 PolarHBondContact OE1-NH1 2.97Å; E240-R258 WeakPolarHBondContact OE2-CD 3.18Å; E240-R258 IonicContact OE2-CZ 2.75Å; E240-R258 IonicContact OE2-NE 3.91Å; E240-R258 IonicContact OE2-NH1 2.87Å; E240-R258 PolarHBondContact OE2-NH1 3.26Å; L242-R258 HydrophobicContact CD1-CG 4.42Å; R256-R258 PolarHBondContact O-N 3.2Å; R258-R260 PolarHBondContact O-N 3.29Å
259	S	85.2	Confident	88.4	Confident	27 Å²	27	64.6 Å²	64.6	19%	0.189	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	41.8	177.5	-58.5	0	0	0	0	113.4	C257 T261 F262 C263	C257-S259 VanDerWaalsContact C-N 3.27Å; C257-S259 PolarHBondContact O-N 3.31Å; C257-S259 PolarHBondContact SG-N 2.96Å; S259-T261 PolarHBondContact O-N 2.89Å; S259-F262 PolarHBondContact O-N 3.11Å; S259-F262 VanDerWaalsContact O-N 3.15Å; S259-C263 VanDerWaalsContact O-CB 3.3Å; S259-C263 WeakPolarHBondContact O-CB 3.39Å; S259-C263 PolarHBondContact O-N 3.15Å
260	R	80.9	Confident	88.8	Confident	154 Å²	154	57.2 Å²	57.2	58%	0.581	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-10.1	-175.1	68.6	-179.6	-178.1	-177.5	0.3	115.9	C257 R258 F262	C257-R260 PolarHBondContact O-N 3.42Å; R258-R260 PolarHBondContact O-N 3.29Å; R260-F262 VanDerWaalsContact C-N 3.32Å
261	T	81.1	Confident	88.9	Confident	127 Å²	127	51.8 Å²	51.8	78%	0.779	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-31	177.8	42.2	0	0	0	0	111.5	S259	S259-T261 PolarHBondContact O-N 2.89Å
262	F	85	Confident	88.8	Confident	124 Å²	124	54.1 Å²	54.1	54%	0.544	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.9	-16	179.9	61.1	-91.7	0	0	0	113.9	S259 R260 C283 H284	S259-F262 PolarHBondContact O-N 3.11Å; S259-F262 VanDerWaalsContact O-N 3.15Å; R260-F262 VanDerWaalsContact C-N 3.32Å; F262-C283 PolarHBondContact O-SG 3.24Å; F262-H284 HydrophobicContact CE2-CB 4.14Å; F262-H284 AromaticContact CE2-CD2 3.92Å
263	C	87.1	Confident	88.6	Confident	6 Å²	6	54.4 Å²	54.4	4%	0.041	27%	0.266	C	S	.	.			trans	-97.6	135.9	-179.1	-169.1	0	0	0	0	112.9	C257 S259 G265 H282 H284	C257-C263 HydrophobicContact CB-CB 4.08Å; C257-C263 VanDerWaalsContact SG-SG 3.68Å; S259-C263 VanDerWaalsContact O-CB 3.3Å; S259-C263 WeakPolarHBondContact O-CB 3.39Å; S259-C263 PolarHBondContact O-N 3.15Å; C263-G265 PolarHBondContact SG-N 3.46Å; C263-H282 PolarHBondContact SG-ND1 2.89Å; C263-H284 PolarHBondContact SG-CD2 3.43Å; C263-H284 PolarHBondContact SG-NE2 2.78Å; C263-H284 VanDerWaalsContact SG-NE2 3.44Å
264	Q	87.7	Confident	88.2	Confident	137 Å²	137	58.2 Å²	58.2	64%	0.64	29%	0.29	S	S	*	.			trans	-98	4.2	173.5	-64	-63.7	-19.1	0	0	113.8	K266	Q264-K266 WeakPolarHBondContact O-CG 3.17Å; Q264-K266 PolarHBondContact O-N 2.98Å
265	G	89	Confident	87.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.01	31%	0.305	C	S	.	.			trans	-56.6	134.8	-179.4	0	0	0	0	0	111.9	C257 C263 V280	C257-G265 WeakPolarHBondContact CB-O 3.33Å; C257-G265 PolarHBondContact N-O 2.84Å; C263-G265 PolarHBondContact SG-N 3.46Å; G265-V280 WeakPolarHBondContact CA-O 3.44Å
266	K	92.7	Very high	87.4	Confident	87 Å²	87	63.5 Å²	63.5	38%	0.378	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.6	-176.3	-69.3	168.4	-166.9	165	0	109.6	W255 R256 Q264 V280	W255-K266 VanDerWaalsContact O-CA 3.28Å; W255-K266 WeakPolarHBondContact O-CA 3.41Å; R256-K266 HydrophobicContact CB-CG 4.48Å; Q264-K266 WeakPolarHBondContact O-CG 3.17Å; Q264-K266 PolarHBondContact O-N 2.98Å; K266-V280 HydrophobicContact CB-CB 4.08Å; K266-V280 HydrophobicContact CB-CG2 4.01Å; K266-V280 PolarHBondContact N-O 3.06Å; K266-V280 PolarHBondContact O-N 3.01Å
267	V	91.5	Very high	87.1	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.9	173.2	162.7	0	0	0	0	108.4	L234 Y241 W255 T269 V276 R278 L279	L234-V267 HydrophobicContact CD2-CG1 3.75Å; Y241-V267 HydrophobicContact CD1-CB 4.04Å; Y241-V267 HydrophobicContact CD1-CG2 4.02Å; Y241-V267 HydrophobicContact CD2-CG2 4.32Å; Y241-V267 HydrophobicContact CE1-CB 3.93Å; Y241-V267 HydrophobicContact CE1-CG2 3.41Å; Y241-V267 VanDerWaalsContact CE1-CG2 3.41Å; Y241-V267 HydrophobicContact CE2-CB 4.49Å; Y241-V267 HydrophobicContact CE2-CG2 3.77Å; Y241-V267 HydrophobicContact CG-CB 4.38Å; Y241-V267 HydrophobicContact CG-CG2 4.44Å; Y241-V267 WeakPolarHBondContact OH-CG2 3.19Å; W255-V267 WeakPolarHBondContact CA-O 3.43Å; W255-V267 HydrophobicContact CB-CB 4.15Å; W255-V267 VanDerWaalsContact CB-O 3.26Å; W255-V267 WeakPolarHBondContact CB-O 3.49Å; W255-V267 PolarHBondContact N-O 3.36Å; W255-V267 PolarHBondContact O-N 2.95Å; V267-T269 HydrophobicContact CG1-CG2 3.67Å; V267-V276 HydrophobicContact CG1-CG1 4.2Å; V267-V276 HydrophobicContact CG1-CG2 4.35Å; V267-R278 CarbonylContact C-O 3.38Å; V267-R278 VanDerWaalsContact CA-O 3.26Å; V267-R278 WeakPolarHBondContact CA-O 3.42Å; V267-L279 HydrophobicContact CG2-CD1 3.26Å
268	Q	92.6	Very high	86.9	Confident	36 Å²	36	72.5 Å²	72.5	17%	0.168	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128	168.7	-170.6	175.3	-3	0	0	107.9	T252 I253 D254 V276 Y277 R278	T252-Q268 HydrophobicContact CG2-CG 4.48Å; T252-Q268 PolarHBondContact OG1-NE2 2.79Å; I253-Q268 WeakPolarHBondContact O-CA 3.16Å; D254-Q268 VanDerWaalsContact OD1-CG 3.31Å; D254-Q268 WeakPolarHBondContact OD1-CG 3.43Å; Q268-V276 CarbonylContact O-C 3.55Å; Q268-Y277 PolarHBondContact O-N 3.06Å; Q268-R278 HydrophobicContact CB-CB 3.81Å; Q268-R278 PolarHBondContact N-O 3.09Å; Q268-R278 PolarHBondContact O-N 3.33Å
269	T	91.1	Very high	87	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	170.1	177.3	66.6	0	0	0	0	111.2	L234 T252 I253 W255 V267 R275 V276	L234-T269 HydrophobicContact CD2-CG2 3.56Å; T252-T269 CarbonylContact C-O 3.59Å; T252-T269 WeakPolarHBondContact CA-O 3.41Å; T252-T269 WeakPolarHBondContact CB-O 2.98Å; I253-T269 PolarHBondContact N-O 3.03Å; I253-T269 PolarHBondContact O-N 3.12Å; W255-T269 PolarHBondContact NE1-OG1 3.16Å; V267-T269 HydrophobicContact CG1-CG2 3.67Å; T269-R275 CarbonylContact C-O 3.57Å; T269-R275 WeakPolarHBondContact CA-O 3.03Å; T269-R275 VanDerWaalsContact CB-O 3.29Å; T269-R275 WeakPolarHBondContact CB-O 3.49Å; T269-V276 HydrophobicContact CG2-CG2 4.27Å
270	N	89.6	Confident	87.2	Confident	27 Å²	27	70.7 Å²	70.7	14%	0.144	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	166.5	159	67.6	-22.6	0	0	0	111.8	G251 A272 C273 T274 R275 Y277	G251-N270 WeakPolarHBondContact O-CA 3.46Å; N270-A272 PolarHBondContact O-N 3.48Å; N270-C273 PolarHBondContact O-N 3.28Å; N270-C273 PolarHBondContact OD1-N 2.99Å; N270-C273 VanDerWaalsContact OD1-N 3.15Å; N270-T274 PolarHBondContact ND2-OG1 3.31Å; N270-T274 PolarHBondContact OD1-N 3.45Å; N270-R275 PolarHBondContact N-O 3.33Å; N270-R275 PolarHBondContact OD1-N 3.23Å; N270-R275 PolarHBondContact OD1-O 2.79Å; N270-Y277 HydrophobicContact CB-CE2 3.69Å
271	L	87.1	Confident	87.4	Confident	74 Å²	74	71.8 Å²	71.8	39%	0.387	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.5	178.6	-61.6	-175.9	0	0	0	113.1	E246 G251 I253 C273	E246-L271 HydrophobicContact CG-CD2 3.68Å; E246-L271 WeakPolarHBondContact OE1-CD2 3.29Å; G251-L271 PolarHBondContact O-N 3.4Å; I253-L271 HydrophobicContact CD1-CD2 4.4Å; I253-L271 HydrophobicContact CG1-CD2 3.84Å; L271-C273 PolarHBondContact O-N 3.2Å
272	A	85	Confident	87.6	Confident	71 Å²	71	67 Å²	67	59%	0.587	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.1	178.4	0	0	0	0	0	113.9	N270 T274	N270-A272 PolarHBondContact O-N 3.48Å; A272-T274 HydrophobicContact CB-CG2 4.11Å; A272-T274 PolarHBondContact O-N 3.2Å
273	C	85.8	Confident	87.6	Confident	16 Å²	16	65.2 Å²	65.2	11%	0.108	33%	0.326	C	S	.	.	S	Bend	trans	56.9	26.5	-176.3	-53.7	0	0	0	0	114.3	L234 W255 N270 L271	L234-C273 HydrophobicContact CD1-CB 4.27Å; W255-C273 VanDerWaalsContact CZ2-SG 3.54Å; N270-C273 PolarHBondContact O-N 3.28Å; N270-C273 PolarHBondContact OD1-N 2.99Å; N270-C273 VanDerWaalsContact OD1-N 3.15Å; L271-C273 PolarHBondContact O-N 3.2Å
274	T	83.9	Confident	87.4	Confident	86 Å²	86	66.1 Å²	66.1	53%	0.528	33%	0.329	S	S	.	.	S	Bend	trans	-98.4	-18.4	-179.6	54.2	0	0	0	0	113.1	N219 L222 N270 A272	N219-T274 PolarHBondContact OD1-O 3.26Å; L222-T274 WeakPolarHBondContact CD1-O 2.98Å; N270-T274 PolarHBondContact ND2-OG1 3.31Å; N270-T274 PolarHBondContact OD1-N 3.45Å; A272-T274 HydrophobicContact CB-CG2 4.11Å; A272-T274 PolarHBondContact O-N 3.2Å
275	R	84.7	Confident	87.1	Confident	125 Å²	125	64.5 Å²	64.5	47%	0.472	33%	0.331	S	S	.	.			trans	-135.2	134.6	-177.8	-173.4	173.4	177.8	143.9	-1.6	111	T269 N270	T269-R275 CarbonylContact C-O 3.57Å; T269-R275 WeakPolarHBondContact CA-O 3.03Å; T269-R275 VanDerWaalsContact CB-O 3.29Å; T269-R275 WeakPolarHBondContact CB-O 3.49Å; N270-R275 PolarHBondContact N-O 3.33Å; N270-R275 PolarHBondContact OD1-N 3.23Å; N270-R275 PolarHBondContact OD1-O 2.79Å
276	V	86.5	Confident	86.5	Confident	20 Å²	20	67.5 Å²	67.5	12%	0.121	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.7	173.3	178.8	0	0	0	0	109.6	L222 V267 Q268 T269 L279	L222-V276 HydrophobicContact CD1-CG2 4.08Å; L222-V276 HydrophobicContact CD2-CG2 3.73Å; L222-V276 HydrophobicContact CG-CG2 4.38Å; V267-V276 HydrophobicContact CG1-CG1 4.2Å; V267-V276 HydrophobicContact CG1-CG2 4.35Å; Q268-V276 CarbonylContact O-C 3.55Å; T269-V276 HydrophobicContact CG2-CG2 4.27Å; V276-L279 HydrophobicContact CG1-CB 4.45Å
277	Y	86.3	Confident	85.6	Confident	125 Å²	125	66.2 Å²	66.2	49%	0.49	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-32.1	174	-65.5	-55.4	0	0	0	112.8	T252 Q268 N270	T252-Y277 HydrophobicContact CG2-CD2 3.66Å; T252-Y277 HydrophobicContact CG2-CE2 3.67Å; Q268-Y277 PolarHBondContact O-N 3.06Å; N270-Y277 HydrophobicContact CB-CE2 3.69Å
278	R	86.4	Confident	84.7	Confident	147 Å²	147	70.1 Å²	70.1	56%	0.555	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.4	136.8	-178.7	-168.6	179.3	179.1	171.2	7.3	110.4	V267 Q268	V267-R278 CarbonylContact C-O 3.38Å; V267-R278 VanDerWaalsContact CA-O 3.26Å; V267-R278 WeakPolarHBondContact CA-O 3.42Å; Q268-R278 HydrophobicContact CB-CB 3.81Å; Q268-R278 PolarHBondContact N-O 3.09Å; Q268-R278 PolarHBondContact O-N 3.33Å
279	L	87.9	Confident	83.7	Confident	73 Å²	73	71.3 Å²	71.3	38%	0.382	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.3	173.6	179.8	66.8	0	0	0	108.5	L218 Y241 V267 V276	L218-L279 HydrophobicContact CD1-CD2 3.82Å; Y241-L279 WeakPolarHBondContact OH-CD1 3.29Å; V267-L279 HydrophobicContact CG2-CD1 3.26Å; V276-L279 HydrophobicContact CG1-CB 4.45Å
280	V	88.7	Confident	83	Confident	47 Å²	47	72.2 Å²	72.2	29%	0.285	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127	173.1	179.1	0	0	0	0	107.6	G265 K266	G265-V280 WeakPolarHBondContact CA-O 3.44Å; K266-V280 HydrophobicContact CB-CB 4.08Å; K266-V280 HydrophobicContact CB-CG2 4.01Å; K266-V280 PolarHBondContact N-O 3.06Å; K266-V280 PolarHBondContact O-N 3.01Å
281	E	84.6	Confident	82.5	Confident	176 Å²	176	71.5 Å²	71.5	82%	0.822	38%	0.38	S	S	*	.			trans	-59.3	152.7	-176	-67.2	-178.7	177.7	0	0	113.5
282	H	85.7	Confident	82.4	Confident	27 Å²	27	69.8 Å²	69.8	13%	0.125	37%	0.372	C	S	.	.			trans	-96.8	143.1	179.4	-73.9	-112.1	0	0	0	110.7	Y239 Y241 C257 C263 H284	Y239-H282 HydrophobicContact CD1-CB 4.13Å; Y239-H282 AromaticContact CD1-CD2 3.91Å; Y239-H282 AromaticContact CD1-CE1 3.6Å; Y239-H282 AromaticContact CD1-CG 3.54Å; Y239-H282 AromaticContact CD1-ND1 3.34Å; Y239-H282 VanDerWaalsContact CD1-ND1 3.34Å; Y239-H282 WeakPolarHBondContact CD1-ND1 3.23Å; Y239-H282 AromaticContact CD1-NE2 3.98Å; Y239-H282 AromaticContact CD2-CD2 3.79Å; Y239-H282 HydrophobicContact CE1-CB 3.51Å; Y239-H282 AromaticContact CE1-CG 3.46Å; Y239-H282 VanDerWaalsContact CE1-CG 3.46Å; Y239-H282 AromaticContact CE1-ND1 3.66Å; Y239-H282 HydrophobicContact CE2-CB 4.34Å; Y239-H282 AromaticContact CE2-CD2 3.98Å; Y239-H282 AromaticContact CG-CD2 3.75Å; Y239-H282 AromaticContact CG-CE1 3.64Å; Y239-H282 AromaticContact CG-CG 3.89Å; Y239-H282 AromaticContact CG-ND1 3.83Å; Y239-H282 AromaticContact CG-NE2 3.64Å; Y239-H282 AromaticContact CZ-CG 3.79Å; Y241-H282 AromaticContact CE1-CE1 3.79Å; Y241-H282 AromaticContact CE1-NE2 3.25Å; Y241-H282 VanDerWaalsContact CE1-NE2 3.25Å; Y241-H282 WeakPolarHBondContact CE1-NE2 3.41Å; Y241-H282 AromaticContact CZ-CE1 3.87Å; Y241-H282 AromaticContact CZ-NE2 3.19Å; Y241-H282 PolarHBondContact OH-NE2 3.28Å; C257-H282 VanDerWaalsContact CB-CE1 3.48Å; C257-H282 WeakPolarHBondContact CB-CE1 3.25Å; C257-H282 PolarHBondContact SG-CE1 3.12Å; C263-H282 PolarHBondContact SG-ND1 2.89Å; H282-H284 AromaticContact ND1-CD2 3.96Å; H282-H284 AromaticContact ND1-CE1 3.5Å; H282-H284 PolarHBondContact ND1-CE1 3.11Å; H282-H284 AromaticContact ND1-NE2 3.12Å; H282-H284 PolarHBondContact ND1-NE2 2.8Å; H282-H284 VanDerWaalsContact ND1-NE2 3.12Å; H282-H284 PolarHBondContact O-N 3.29Å
283	C	85.9	Confident	82.5	Confident	87 Å²	87	66.7 Å²	66.7	59%	0.588	35%	0.346	S	S	*	.	S	Bend	trans	-86.7	21	171.6	68.6	0	0	0	0	113	F262	F262-C283 PolarHBondContact O-SG 3.24Å
284	H	82.7	Confident	82.5	Confident	25 Å²	25	67.2 Å²	67.2	12%	0.116	35%	0.347	C	S	.	.	S	Bend	trans	-146.6	154.7	-179.3	65.4	80.6	0	0	0	109.9	Y239 C257 F262 C263 H282 F287	Y239-H284 AromaticContact CD1-CE1 3.52Å; Y239-H284 AromaticContact CE1-CE1 3.56Å; Y239-H284 AromaticContact CE1-ND1 3.65Å; Y239-H284 WeakPolarHBondContact CE1-O 3.4Å; Y239-H284 PolarHBondContact OH-O 3.37Å; C257-H284 PolarHBondContact SG-NE2 2.8Å; F262-H284 HydrophobicContact CE2-CB 4.14Å; F262-H284 AromaticContact CE2-CD2 3.92Å; C263-H284 PolarHBondContact SG-CD2 3.43Å; C263-H284 PolarHBondContact SG-NE2 2.78Å; C263-H284 VanDerWaalsContact SG-NE2 3.44Å; H282-H284 AromaticContact ND1-CD2 3.96Å; H282-H284 AromaticContact ND1-CE1 3.5Å; H282-H284 PolarHBondContact ND1-CE1 3.11Å; H282-H284 AromaticContact ND1-NE2 3.12Å; H282-H284 PolarHBondContact ND1-NE2 2.8Å; H282-H284 VanDerWaalsContact ND1-NE2 3.12Å; H282-H284 PolarHBondContact O-N 3.29Å; H284-F287 AromaticContact CE1-CE2 3.94Å
285	P	80.1	Confident	82.7	Confident	103 Å²	103	67 Å²	67	67%	0.669	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-61.3	153.2	179.9	23.7	-33.6	0	0	0	111.6	Y239	Y239-P285 WeakPolarHBondContact CE1-O 3.41Å
286	P	77.4	Confident	83.1	Confident	63 Å²	63	61 Å²	61	41%	0.409	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-61.6	152.9	172.1	25.3	-31.6	0	0	0	110.8	N238 Y239	N238-P286 HydrophobicContact CB-CB 3.5Å; Y239-P286 VanDerWaalsContact CE1-CA 3.49Å; Y239-P286 HydrophobicContact CE1-CB 4.24Å; Y239-P286 HydrophobicContact CE2-CB 4.11Å; Y239-P286 WeakPolarHBondContact OH-CD 3.46Å
287	F	73.9	Confident	83.4	Confident	61 Å²	61	60.7 Å²	60.7	27%	0.268	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-83.8	132.3	174.2	-57.7	-78.5	0	0	0	110	W235 N238 H284 L290	W235-F287 HydrophobicContact CH2-CB 4.09Å; W235-F287 WeakPolarHBondContact CH2-O 3.39Å; W235-F287 HydrophobicContact CZ3-CB 4.32Å; N238-F287 PolarHBondContact O-N 3.05Å; H284-F287 AromaticContact CE1-CE2 3.94Å; F287-L290 HydrophobicContact CB-CD1 3.28Å; F287-L290 HydrophobicContact CB-CG 3.69Å; F287-L290 HydrophobicContact CD1-CD1 3.98Å; F287-L290 HydrophobicContact CD2-CD1 3.77Å; F287-L290 HydrophobicContact CG-CD1 3.43Å; F287-L290 VanDerWaalsContact CG-CD1 3.43Å; F287-L290 HydrophobicContact CG-CG 4.33Å
288	C	72.1	Confident	83.6	Confident	83 Å²	83	58.4 Å²	58.4	56%	0.561	31%	0.311	S	S	*	.	S	Bend	trans	-80.4	136.8	176.9	-61.1	0	0	0	0	110.8	L290 Q329	C288-L290 PolarHBondContact O-N 3.01Å; C288-Q329 VanDerWaalsContact O-CD 3.28Å; C288-Q329 PolarHBondContact O-NE2 3Å; C288-Q329 PolarHBondContact O-OE1 3.45Å
289	N	72.9	Confident	84	Confident	61 Å²	61	55.4 Å²	55.4	33%	0.326	30%	0.3	S	S	.	.	S	Bend	trans	56.9	12.2	166.5	-54.2	-35.1	0	0	0	118.5	P291 T292 V293 S325 V326	N289-P291 VanDerWaalsContact C-CD 3.44Å; N289-T292 WeakPolarHBondContact O-CA 3.48Å; N289-T292 VanDerWaalsContact O-CB 3.27Å; N289-T292 WeakPolarHBondContact O-CB 3.3Å; N289-T292 PolarHBondContact O-N 2.84Å; N289-V293 PolarHBondContact O-N 2.94Å; N289-S325 PolarHBondContact ND2-OG 3.46Å; N289-V326 HydrophobicContact CB-CG2 3.58Å
290	L	75.7	Confident	84.3	Confident	20 Å²	20	52 Å²	52	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-36.5	-176.7	-82.4	-177.4	0	0	0	115.6	W235 E240 F287 C288 T292 V293 H294	W235-L290 HydrophobicContact CE3-CB 4.23Å; W235-L290 HydrophobicContact CH2-CB 3.56Å; W235-L290 HydrophobicContact CH2-CD1 4.21Å; W235-L290 HydrophobicContact CH2-CG 4.25Å; W235-L290 HydrophobicContact CZ2-CB 4.38Å; W235-L290 HydrophobicContact CZ3-CB 3.5Å; W235-L290 VanDerWaalsContact CZ3-CB 3.5Å; W235-L290 HydrophobicContact CZ3-CD1 3.69Å; W235-L290 HydrophobicContact CZ3-CG 4.12Å; E240-L290 HydrophobicContact CG-CD1 3.87Å; F287-L290 HydrophobicContact CB-CD1 3.28Å; F287-L290 HydrophobicContact CB-CG 3.69Å; F287-L290 HydrophobicContact CD1-CD1 3.98Å; F287-L290 HydrophobicContact CD2-CD1 3.77Å; F287-L290 HydrophobicContact CG-CD1 3.43Å; F287-L290 VanDerWaalsContact CG-CD1 3.43Å; F287-L290 HydrophobicContact CG-CG 4.33Å; C288-L290 PolarHBondContact O-N 3.01Å; L290-T292 VanDerWaalsContact C-N 3.26Å; L290-T292 PolarHBondContact O-N 3.08Å; L290-V293 HydrophobicContact CD2-CB 4.36Å; L290-V293 HydrophobicContact CD2-CG2 4.44Å; L290-V293 WeakPolarHBondContact O-CB 3.16Å; L290-V293 PolarHBondContact O-N 2.84Å; L290-V293 VanDerWaalsContact O-N 3.12Å; L290-H294 PolarHBondContact O-CD2 3.13Å; L290-H294 PolarHBondContact O-N 3.29Å
291	P	79.1	Confident	84.5	Confident	11 Å²	11	52.3 Å²	52.3	7%	0.071	28%	0.278	C	S	.	.	H	α-helix	trans	-57.6	-43.6	173.8	-27.5	36.1	0	0	0	111.5	K223 W235 N289 V293 H294 E295	K223-P291 HydrophobicContact CD-CB 3.96Å; K223-P291 HydrophobicContact CD-CG 4.42Å; W235-P291 HydrophobicContact CD2-CG 3.66Å; W235-P291 VanDerWaalsContact CE2-CD 3.43Å; W235-P291 HydrophobicContact CE3-CG 4.46Å; W235-P291 HydrophobicContact CG-CG 3.88Å; W235-P291 HydrophobicContact CH2-CG 4.46Å; W235-P291 HydrophobicContact CZ2-CG 3.62Å; W235-P291 VanDerWaalsContact NE1-CG 3.27Å; N289-P291 VanDerWaalsContact C-CD 3.44Å; P291-V293 VanDerWaalsContact C-N 3.32Å; P291-V293 PolarHBondContact O-N 3.48Å; P291-H294 PolarHBondContact O-N 3.24Å; P291-E295 WeakPolarHBondContact O-CB 3.33Å; P291-E295 VanDerWaalsContact O-CG 3.25Å; P291-E295 WeakPolarHBondContact O-CG 3.46Å; P291-E295 PolarHBondContact O-N 3.23Å
292	T	85.5	Confident	84.8	Confident	38 Å²	38	50 Å²	50	23%	0.233	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-37.1	176.7	-44.4	0	0	0	0	111.3	N289 L290 T296 V326	N289-T292 WeakPolarHBondContact O-CA 3.48Å; N289-T292 VanDerWaalsContact O-CB 3.27Å; N289-T292 WeakPolarHBondContact O-CB 3.3Å; N289-T292 PolarHBondContact O-N 2.84Å; L290-T292 VanDerWaalsContact C-N 3.26Å; L290-T292 PolarHBondContact O-N 3.08Å; T292-T296 VanDerWaalsContact O-CB 3.31Å; T292-T296 WeakPolarHBondContact O-CB 3.27Å; T292-T296 PolarHBondContact O-N 3.17Å; T292-T296 PolarHBondContact O-OG1 2.62Å; T292-V326 HydrophobicContact CG2-CG1 4.28Å; T292-V326 HydrophobicContact CG2-CG2 3.86Å
293	V	87.5	Confident	85.2	Confident	6 Å²	6	50.8 Å²	50.8	4%	0.036	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-48.3	172.7	176.3	0	0	0	0	110.7	N289 L290 P291 T296 L297 V326 Q329 L330	N289-V293 PolarHBondContact O-N 2.94Å; L290-V293 HydrophobicContact CD2-CB 4.36Å; L290-V293 HydrophobicContact CD2-CG2 4.44Å; L290-V293 WeakPolarHBondContact O-CB 3.16Å; L290-V293 PolarHBondContact O-N 2.84Å; L290-V293 VanDerWaalsContact O-N 3.12Å; P291-V293 VanDerWaalsContact C-N 3.32Å; P291-V293 PolarHBondContact O-N 3.48Å; V293-T296 WeakPolarHBondContact O-CB 3.45Å; V293-T296 PolarHBondContact O-N 2.79Å; V293-L297 HydrophobicContact CG1-CD1 4.4Å; V293-L297 WeakPolarHBondContact O-CG 3.29Å; V293-L297 PolarHBondContact O-N 2.98Å; V293-V326 HydrophobicContact CG2-CG1 3.94Å; V293-Q329 HydrophobicContact CG2-CB 3.83Å; V293-L330 HydrophobicContact CG1-CD2 4.01Å
294	H	84.8	Confident	85.4	Confident	28 Å²	28	46.6 Å²	46.6	13%	0.13	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-45.2	178	-74.8	-68.6	0	0	0	112.1	E240 L290 P291 T296 L297 D298	E240-H294 IonicContact OE1-CD2 2.76Å; E240-H294 IonicContact OE1-CE1 3.86Å; E240-H294 IonicContact OE1-NE2 2.7Å; E240-H294 PolarHBondContact OE1-NE2 3.06Å; L290-H294 PolarHBondContact O-CD2 3.13Å; L290-H294 PolarHBondContact O-N 3.29Å; P291-H294 PolarHBondContact O-N 3.24Å; H294-T296 VanDerWaalsContact C-N 3.26Å; H294-T296 PolarHBondContact O-N 3Å; H294-L297 CarbonylContact O-C 3.58Å; H294-L297 PolarHBondContact O-N 2.8Å; H294-L297 VanDerWaalsContact O-N 3.12Å; H294-D298 PolarHBondContact O-N 2.67Å
295	E	88.9	Confident	85.6	Confident	81 Å²	81	46.2 Å²	46.2	38%	0.379	24%	0.242	S	C	.	.	H	α-helix	trans	-57.8	-39.5	174.5	-74.2	167.5	-162.5	0	0	111.7	K223 P291 D298 R299	K223-E295 IonicContact NZ-OE1 3.93Å; K223-E295 PolarHBondContact NZ-OE1 3.24Å; P291-E295 WeakPolarHBondContact O-CB 3.33Å; P291-E295 VanDerWaalsContact O-CG 3.25Å; P291-E295 WeakPolarHBondContact O-CG 3.46Å; P291-E295 PolarHBondContact O-N 3.23Å; E295-D298 PolarHBondContact O-N 3.45Å; E295-R299 WeakPolarHBondContact O-CB 3.29Å; E295-R299 PolarHBondContact O-N 3.03Å
296	T	93.3	Very high	85.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-44.2	175.7	-56.6	0	0	0	0	111	T292 V293 H294 R299 M300 C318 R322 L330	T292-T296 VanDerWaalsContact O-CB 3.31Å; T292-T296 WeakPolarHBondContact O-CB 3.27Å; T292-T296 PolarHBondContact O-N 3.17Å; T292-T296 PolarHBondContact O-OG1 2.62Å; V293-T296 WeakPolarHBondContact O-CB 3.45Å; V293-T296 PolarHBondContact O-N 2.79Å; H294-T296 VanDerWaalsContact C-N 3.26Å; H294-T296 PolarHBondContact O-N 3Å; T296-R299 WeakPolarHBondContact O-CB 3.39Å; T296-R299 PolarHBondContact O-N 2.88Å; T296-M300 HydrophobicContact CG2-CE 3.8Å; T296-M300 VanDerWaalsContact O-CG 3.31Å; T296-M300 WeakPolarHBondContact O-CG 3.39Å; T296-M300 PolarHBondContact O-N 3.43Å; T296-C318 HydrophobicContact CG2-CB 4.33Å; T296-R322 HydrophobicContact CG2-CG 4.38Å; T296-R322 WeakPolarHBondContact OG1-CD 3.49Å; T296-L330 HydrophobicContact CG2-CD1 4.43Å; T296-L330 HydrophobicContact CG2-CD2 4.17Å
297	L	92.4	Very high	86.5	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-38.3	175.5	-69.6	174.2	0	0	0	112.1	V293 H294 M300 R301 L330 P331 I336 M339	V293-L297 HydrophobicContact CG1-CD1 4.4Å; V293-L297 WeakPolarHBondContact O-CG 3.29Å; V293-L297 PolarHBondContact O-N 2.98Å; H294-L297 CarbonylContact O-C 3.58Å; H294-L297 PolarHBondContact O-N 2.8Å; H294-L297 VanDerWaalsContact O-N 3.12Å; L297-M300 HydrophobicContact CD2-SD 4.24Å; L297-M300 WeakPolarHBondContact O-CB 2.92Å; L297-M300 PolarHBondContact O-N 3.08Å; L297-R301 VanDerWaalsContact O-CG 3.31Å; L297-R301 WeakPolarHBondContact O-CG 3.41Å; L297-R301 PolarHBondContact O-N 3.3Å; L297-L330 HydrophobicContact CD2-CD2 4.06Å; L297-L330 HydrophobicContact CG-CD2 4.14Å; L297-P331 HydrophobicContact CD1-CG 4.28Å; L297-P331 HydrophobicContact CD2-CG 4.34Å; L297-I336 HydrophobicContact CD2-CG1 4.42Å; L297-M339 HydrophobicContact CD2-CE 3.92Å; L297-M339 HydrophobicContact CD2-SD 4.37Å
298	D	90.6	Very high	87	Confident	78 Å²	78	47.8 Å²	47.8	42%	0.417	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-40.7	175.5	-77.7	-31.8	0	0	0	111.8	H294 E295 M300 R301 K302	H294-D298 PolarHBondContact O-N 2.67Å; E295-D298 PolarHBondContact O-N 3.45Å; D298-M300 VanDerWaalsContact C-N 3.33Å; D298-M300 PolarHBondContact O-N 2.95Å; D298-R301 WeakPolarHBondContact O-CB 2.8Å; D298-R301 PolarHBondContact O-N 2.73Å; D298-R301 IonicContact OD1-CZ 3.88Å; D298-R301 IonicContact OD1-NH1 2.77Å; D298-R301 PolarHBondContact OD1-NH1 2.68Å; D298-K302 WeakPolarHBondContact O-CB 3.26Å; D298-K302 PolarHBondContact O-N 2.83Å
299	R	93.9	Very high	87.7	Confident	84 Å²	84	47 Å²	47	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-59	-44.8	170.9	-171.5	-175.3	-62	169.2	-4.6	111.4	E295 T296 R301 K302 M303 D321	E295-R299 WeakPolarHBondContact O-CB 3.29Å; E295-R299 PolarHBondContact O-N 3.03Å; T296-R299 WeakPolarHBondContact O-CB 3.39Å; T296-R299 PolarHBondContact O-N 2.88Å; R299-R301 VanDerWaalsContact C-N 3.34Å; R299-R301 PolarHBondContact O-N 2.94Å; R299-K302 PolarHBondContact O-N 2.92Å; R299-M303 HydrophobicContact CG-SD 4.33Å; R299-M303 WeakPolarHBondContact O-CB 3.48Å; R299-M303 WeakPolarHBondContact O-CG 3.13Å; R299-M303 PolarHBondContact O-N 3.3Å; R299-D321 IonicContact CZ-OD2 3.96Å; R299-D321 IonicContact NH1-OD1 3.1Å; R299-D321 PolarHBondContact NH1-OD1 2.99Å; R299-D321 VanDerWaalsContact NH1-OD1 3.1Å; R299-D321 IonicContact NH1-OD2 3.01Å; R299-D321 PolarHBondContact NH1-OD2 3.02Å; R299-D321 IonicContact NH2-OD2 3.82Å
300	M	94.9	Very high	88.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-38.9	175.1	-69.9	174.7	-177.6	0	0	112.2	T296 L297 D298 G304 I314 Y315 C318 T319 L330 I336 M339	T296-M300 HydrophobicContact CG2-CE 3.8Å; T296-M300 VanDerWaalsContact O-CG 3.31Å; T296-M300 WeakPolarHBondContact O-CG 3.39Å; T296-M300 PolarHBondContact O-N 3.43Å; L297-M300 HydrophobicContact CD2-SD 4.24Å; L297-M300 WeakPolarHBondContact O-CB 2.92Å; L297-M300 PolarHBondContact O-N 3.08Å; D298-M300 VanDerWaalsContact C-N 3.33Å; D298-M300 PolarHBondContact O-N 2.95Å; M300-G304 PolarHBondContact O-N 3.2Å; M300-I314 HydrophobicContact CB-CG2 4.28Å; M300-I314 HydrophobicContact CG-CG2 4.27Å; M300-Y315 HydrophobicContact CE-CD2 3.56Å; M300-Y315 HydrophobicContact CE-CE2 4.03Å; M300-Y315 HydrophobicContact CE-CG 4.34Å; M300-Y315 HydrophobicContact SD-CD2 4.42Å; M300-C318 HydrophobicContact CE-CB 3.68Å; M300-C318 HydrophobicContact CG-CB 3.6Å; M300-C318 VanDerWaalsContact CG-SG 3.53Å; M300-T319 HydrophobicContact CE-CG2 3.81Å; M300-L330 HydrophobicContact CE-CD1 4.21Å; M300-I336 HydrophobicContact SD-CD1 4.34Å; M300-I336 HydrophobicContact SD-CG2 3.64Å; M300-M339 HydrophobicContact CB-CE 3.98Å
301	R	92.9	Very high	89.2	Confident	54 Å²	54	45.6 Å²	45.6	20%	0.204	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-46.8	175.3	-70.3	172	-165.1	141.2	8.5	111.4	L297 D298 R299 G304 A305 M339 Q343	L297-R301 VanDerWaalsContact O-CG 3.31Å; L297-R301 WeakPolarHBondContact O-CG 3.41Å; L297-R301 PolarHBondContact O-N 3.3Å; D298-R301 WeakPolarHBondContact O-CB 2.8Å; D298-R301 PolarHBondContact O-N 2.73Å; D298-R301 IonicContact OD1-CZ 3.88Å; D298-R301 IonicContact OD1-NH1 2.77Å; D298-R301 PolarHBondContact OD1-NH1 2.68Å; R299-R301 VanDerWaalsContact C-N 3.34Å; R299-R301 PolarHBondContact O-N 2.94Å; R301-G304 PolarHBondContact O-N 3.3Å; R301-A305 PolarHBondContact O-N 3.35Å; R301-M339 HydrophobicContact CG-CE 4.02Å; R301-M339 HydrophobicContact CG-CG 4.15Å; R301-M339 HydrophobicContact CG-SD 3.8Å; R301-M339 PolarHBondContact NE-SD 3.37Å; R301-M339 VanDerWaalsContact NE-SD 3.36Å; R301-Q343 HydrophobicContact CB-CG 3.87Å; R301-Q343 HydrophobicContact CG-CG 3.81Å
302	K	91.5	Very high	89.8	Confident	129 Å²	129	55.5 Å²	55.5	56%	0.561	27%	0.267	S	S	*	.	H	α-helix	trans	-62.6	-51.8	178.7	-174.9	178.4	178	-178.6	0	111.6	D298 R299 G304 A305 E306	D298-K302 WeakPolarHBondContact O-CB 3.26Å; D298-K302 PolarHBondContact O-N 2.83Å; R299-K302 PolarHBondContact O-N 2.92Å; K302-G304 VanDerWaalsContact C-N 3.26Å; K302-G304 PolarHBondContact O-N 3.19Å; K302-A305 PolarHBondContact O-N 3.2Å; K302-A305 VanDerWaalsContact O-N 3.09Å; K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 WeakPolarHBondContact CE-OE2 3.38Å; K302-E306 WeakPolarHBondContact CG-OE1 3.32Å; K302-E306 WeakPolarHBondContact CG-OE2 3.44Å; K302-E306 PolarHBondContact O-N 2.87Å
303	M	93.1	Very high	90.2	Very high	42 Å²	42	58.6 Å²	58.6	21%	0.207	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-37.7	175.5	-72.6	-173.8	71	0	0	112	R299 A305 T307 L309 I314 A317 C318	R299-M303 HydrophobicContact CG-SD 4.33Å; R299-M303 WeakPolarHBondContact O-CB 3.48Å; R299-M303 WeakPolarHBondContact O-CG 3.13Å; R299-M303 PolarHBondContact O-N 3.3Å; M303-A305 VanDerWaalsContact C-N 3.33Å; M303-A305 PolarHBondContact O-N 3.45Å; M303-T307 WeakPolarHBondContact O-CB 3.37Å; M303-T307 PolarHBondContact O-N 3.42Å; M303-T307 PolarHBondContact O-OG1 3.17Å; M303-L309 HydrophobicContact CE-CD1 4.02Å; M303-I314 HydrophobicContact CB-CG1 4.43Å; M303-I314 HydrophobicContact CB-CG2 3.94Å; M303-A317 HydrophobicContact CE-CB 4.04Å; M303-C318 PolarHBondContact SD-SG 3.03Å
304	G	90	Very high	90.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-41.5	174.2	0	0	0	0	0	112.8	M300 R301 K302 R344	M300-G304 PolarHBondContact O-N 3.2Å; R301-G304 PolarHBondContact O-N 3.3Å; K302-G304 VanDerWaalsContact C-N 3.26Å; K302-G304 PolarHBondContact O-N 3.19Å; G304-R344 WeakPolarHBondContact O-CG 3.45Å
305	A	87.2	Confident	91	Very high	16 Å²	16	59.3 Å²	59.3	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-72	-42.8	178.6	0	0	0	0	0	113	R301 K302 M303 H347	R301-A305 PolarHBondContact O-N 3.35Å; K302-A305 PolarHBondContact O-N 3.2Å; K302-A305 VanDerWaalsContact O-N 3.09Å; M303-A305 VanDerWaalsContact C-N 3.33Å; M303-A305 PolarHBondContact O-N 3.45Å; A305-H347 HydrophobicContact CB-CB 3.82Å; A305-H347 PolarHBondContact O-CD2 3.4Å
306	E	87	Confident	91.3	Very high	129 Å²	129	63 Å²	63	60%	0.603	30%	0.295	S	S	*	.	H	α-helix	trans	-92.9	-20.2	-167.6	-66.2	170.4	179.3	0	0	114.1	K302	K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 WeakPolarHBondContact CE-OE2 3.38Å; K302-E306 WeakPolarHBondContact CG-OE1 3.32Å; K302-E306 WeakPolarHBondContact CG-OE2 3.44Å; K302-E306 PolarHBondContact O-N 2.87Å
307	T	88.6	Confident	91.4	Very high	37 Å²	37	65.5 Å²	65.5	23%	0.227	32%	0.316	C	S	.	.			trans	-116.8	159.7	-174	76.6	0	0	0	0	112.9	M303 N365	M303-T307 WeakPolarHBondContact O-CB 3.37Å; M303-T307 PolarHBondContact O-N 3.42Å; M303-T307 PolarHBondContact O-OG1 3.17Å; T307-N365 PolarHBondContact O-ND2 3.32Å
308	T	85	Confident	91.5	Very high	95 Å²	95	64.9 Å²	64.9	58%	0.583	31%	0.313	S	S	*	.			trans	-95.5	2.2	173.1	53.9	0	0	0	0	112.9	P364	T308-P364 HydrophobicContact CG2-CB 3.87Å; T308-P364 HydrophobicContact CG2-CG 3.72Å
309	L	88.1	Confident	91.7	Very high	66 Å²	66	61.9 Å²	61.9	35%	0.346	30%	0.297	S	S	.	.			trans	-62.5	134.8	-178.8	-65.8	177.5	0	0	0	111.4	M303 Q313 I314 R344	M303-L309 HydrophobicContact CE-CD1 4.02Å; L309-Q313 HydrophobicContact CB-CB 4.15Å; L309-I314 HydrophobicContact CB-CD1 4.42Å; L309-I314 HydrophobicContact CB-CG1 3.83Å; L309-I314 WeakPolarHBondContact O-CD1 3.48Å; L309-I314 WeakPolarHBondContact O-CG1 3.33Å; L309-R344 PolarHBondContact O-NH2 3.07Å
310	S	89	Confident	91.7	Very high	38 Å²	38	62 Å²	62	27%	0.266	32%	0.316	S	S	.	.			trans	-53.9	152.2	178.7	66.9	0	0	0	0	112.5	R312 Q313 I314	S310-R312 PolarHBondContact O-N 2.98Å; S310-Q313 WeakPolarHBondContact O-CB 3.42Å; S310-Q313 PolarHBondContact O-N 3.43Å; S310-Q313 WeakPolarHBondContact OG-CG 3.31Å; S310-Q313 PolarHBondContact OG-N 3.48Å; S310-Q313 PolarHBondContact OG-OE1 3.33Å; S310-I314 PolarHBondContact O-N 2.86Å
311	P	90	Very high	91.6	Very high	13 Å²	13	66.3 Å²	66.3	8%	0.084	34%	0.339	C	S	.	.	H	α-helix	trans	-53.9	-30.8	177.7	-28.8	36.1	0	0	0	113.9	Y315 R337 I340 Y341	P311-Y315 VanDerWaalsContact O-CB 3.32Å; P311-Y315 WeakPolarHBondContact O-CB 3.17Å; P311-Y315 PolarHBondContact O-N 2.94Å; P311-R337 HydrophobicContact CB-CB 4.31Å; P311-R337 HydrophobicContact CB-CG 3.91Å; P311-R337 HydrophobicContact CG-CG 4.02Å; P311-I340 HydrophobicContact CB-CD1 3.98Å; P311-I340 HydrophobicContact CB-CG2 4.44Å; P311-I340 HydrophobicContact CG-CG2 4.17Å; P311-Y341 HydrophobicContact CG-CD1 4.34Å; P311-Y341 HydrophobicContact CG-CE1 3.62Å
312	R	92	Very high	91.5	Very high	220 Å²	220	65.9 Å²	65.9	83%	0.83	34%	0.338	S	S	*	.	H	α-helix	trans	-68.2	-43.9	174.4	-72.7	-176.5	174.3	179	-2.5	112.4	S310 Y315 K316	S310-R312 PolarHBondContact O-N 2.98Å; R312-Y315 PolarHBondContact O-N 3.43Å; R312-K316 WeakPolarHBondContact O-CB 3.41Å; R312-K316 PolarHBondContact O-N 3.06Å
313	Q	93.7	Very high	91.5	Very high	103 Å²	103	63 Å²	63	48%	0.481	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-42.4	176.2	-74.5	163.9	-39	0	0	111.3	L309 S310 K316 A317	L309-Q313 HydrophobicContact CB-CB 4.15Å; S310-Q313 WeakPolarHBondContact O-CB 3.42Å; S310-Q313 PolarHBondContact O-N 3.43Å; S310-Q313 WeakPolarHBondContact OG-CG 3.31Å; S310-Q313 PolarHBondContact OG-N 3.48Å; S310-Q313 PolarHBondContact OG-OE1 3.33Å; Q313-K316 PolarHBondContact O-N 3.33Å; Q313-A317 VanDerWaalsContact O-CB 3.32Å; Q313-A317 WeakPolarHBondContact O-CB 3.22Å; Q313-A317 PolarHBondContact O-N 2.91Å
314	I	93.8	Very high	91.4	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60.6	-47.1	175	-65.9	171.9	0	0	0	110.3	M300 M303 L309 S310 A317 C318 I340	M300-I314 HydrophobicContact CB-CG2 4.28Å; M300-I314 HydrophobicContact CG-CG2 4.27Å; M303-I314 HydrophobicContact CB-CG1 4.43Å; M303-I314 HydrophobicContact CB-CG2 3.94Å; L309-I314 HydrophobicContact CB-CD1 4.42Å; L309-I314 HydrophobicContact CB-CG1 3.83Å; L309-I314 WeakPolarHBondContact O-CD1 3.48Å; L309-I314 WeakPolarHBondContact O-CG1 3.33Å; S310-I314 PolarHBondContact O-N 2.86Å; I314-A317 PolarHBondContact O-N 2.99Å; I314-C318 WeakPolarHBondContact O-CB 3.28Å; I314-C318 PolarHBondContact O-N 3.33Å; I314-C318 PolarHBondContact O-SG 3.5Å; I314-I340 HydrophobicContact CB-CD1 4.17Å; I314-I340 HydrophobicContact CD1-CD1 4.47Å; I314-I340 HydrophobicContact CD1-CG2 4Å; I314-I340 HydrophobicContact CG2-CD1 3.93Å
315	Y	95.2	Very high	91.3	Very high	49 Å²	49	71.8 Å²	71.8	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-56.8	-53.5	177.1	179.8	-92.3	0	0	0	110.8	M300 P311 R312 A317 C318 T319 I327 L330 L333 I336	M300-Y315 HydrophobicContact CE-CD2 3.56Å; M300-Y315 HydrophobicContact CE-CE2 4.03Å; M300-Y315 HydrophobicContact CE-CG 4.34Å; M300-Y315 HydrophobicContact SD-CD2 4.42Å; P311-Y315 VanDerWaalsContact O-CB 3.32Å; P311-Y315 WeakPolarHBondContact O-CB 3.17Å; P311-Y315 PolarHBondContact O-N 2.94Å; R312-Y315 PolarHBondContact O-N 3.43Å; Y315-A317 VanDerWaalsContact C-N 3.33Å; Y315-A317 PolarHBondContact O-N 2.93Å; Y315-C318 PolarHBondContact O-N 2.87Å; Y315-C318 VanDerWaalsContact O-N 3.15Å; Y315-T319 HydrophobicContact CD1-CG2 4.36Å; Y315-T319 HydrophobicContact CD2-CG2 4.2Å; Y315-T319 HydrophobicContact CE1-CG2 4.04Å; Y315-T319 HydrophobicContact CE2-CG2 3.88Å; Y315-T319 HydrophobicContact CG-CG2 4.45Å; Y315-T319 WeakPolarHBondContact O-CG2 3.47Å; Y315-T319 PolarHBondContact O-N 3.4Å; Y315-T319 PolarHBondContact O-OG1 3.28Å; Y315-I327 WeakPolarHBondContact OH-CG2 3.36Å; Y315-L330 HydrophobicContact CE2-CD1 3.97Å; Y315-L333 HydrophobicContact CD1-CD2 3.83Å; Y315-L333 HydrophobicContact CD2-CD2 3.45Å; Y315-L333 VanDerWaalsContact CD2-CD2 3.45Å; Y315-L333 HydrophobicContact CE1-CD2 3.79Å; Y315-L333 HydrophobicContact CE2-CD2 3.4Å; Y315-L333 HydrophobicContact CG-CD2 3.66Å; Y315-I336 HydrophobicContact CD2-CD1 3.85Å; Y315-I336 HydrophobicContact CD2-CG2 4.38Å; Y315-I336 HydrophobicContact CE2-CD1 3.67Å
316	K	95.1	Very high	91.4	Very high	158 Å²	158	71 Å²	71	69%	0.687	37%	0.365	S	S	*	.	H	α-helix	trans	-56.5	-45	179.5	-172.7	179	179.9	-178	0	112.1	R312 Q313 T319 A320	R312-K316 WeakPolarHBondContact O-CB 3.41Å; R312-K316 PolarHBondContact O-N 3.06Å; Q313-K316 PolarHBondContact O-N 3.33Å; K316-T319 PolarHBondContact O-N 3.03Å; K316-T319 PolarHBondContact O-OG1 3.31Å; K316-A320 WeakPolarHBondContact O-CB 3.34Å; K316-A320 PolarHBondContact O-N 3.35Å
317	A	95.1	Very high	91.5	Very high	52 Å²	52	67.1 Å²	67.1	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-39.2	178.9	0	0	0	0	0	112.5	M303 Q313 I314 Y315	M303-A317 HydrophobicContact CE-CB 4.04Å; Q313-A317 VanDerWaalsContact O-CB 3.32Å; Q313-A317 WeakPolarHBondContact O-CB 3.22Å; Q313-A317 PolarHBondContact O-N 2.91Å; I314-A317 PolarHBondContact O-N 2.99Å; Y315-A317 VanDerWaalsContact C-N 3.33Å; Y315-A317 PolarHBondContact O-N 2.93Å
318	C	95.2	Very high	91.5	Very high	0 Å²	0	72 Å²	72	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-77.2	-21.4	-179.5	-67.7	0	0	0	0	113.8	T296 M300 M303 I314 Y315 R322	T296-C318 HydrophobicContact CG2-CB 4.33Å; M300-C318 HydrophobicContact CE-CB 3.68Å; M300-C318 HydrophobicContact CG-CB 3.6Å; M300-C318 VanDerWaalsContact CG-SG 3.53Å; M303-C318 PolarHBondContact SD-SG 3.03Å; I314-C318 WeakPolarHBondContact O-CB 3.28Å; I314-C318 PolarHBondContact O-N 3.33Å; I314-C318 PolarHBondContact O-SG 3.5Å; Y315-C318 PolarHBondContact O-N 2.87Å; Y315-C318 VanDerWaalsContact O-N 3.15Å; C318-R322 VanDerWaalsContact O-CG 3.31Å; C318-R322 WeakPolarHBondContact O-CG 3.29Å
319	T	95	Very high	91.7	Very high	15 Å²	15	70.8 Å²	70.8	9%	0.092	36%	0.356	C	S	.	.	H	α-helix	trans	-101.7	-10.7	179.5	61.1	0	0	0	0	113.8	M300 Y315 K316 D321 R322 I327 L330	M300-T319 HydrophobicContact CE-CG2 3.81Å; Y315-T319 HydrophobicContact CD1-CG2 4.36Å; Y315-T319 HydrophobicContact CD2-CG2 4.2Å; Y315-T319 HydrophobicContact CE1-CG2 4.04Å; Y315-T319 HydrophobicContact CE2-CG2 3.88Å; Y315-T319 HydrophobicContact CG-CG2 4.45Å; Y315-T319 WeakPolarHBondContact O-CG2 3.47Å; Y315-T319 PolarHBondContact O-N 3.4Å; Y315-T319 PolarHBondContact O-OG1 3.28Å; K316-T319 PolarHBondContact O-N 3.03Å; K316-T319 PolarHBondContact O-OG1 3.31Å; T319-D321 PolarHBondContact O-N 3.11Å; T319-R322 PolarHBondContact O-N 3.36Å; T319-R322 VanDerWaalsContact O-N 3.13Å; T319-I327 HydrophobicContact CG2-CG1 4.38Å; T319-L330 HydrophobicContact CG2-CD1 3.73Å
320	A	93.4	Very high	91.8	Very high	86 Å²	86	68.5 Å²	68.5	71%	0.711	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.9	-176.3	0	0	0	0	0	113.4	K316	K316-A320 WeakPolarHBondContact O-CB 3.34Å; K316-A320 PolarHBondContact O-N 3.35Å
321	D	92.1	Very high	91.9	Very high	91 Å²	91	68.7 Å²	68.7	49%	0.487	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	9.8	-179.9	70.2	-33.3	0	0	0	113.3	R299 T319	R299-D321 IonicContact CZ-OD2 3.96Å; R299-D321 IonicContact NH1-OD1 3.1Å; R299-D321 PolarHBondContact NH1-OD1 2.99Å; R299-D321 VanDerWaalsContact NH1-OD1 3.1Å; R299-D321 IonicContact NH1-OD2 3.01Å; R299-D321 PolarHBondContact NH1-OD2 3.02Å; R299-D321 IonicContact NH2-OD2 3.82Å; T319-D321 PolarHBondContact O-N 3.11Å
322	R	92.2	Very high	91.9	Very high	45 Å²	45	72.5 Å²	72.5	17%	0.17	37%	0.369	C	S	.	.	S	Bend	trans	-105.1	139.6	-172.4	-59.7	-66.6	135.4	176.3	-20.4	111.2	T296 C318 T319 V326 I327	T296-R322 HydrophobicContact CG2-CG 4.38Å; T296-R322 WeakPolarHBondContact OG1-CD 3.49Å; C318-R322 VanDerWaalsContact O-CG 3.31Å; C318-R322 WeakPolarHBondContact O-CG 3.29Å; T319-R322 PolarHBondContact O-N 3.36Å; T319-R322 VanDerWaalsContact O-N 3.13Å; R322-V326 HydrophobicContact CB-CB 4.48Å; R322-V326 HydrophobicContact CB-CG1 4.33Å; R322-I327 HydrophobicContact CB-CG1 4.27Å
323	P	91	Very high	91.8	Very high	69 Å²	69	67.1 Å²	67.1	45%	0.448	36%	0.356	S	S	.	.			trans	-66.9	152	174.7	29.5	-34.7	0	0	0	110.8	S325 V326 I327	P323-S325 PolarHBondContact O-N 3.48Å; P323-S325 VanDerWaalsContact O-N 3.15Å; P323-V326 HydrophobicContact CG-CB 4.22Å; P323-V326 HydrophobicContact CG-CG2 3.7Å; P323-V326 WeakPolarHBondContact O-CB 3.41Å; P323-V326 PolarHBondContact O-N 3.29Å; P323-I327 PolarHBondContact O-N 2.96Å
324	Y	90	Very high	91.7	Very high	176 Å²	176	69.1 Å²	69.1	69%	0.69	36%	0.363	S	S	*	.	H	α-helix	trans	-53.5	-38.6	-177.6	-177.7	-95.9	0	0	0	113.2	V326 I327 E328	Y324-V326 PolarHBondContact O-N 2.93Å; Y324-I327 WeakPolarHBondContact O-CB 3.4Å; Y324-I327 PolarHBondContact O-N 3.43Å; Y324-E328 HydrophobicContact CE1-CB 4.46Å; Y324-E328 PolarHBondContact O-N 3.41Å
325	S	88.5	Confident	91.6	Very high	49 Å²	49	71.9 Å²	71.9	34%	0.343	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-21.4	178.3	58.2	0	0	0	0	114.9	N289 P323 Q329	N289-S325 PolarHBondContact ND2-OG 3.46Å; P323-S325 PolarHBondContact O-N 3.48Å; P323-S325 VanDerWaalsContact O-N 3.15Å; S325-Q329 WeakPolarHBondContact O-CG 3.32Å; S325-Q329 PolarHBondContact O-NE2 3.21Å
326	V	89.1	Confident	91.5	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.006	38%	0.375	C	S	.	.	H	α-helix	trans	-81	-42.7	170.6	169.7	0	0	0	0	109.9	N289 T292 V293 R322 P323 Y324 E328 Q329 L330	N289-V326 HydrophobicContact CB-CG2 3.58Å; T292-V326 HydrophobicContact CG2-CG1 4.28Å; T292-V326 HydrophobicContact CG2-CG2 3.86Å; V293-V326 HydrophobicContact CG2-CG1 3.94Å; R322-V326 HydrophobicContact CB-CB 4.48Å; R322-V326 HydrophobicContact CB-CG1 4.33Å; P323-V326 HydrophobicContact CG-CB 4.22Å; P323-V326 HydrophobicContact CG-CG2 3.7Å; P323-V326 WeakPolarHBondContact O-CB 3.41Å; P323-V326 PolarHBondContact O-N 3.29Å; Y324-V326 PolarHBondContact O-N 2.93Å; V326-E328 VanDerWaalsContact C-N 3.32Å; V326-E328 PolarHBondContact O-N 3.44Å; V326-Q329 PolarHBondContact O-N 3.21Å; V326-L330 PolarHBondContact O-N 2.87Å
327	I	90.2	Very high	91.2	Very high	47 Å²	47	66.7 Å²	66.7	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-42.4	-178.7	-59.6	175.9	0	0	0	110.6	Y315 T319 R322 P323 Y324 Q329 L330	Y315-I327 WeakPolarHBondContact OH-CG2 3.36Å; T319-I327 HydrophobicContact CG2-CG1 4.38Å; R322-I327 HydrophobicContact CB-CG1 4.27Å; P323-I327 PolarHBondContact O-N 2.96Å; Y324-I327 WeakPolarHBondContact O-CB 3.4Å; Y324-I327 PolarHBondContact O-N 3.43Å; I327-Q329 PolarHBondContact O-N 3.11Å; I327-L330 WeakPolarHBondContact O-CB 3.43Å; I327-L330 PolarHBondContact O-N 2.76Å; I327-L330 VanDerWaalsContact O-N 3.11Å
328	E	88.9	Confident	91	Very high	140 Å²	140	67.6 Å²	67.6	65%	0.654	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.3	177.6	-172.2	176.3	-172.6	0	0	113.2	Y324 V326	Y324-E328 HydrophobicContact CE1-CB 4.46Å; Y324-E328 PolarHBondContact O-N 3.41Å; V326-E328 VanDerWaalsContact C-N 3.32Å; V326-E328 PolarHBondContact O-N 3.44Å
329	Q	87.7	Confident	90.8	Very high	69 Å²	69	68.8 Å²	68.8	32%	0.322	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.2	179	-69.2	-177.6	57.6	0	0	113.8	C288 V293 S325 V326 I327	C288-Q329 VanDerWaalsContact O-CD 3.28Å; C288-Q329 PolarHBondContact O-NE2 3Å; C288-Q329 PolarHBondContact O-OE1 3.45Å; V293-Q329 HydrophobicContact CG2-CB 3.83Å; S325-Q329 WeakPolarHBondContact O-CG 3.32Å; S325-Q329 PolarHBondContact O-NE2 3.21Å; V326-Q329 PolarHBondContact O-N 3.21Å; I327-Q329 PolarHBondContact O-N 3.11Å
330	L	90.7	Very high	90.6	Very high	17 Å²	17	68 Å²	68	9%	0.089	36%	0.356	C	S	.	.	S	Bend	trans	-66.5	148.9	177.1	-69.2	170.7	0	0	0	110.3	V293 T296 L297 M300 Y315 T319 V326 I327 I336	V293-L330 HydrophobicContact CG1-CD2 4.01Å; T296-L330 HydrophobicContact CG2-CD1 4.43Å; T296-L330 HydrophobicContact CG2-CD2 4.17Å; L297-L330 HydrophobicContact CD2-CD2 4.06Å; L297-L330 HydrophobicContact CG-CD2 4.14Å; M300-L330 HydrophobicContact CE-CD1 4.21Å; Y315-L330 HydrophobicContact CE2-CD1 3.97Å; T319-L330 HydrophobicContact CG2-CD1 3.73Å; V326-L330 PolarHBondContact O-N 2.87Å; I327-L330 WeakPolarHBondContact O-CB 3.43Å; I327-L330 PolarHBondContact O-N 2.76Å; I327-L330 VanDerWaalsContact O-N 3.11Å; L330-I336 HydrophobicContact CB-CD1 4.18Å
331	P	90.3	Very high	90.4	Very high	43 Å²	43	65.2 Å²	65.2	28%	0.279	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-57.8	159.5	172.1	-21.5	32.8	0	0	0	111.7	L297 L333 I336	L297-P331 HydrophobicContact CD1-CG 4.28Å; L297-P331 HydrophobicContact CD2-CG 4.34Å; P331-L333 PolarHBondContact O-N 2.71Å; P331-I336 HydrophobicContact CB-CG1 4.28Å; P331-I336 VanDerWaalsContact O-CD1 3.25Å; P331-I336 WeakPolarHBondContact O-CD1 3.48Å
332	P	91	Very high	90.2	Very high	93 Å²	93	68.6 Å²	68.6	60%	0.604	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-51.9	142.8	174.8	-26.7	34.1	0	0	0	112.2	K334 S335 I336	P332-K334 PolarHBondContact O-N 2.71Å; P332-S335 WeakPolarHBondContact O-CA 3.43Å; P332-S335 VanDerWaalsContact O-CB 3.32Å; P332-S335 WeakPolarHBondContact O-CB 3.28Å; P332-S335 PolarHBondContact O-N 3.07Å; P332-I336 PolarHBondContact O-N 3.45Å; P332-I336 VanDerWaalsContact O-N 3.12Å
333	L	90.2	Very high	89.9	Confident	106 Å²	106	69.7 Å²	69.7	56%	0.555	34%	0.34	S	S	*	.	H	α-helix	trans	-51.1	-35.2	-178.7	-75.7	175.4	0	0	0	113.5	Y315 P331 I336 R337	Y315-L333 HydrophobicContact CD1-CD2 3.83Å; Y315-L333 HydrophobicContact CD2-CD2 3.45Å; Y315-L333 VanDerWaalsContact CD2-CD2 3.45Å; Y315-L333 HydrophobicContact CE1-CD2 3.79Å; Y315-L333 HydrophobicContact CE2-CD2 3.4Å; Y315-L333 HydrophobicContact CG-CD2 3.66Å; P331-L333 PolarHBondContact O-N 2.71Å; L333-I336 PolarHBondContact O-N 2.94Å; L333-R337 VanDerWaalsContact O-CB 3.28Å; L333-R337 WeakPolarHBondContact O-CB 3.41Å; L333-R337 PolarHBondContact O-N 2.68Å
334	K	91	Very high	89.8	Confident	145 Å²	145	66.4 Å²	66.4	63%	0.63	32%	0.318	S	S	*	.	H	α-helix	trans	-57.6	-48.2	173.4	-174.4	176.8	179.4	178.8	0	111.3	P332 R337 E338	P332-K334 PolarHBondContact O-N 2.71Å; K334-R337 WeakPolarHBondContact O-CB 3.25Å; K334-R337 PolarHBondContact O-N 2.96Å; K334-E338 WeakPolarHBondContact O-CG 3.43Å; K334-E338 PolarHBondContact O-N 3.22Å
335	S	91.5	Very high	89.5	Confident	59 Å²	59	59 Å²	59	41%	0.413	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-39.8	178.5	-60.3	0	0	0	0	112.4	P332 E338 M339	P332-S335 WeakPolarHBondContact O-CA 3.43Å; P332-S335 VanDerWaalsContact O-CB 3.32Å; P332-S335 WeakPolarHBondContact O-CB 3.28Å; P332-S335 PolarHBondContact O-N 3.07Å; S335-E338 PolarHBondContact O-N 3.1Å; S335-M339 WeakPolarHBondContact O-CB 3.27Å; S335-M339 PolarHBondContact O-N 3.38Å
336	I	92.4	Very high	89.3	Confident	4 Å²	4	59 Å²	59	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-44.6	175.7	-64.3	176	0	0	0	110.4	L297 M300 Y315 L330 P331 P332 L333 E338 M339 I340	L297-I336 HydrophobicContact CD2-CG1 4.42Å; M300-I336 HydrophobicContact SD-CD1 4.34Å; M300-I336 HydrophobicContact SD-CG2 3.64Å; Y315-I336 HydrophobicContact CD2-CD1 3.85Å; Y315-I336 HydrophobicContact CD2-CG2 4.38Å; Y315-I336 HydrophobicContact CE2-CD1 3.67Å; L330-I336 HydrophobicContact CB-CD1 4.18Å; P331-I336 HydrophobicContact CB-CG1 4.28Å; P331-I336 VanDerWaalsContact O-CD1 3.25Å; P331-I336 WeakPolarHBondContact O-CD1 3.48Å; P332-I336 PolarHBondContact O-N 3.45Å; P332-I336 VanDerWaalsContact O-N 3.12Å; L333-I336 PolarHBondContact O-N 2.94Å; I336-E338 PolarHBondContact O-N 3.22Å; I336-M339 HydrophobicContact CG2-CE 4.38Å; I336-M339 WeakPolarHBondContact O-CB 3.26Å; I336-M339 PolarHBondContact O-N 3.36Å; I336-M339 VanDerWaalsContact O-N 3.14Å; I336-I340 HydrophobicContact CG2-CD1 3.95Å; I336-I340 HydrophobicContact CG2-CG1 4.5Å; I336-I340 WeakPolarHBondContact O-CG1 3.34Å; I336-I340 PolarHBondContact O-N 2.97Å
337	R	90.5	Very high	89.1	Confident	94 Å²	94	62.1 Å²	62.1	36%	0.355	31%	0.309	S	S	.	.	H	α-helix	trans	-58.7	-48.6	175.7	-176.5	-169.4	65	177.9	4.4	111.6	P311 L333 K334 M339 I340 Y341	P311-R337 HydrophobicContact CB-CB 4.31Å; P311-R337 HydrophobicContact CB-CG 3.91Å; P311-R337 HydrophobicContact CG-CG 4.02Å; L333-R337 VanDerWaalsContact O-CB 3.28Å; L333-R337 WeakPolarHBondContact O-CB 3.41Å; L333-R337 PolarHBondContact O-N 2.68Å; K334-R337 WeakPolarHBondContact O-CB 3.25Å; K334-R337 PolarHBondContact O-N 2.96Å; R337-M339 VanDerWaalsContact C-N 3.25Å; R337-M339 PolarHBondContact O-N 2.94Å; R337-I340 PolarHBondContact O-N 2.76Å; R337-Y341 HydrophobicContact CG-CD2 3.94Å; R337-Y341 HydrophobicContact CG-CE2 3.37Å; R337-Y341 WeakPolarHBondContact O-CD2 3.49Å; R337-Y341 PolarHBondContact O-N 2.77Å
338	E	89.9	Confident	88.6	Confident	71 Å²	71	60.1 Å²	60.1	33%	0.332	30%	0.298	S	S	.	.	H	α-helix	trans	-63.2	-30.9	175.7	-63.3	-42.8	133.3	0	0	112.9	K334 S335 I336 R342	K334-E338 WeakPolarHBondContact O-CG 3.43Å; K334-E338 PolarHBondContact O-N 3.22Å; S335-E338 PolarHBondContact O-N 3.1Å; I336-E338 PolarHBondContact O-N 3.22Å; E338-R342 WeakPolarHBondContact O-CB 3.37Å; E338-R342 WeakPolarHBondContact O-CG 3.32Å; E338-R342 PolarHBondContact O-N 2.9Å; E338-R342 VanDerWaalsContact O-N 3.12Å; E338-R342 PolarHBondContact O-NE 2.79Å
339	M	91.9	Very high	88.1	Confident	24 Å²	24	55.5 Å²	55.5	12%	0.118	28%	0.278	C	S	.	.	H	α-helix	trans	-67.2	-47.2	173.4	178.7	-172.6	72.3	0	0	110.7	L297 M300 R301 S335 I336 R337 R342 Q343	L297-M339 HydrophobicContact CD2-CE 3.92Å; L297-M339 HydrophobicContact CD2-SD 4.37Å; M300-M339 HydrophobicContact CB-CE 3.98Å; R301-M339 HydrophobicContact CG-CE 4.02Å; R301-M339 HydrophobicContact CG-CG 4.15Å; R301-M339 HydrophobicContact CG-SD 3.8Å; R301-M339 PolarHBondContact NE-SD 3.37Å; R301-M339 VanDerWaalsContact NE-SD 3.36Å; S335-M339 WeakPolarHBondContact O-CB 3.27Å; S335-M339 PolarHBondContact O-N 3.38Å; I336-M339 HydrophobicContact CG2-CE 4.38Å; I336-M339 WeakPolarHBondContact O-CB 3.26Å; I336-M339 PolarHBondContact O-N 3.36Å; I336-M339 VanDerWaalsContact O-N 3.14Å; R337-M339 VanDerWaalsContact C-N 3.25Å; R337-M339 PolarHBondContact O-N 2.94Å; M339-R342 PolarHBondContact O-N 2.87Å; M339-Q343 WeakPolarHBondContact O-CG 3.5Å; M339-Q343 PolarHBondContact O-N 2.81Å
340	I	90.9	Very high	87.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-46.8	178.6	-69.9	167.8	0	0	0	110.6	P311 I314 I336 R337 R342 Q343 R344	P311-I340 HydrophobicContact CB-CD1 3.98Å; P311-I340 HydrophobicContact CB-CG2 4.44Å; P311-I340 HydrophobicContact CG-CG2 4.17Å; I314-I340 HydrophobicContact CB-CD1 4.17Å; I314-I340 HydrophobicContact CD1-CD1 4.47Å; I314-I340 HydrophobicContact CD1-CG2 4Å; I314-I340 HydrophobicContact CG2-CD1 3.93Å; I336-I340 HydrophobicContact CG2-CD1 3.95Å; I336-I340 HydrophobicContact CG2-CG1 4.5Å; I336-I340 WeakPolarHBondContact O-CG1 3.34Å; I336-I340 PolarHBondContact O-N 2.97Å; R337-I340 PolarHBondContact O-N 2.76Å; I340-R342 PolarHBondContact O-N 3.19Å; I340-Q343 PolarHBondContact O-N 2.7Å; I340-Q343 VanDerWaalsContact O-N 3.16Å; I340-R344 WeakPolarHBondContact O-CG 3.38Å; I340-R344 PolarHBondContact O-N 2.76Å
341	Y	88.5	Confident	86.9	Confident	26 Å²	26	60.4 Å²	60.4	10%	0.102	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-43.5	176.5	-67.7	-37.1	0	0	0	112.4	P311 R337 Q343 R344 V345 S368 E371	P311-Y341 HydrophobicContact CG-CD1 4.34Å; P311-Y341 HydrophobicContact CG-CE1 3.62Å; R337-Y341 HydrophobicContact CG-CD2 3.94Å; R337-Y341 HydrophobicContact CG-CE2 3.37Å; R337-Y341 WeakPolarHBondContact O-CD2 3.49Å; R337-Y341 PolarHBondContact O-N 2.77Å; Y341-Q343 VanDerWaalsContact C-N 3.31Å; Y341-Q343 PolarHBondContact O-N 2.83Å; Y341-R344 WeakPolarHBondContact O-CB 3.35Å; Y341-R344 PolarHBondContact O-N 3.34Å; Y341-V345 WeakPolarHBondContact O-CG2 3.29Å; Y341-V345 PolarHBondContact O-N 3.34Å; Y341-S368 WeakPolarHBondContact CE1-O 3.48Å; Y341-E371 PolarHBondContact OH-OE2 3.02Å
342	R	87.4	Confident	86	Confident	163 Å²	163	67.9 Å²	67.9	62%	0.615	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-40.2	174.4	-81	180	-89.6	176.3	-11.6	112.7	E338 M339 I340 A346	E338-R342 WeakPolarHBondContact O-CB 3.37Å; E338-R342 WeakPolarHBondContact O-CG 3.32Å; E338-R342 PolarHBondContact O-N 2.9Å; E338-R342 VanDerWaalsContact O-N 3.12Å; E338-R342 PolarHBondContact O-NE 2.79Å; M339-R342 PolarHBondContact O-N 2.87Å; I340-R342 PolarHBondContact O-N 3.19Å; R342-A346 VanDerWaalsContact O-CB 3.28Å; R342-A346 WeakPolarHBondContact O-CB 3.33Å; R342-A346 PolarHBondContact O-N 3.45Å
343	Q	87.5	Confident	85.3	Confident	67 Å²	67	67.1 Å²	67.1	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-68.6	-41.3	177.4	-67.4	-56.7	-31.6	0	0	112.5	R301 M339 I340 Y341 V345 A346 H347	R301-Q343 HydrophobicContact CB-CG 3.87Å; R301-Q343 HydrophobicContact CG-CG 3.81Å; M339-Q343 WeakPolarHBondContact O-CG 3.5Å; M339-Q343 PolarHBondContact O-N 2.81Å; I340-Q343 PolarHBondContact O-N 2.7Å; I340-Q343 VanDerWaalsContact O-N 3.16Å; Y341-Q343 VanDerWaalsContact C-N 3.31Å; Y341-Q343 PolarHBondContact O-N 2.83Å; Q343-V345 PolarHBondContact O-N 2.8Å; Q343-A346 PolarHBondContact O-N 2.83Å; Q343-H347 VanDerWaalsContact O-CB 3.31Å; Q343-H347 WeakPolarHBondContact O-CB 3.48Å; Q343-H347 PolarHBondContact O-N 2.75Å
344	R	88	Confident	85	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-50.1	173.9	-80.1	177	178.1	-174.7	-6.8	112	G304 L309 I340 Y341 H347 C348 N365 S368 E371	G304-R344 WeakPolarHBondContact O-CG 3.45Å; L309-R344 PolarHBondContact O-NH2 3.07Å; I340-R344 WeakPolarHBondContact O-CG 3.38Å; I340-R344 PolarHBondContact O-N 2.76Å; Y341-R344 WeakPolarHBondContact O-CB 3.35Å; Y341-R344 PolarHBondContact O-N 3.34Å; R344-H347 PolarHBondContact O-N 2.93Å; R344-C348 PolarHBondContact O-N 2.9Å; R344-C348 PolarHBondContact O-SG 3.35Å; R344-N365 HydrophobicContact CB-CB 4.02Å; R344-N365 HydrophobicContact CG-CB 4Å; R344-S368 WeakPolarHBondContact CD-OG 3.46Å; R344-S368 PolarHBondContact NH1-OG 2.83Å; R344-E371 IonicContact CZ-OE1 3.49Å; R344-E371 IonicContact NH1-OE1 3.13Å; R344-E371 PolarHBondContact NH1-OE1 3.33Å
345	V	83.9	Confident	84.7	Confident	19 Å²	19	61 Å²	61	12%	0.115	31%	0.306	C	S	.	.	H	α-helix	trans	-63.9	-46.5	179.1	172.3	0	0	0	0	110.5	Y341 Q343 H347 C348 I349 P369 N635	Y341-V345 WeakPolarHBondContact O-CG2 3.29Å; Y341-V345 PolarHBondContact O-N 3.34Å; Q343-V345 PolarHBondContact O-N 2.8Å; V345-H347 VanDerWaalsContact C-N 3.3Å; V345-H347 PolarHBondContact O-N 3.11Å; V345-C348 PolarHBondContact O-N 3.26Å; V345-I349 HydrophobicContact CG1-CD1 3.56Å; V345-I349 HydrophobicContact CG1-CG1 4.29Å; V345-I349 WeakPolarHBondContact O-CB 3.39Å; V345-I349 VanDerWaalsContact O-CG1 3.27Å; V345-I349 WeakPolarHBondContact O-CG1 3.36Å; V345-I349 PolarHBondContact O-N 3.17Å; V345-P369 HydrophobicContact CG2-CG 3.76Å; V345-N635 HydrophobicContact CG1-CB 4.41Å; V345-N635 WeakPolarHBondContact CG1-OD1 3.47Å; V345-N635 VanDerWaalsContact CG2-OD1 3.23Å; V345-N635 WeakPolarHBondContact CG2-OD1 3.27Å
346	A	84.3	Confident	84.6	Confident	49 Å²	49	60.7 Å²	60.7	41%	0.405	30%	0.304	S	S	.	.	H	α-helix	trans	-58.2	-42.1	176.3	0	0	0	0	0	112.1	R342 Q343 I349 S350	R342-A346 VanDerWaalsContact O-CB 3.28Å; R342-A346 WeakPolarHBondContact O-CB 3.33Å; R342-A346 PolarHBondContact O-N 3.45Å; Q343-A346 PolarHBondContact O-N 2.83Å; A346-I349 PolarHBondContact O-N 2.95Å; A346-S350 VanDerWaalsContact O-CB 3.31Å; A346-S350 WeakPolarHBondContact O-CB 3.48Å; A346-S350 PolarHBondContact O-N 3.25Å; A346-S350 PolarHBondContact O-OG 3.41Å
347	H	83.6	Confident	84.4	Confident	68 Å²	68	62 Å²	62	32%	0.315	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-44.8	176.5	-176.3	72.4	0	0	0	112	A305 Q343 R344 V345 I349 S350 R351	A305-H347 HydrophobicContact CB-CB 3.82Å; A305-H347 PolarHBondContact O-CD2 3.4Å; Q343-H347 VanDerWaalsContact O-CB 3.31Å; Q343-H347 WeakPolarHBondContact O-CB 3.48Å; Q343-H347 PolarHBondContact O-N 2.75Å; R344-H347 PolarHBondContact O-N 2.93Å; V345-H347 VanDerWaalsContact C-N 3.3Å; V345-H347 PolarHBondContact O-N 3.11Å; H347-I349 PolarHBondContact O-N 2.92Å; H347-S350 WeakPolarHBondContact CA-OG 3.26Å; H347-S350 PolarHBondContact O-N 2.94Å; H347-S350 PolarHBondContact O-OG 2.97Å; H347-R351 PolarHBondContact O-N 3.43Å
348	C	80.5	Confident	84.2	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.027	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-44.2	175.6	-65.5	0	0	0	0	111.9	R344 V345 S350 R351 P363	R344-C348 PolarHBondContact O-N 2.9Å; R344-C348 PolarHBondContact O-SG 3.35Å; V345-C348 PolarHBondContact O-N 3.26Å; C348-S350 VanDerWaalsContact C-N 3.33Å; C348-R351 WeakPolarHBondContact O-CB 3.5Å; C348-R351 WeakPolarHBondContact O-CG 3.48Å; C348-R351 PolarHBondContact O-N 2.61Å; C348-P363 HydrophobicContact CB-CB 4.3Å; C348-P363 HydrophobicContact CB-CG 4.18Å; C348-P363 VanDerWaalsContact SG-CB 3.59Å
349	I	79.2	Confident	84	Confident	43 Å²	43	59.2 Å²	59.2	22%	0.221	32%	0.32	C	S	.	.	H	α-helix	trans	-68.6	-32.5	178.1	-66.1	172	0	0	0	111	V345 A346 H347 R351 N629 H632	V345-I349 HydrophobicContact CG1-CD1 3.56Å; V345-I349 HydrophobicContact CG1-CG1 4.29Å; V345-I349 WeakPolarHBondContact O-CB 3.39Å; V345-I349 VanDerWaalsContact O-CG1 3.27Å; V345-I349 WeakPolarHBondContact O-CG1 3.36Å; V345-I349 PolarHBondContact O-N 3.17Å; A346-I349 PolarHBondContact O-N 2.95Å; H347-I349 PolarHBondContact O-N 2.92Å; I349-R351 PolarHBondContact O-N 3.47Å; I349-N629 PolarHBondContact O-ND2 3.32Å; I349-H632 HydrophobicContact CD1-CB 4.21Å; I349-H632 HydrophobicContact CG1-CB 4.35Å; I349-H632 HydrophobicContact CG2-CB 4.41Å
350	S	79.4	Confident	83.8	Confident	88 Å²	88	58.3 Å²	58.3	62%	0.615	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.5	178	73.1	0	0	0	0	114.7	A346 H347 C348	A346-S350 VanDerWaalsContact O-CB 3.31Å; A346-S350 WeakPolarHBondContact O-CB 3.48Å; A346-S350 PolarHBondContact O-N 3.25Å; A346-S350 PolarHBondContact O-OG 3.41Å; H347-S350 WeakPolarHBondContact CA-OG 3.26Å; H347-S350 PolarHBondContact O-N 2.94Å; H347-S350 PolarHBondContact O-OG 2.97Å; C348-S350 VanDerWaalsContact C-N 3.33Å
351	R	72.3	Confident	83.5	Confident	102 Å²	102	61.3 Å²	61.3	39%	0.385	34%	0.337	S	S	.	.	S	Bend	trans	-61.1	151.2	177	-69.9	-175.6	174.8	-146.3	-2.7	111.2	H347 C348 I349 H353 Y631	H347-R351 PolarHBondContact O-N 3.43Å; C348-R351 WeakPolarHBondContact O-CB 3.5Å; C348-R351 WeakPolarHBondContact O-CG 3.48Å; C348-R351 PolarHBondContact O-N 2.61Å; I349-R351 PolarHBondContact O-N 3.47Å; R351-H353 PolarHBondContact O-N 3.39Å; R351-Y631 HydrophobicContact CB-CE2 4.29Å
352	K	72.9	Confident	83.2	Confident	199 Å²	199	62.6 Å²	62.6	87%	0.865	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-55.1	133.2	171.1	-69.6	-176.4	-179.8	179.4	0	109.1
353	H	76.4	Confident	82.6	Confident	77 Å²	77	55 Å²	55	36%	0.356	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-58.7	133	177	-175.1	-82.2	0	0	0	109.7	R351 S355 R628	R351-H353 PolarHBondContact O-N 3.39Å; H353-S355 PolarHBondContact O-N 2.98Å; H353-R628 PolarHBondContact CD2-O 3.46Å; H353-R628 PolarHBondContact NE2-O 2.98Å; H353-R628 VanDerWaalsContact NE2-O 3.13Å
354	P	83.1	Confident	81.9	Confident	10 Å²	10	56.4 Å²	56.4	7%	0.065	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-59.4	136.3	177	21.7	-29.8	0	0	0	110.4	A359 I360 L418 V630	P354-A359 HydrophobicContact CB-CB 4.12Å; P354-I360 HydrophobicContact CB-CG1 3.96Å; P354-I360 HydrophobicContact CG-CG1 3.83Å; P354-L418 HydrophobicContact CB-CD1 4.07Å; P354-L418 HydrophobicContact CG-CD1 3.86Å; P354-L418 WeakPolarHBondContact O-CD1 3.02Å; P354-V630 HydrophobicContact CG-CG1 3.82Å
355	S	85.4	Confident	81.6	Confident	113 Å²	113	57.1 Å²	57.1	79%	0.79	33%	0.334	S	S	*	.	S	Bend	trans	-82.9	-18.2	-179.7	51.8	0	0	0	0	113.2	H353	H353-S355 PolarHBondContact O-N 2.98Å
356	S	87.9	Confident	81.4	Confident	52 Å²	52	56.2 Å²	56.2	36%	0.364	33%	0.328	S	S	.	.	S	Bend	trans	-146.7	162.6	-178.6	67.7	0	0	0	0	111.3	A358 A359	S356-A358 VanDerWaalsContact C-N 3.3Å; S356-A358 PolarHBondContact O-N 2.79Å; S356-A359 PolarHBondContact O-N 3.18Å; S356-A359 PolarHBondContact OG-N 2.88Å
357	L	88.2	Confident	81.4	Confident	31 Å²	31	55.7 Å²	55.7	16%	0.162	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58.3	-40.1	175.9	-75	168.1	0	0	0	112.4	A359 I360 R387 L418 F419 S442	L357-A359 VanDerWaalsContact C-N 3.26Å; L357-A359 PolarHBondContact O-N 2.85Å; L357-I360 HydrophobicContact CD2-CD1 4.07Å; L357-I360 WeakPolarHBondContact O-CB 3.48Å; L357-I360 WeakPolarHBondContact O-CG1 3.43Å; L357-I360 PolarHBondContact O-N 2.84Å; L357-R387 HydrophobicContact CB-CB 4.33Å; L357-R387 PolarHBondContact O-NH1 3.27Å; L357-L418 HydrophobicContact CD2-CB 4.05Å; L357-L418 WeakPolarHBondContact CD2-O 3.44Å; L357-L418 HydrophobicContact CG-CB 4.49Å; L357-F419 HydrophobicContact CD2-CD1 4.34Å; L357-F419 HydrophobicContact CD2-CE1 3.9Å; L357-F419 HydrophobicContact CD2-CZ 4.06Å; L357-S442 VanDerWaalsContact CD1-CB 3.5Å
358	A	86.6	Confident	81.2	Confident	57 Å²	57	52.7 Å²	52.7	47%	0.471	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63.7	-29.9	178.6	0	0	0	0	0	113	S356 I360	S356-A358 VanDerWaalsContact C-N 3.3Å; S356-A358 PolarHBondContact O-N 2.79Å; A358-I360 PolarHBondContact O-N 3.48Å
359	A	86.8	Confident	81.1	Confident	51 Å²	51	54.6 Å²	54.6	42%	0.421	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-76.2	-7	-179.8	0	0	0	0	0	113.8	P354 S356 L357 S361	P354-A359 HydrophobicContact CB-CB 4.12Å; S356-A359 PolarHBondContact O-N 3.18Å; S356-A359 PolarHBondContact OG-N 2.88Å; L357-A359 VanDerWaalsContact C-N 3.26Å; L357-A359 PolarHBondContact O-N 2.85Å; A359-S361 PolarHBondContact O-N 2.72Å
360	I	87.4	Confident	81.2	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	31%	0.312	C	S	.	.			trans	-73.1	110.6	178.3	-56.9	173.7	0	0	0	109	P354 L357 A358 R387 F389 L418 F419	P354-I360 HydrophobicContact CB-CG1 3.96Å; P354-I360 HydrophobicContact CG-CG1 3.83Å; L357-I360 HydrophobicContact CD2-CD1 4.07Å; L357-I360 WeakPolarHBondContact O-CB 3.48Å; L357-I360 WeakPolarHBondContact O-CG1 3.43Å; L357-I360 PolarHBondContact O-N 2.84Å; A358-I360 PolarHBondContact O-N 3.48Å; I360-R387 PolarHBondContact O-NH1 3.18Å; I360-R387 PolarHBondContact O-NH2 2.84Å; I360-F389 HydrophobicContact CB-CE2 4.42Å; I360-F389 HydrophobicContact CB-CZ 4.08Å; I360-F389 HydrophobicContact CD1-CE2 4.03Å; I360-F389 HydrophobicContact CG2-CE2 4.04Å; I360-F389 HydrophobicContact CG2-CZ 3.68Å; I360-L418 HydrophobicContact CD1-CD1 3.96Å; I360-L418 HydrophobicContact CG1-CD1 4.18Å; I360-F419 HydrophobicContact CD1-CE2 3.71Å; I360-F419 HydrophobicContact CD1-CZ 3.56Å
361	S	84.7	Confident	80.9	Confident	64 Å²	64	54.3 Å²	54.3	45%	0.448	30%	0.303	S	S	.	.			trans	-118.4	135.9	168.6	65.6	0	0	0	0	109.7	A359 P363 Y631	A359-S361 PolarHBondContact O-N 2.72Å; S361-P363 VanDerWaalsContact O-CD 3.23Å; S361-P363 WeakPolarHBondContact O-CD 3.43Å; S361-Y631 VanDerWaalsContact O-CE1 3.29Å; S361-Y631 WeakPolarHBondContact O-CE1 3.36Å; S361-Y631 PolarHBondContact O-OH 2.75Å
362	F	82	Confident	81.3	Confident	53 Å²	53	59 Å²	59	23%	0.232	33%	0.325	C	S	.	.			trans	-69.4	115.8	171.3	-66.5	-80.4	0	0	0	110.2	I366 F367 V377 F389 F391 I634	F362-I366 HydrophobicContact CB-CG2 4.44Å; F362-I366 HydrophobicContact CD1-CG2 4.43Å; F362-F367 HydrophobicContact CB-CE2 4.33Å; F362-F367 AromaticContact CD1-CE2 3.91Å; F362-F367 HydrophobicContact CD1-CE2 3.91Å; F362-F367 AromaticContact CD1-CZ 3.59Å; F362-F367 HydrophobicContact CD1-CZ 3.59Å; F362-F367 AromaticContact CE1-CZ 3.93Å; F362-F367 HydrophobicContact CE1-CZ 3.93Å; F362-F367 HydrophobicContact CG-CE2 4.26Å; F362-F367 HydrophobicContact CG-CZ 4.36Å; F362-V377 HydrophobicContact CE1-CG1 4.21Å; F362-V377 HydrophobicContact CE2-CG1 3.84Å; F362-V377 HydrophobicContact CZ-CG1 3.52Å; F362-F389 AromaticContact CE2-CD1 3.56Å; F362-F389 HydrophobicContact CE2-CD1 3.56Å; F362-F389 AromaticContact CE2-CE1 3.39Å; F362-F389 HydrophobicContact CE2-CE1 3.39Å; F362-F389 HydrophobicContact CE2-CZ 4.41Å; F362-F389 AromaticContact CZ-CD1 3.38Å; F362-F389 HydrophobicContact CZ-CD1 3.38Å; F362-F389 AromaticContact CZ-CE1 3.58Å; F362-F389 HydrophobicContact CZ-CE1 3.58Å; F362-F389 HydrophobicContact CZ-CG 4.12Å; F362-F389 HydrophobicContact CZ-CZ 4.47Å; F362-F391 AromaticContact CE1-CE1 3.81Å; F362-F391 HydrophobicContact CE1-CE1 3.81Å; F362-F391 AromaticContact CE1-CZ 3.84Å; F362-F391 HydrophobicContact CE1-CZ 3.84Å; F362-F391 HydrophobicContact CZ-CE1 4.12Å; F362-F391 AromaticContact CZ-CZ 3.93Å; F362-F391 HydrophobicContact CZ-CZ 3.93Å; F362-I634 HydrophobicContact CD1-CD1 4.2Å; F362-I634 HydrophobicContact CD1-CG2 4.29Å; F362-I634 HydrophobicContact CE1-CD1 3.66Å; F362-I634 HydrophobicContact CE1-CG1 4.29Å; F362-I634 HydrophobicContact CE1-CG2 4Å; F362-I634 HydrophobicContact CZ-CD1 4.5Å
363	P	75.6	Confident	81.8	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.019	31%	0.309	C	S	.	.			trans	-62.1	142.1	174	-19.5	32.8	0	0	0	109.7	C348 S361 N365 I366 Y631	C348-P363 HydrophobicContact CB-CB 4.3Å; C348-P363 HydrophobicContact CB-CG 4.18Å; C348-P363 VanDerWaalsContact SG-CB 3.59Å; S361-P363 VanDerWaalsContact O-CD 3.23Å; S361-P363 WeakPolarHBondContact O-CD 3.43Å; P363-N365 PolarHBondContact O-N 3.13Å; P363-I366 VanDerWaalsContact O-CG2 3.23Å; P363-I366 WeakPolarHBondContact O-CG2 3.11Å; P363-I366 PolarHBondContact O-N 3.08Å; P363-Y631 HydrophobicContact CG-CD1 4.12Å; P363-Y631 HydrophobicContact CG-CE1 3.97Å
364	P	71.1	Confident	82.3	Confident	97 Å²	97	54.3 Å²	54.3	63%	0.63	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.3	-173.7	21.8	-33.7	0	0	0	113.5	T308	T308-P364 HydrophobicContact CG2-CB 3.87Å; T308-P364 HydrophobicContact CG2-CG 3.72Å
365	N	81.6	Confident	82.7	Confident	15 Å²	15	54.2 Å²	54.2	8%	0.08	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-0.7	-176.5	-75	-29.5	0	0	0	114.6	T307 R344 P363 F367 S368	T307-N365 PolarHBondContact O-ND2 3.32Å; R344-N365 HydrophobicContact CB-CB 4.02Å; R344-N365 HydrophobicContact CG-CB 4Å; P363-N365 PolarHBondContact O-N 3.13Å; N365-F367 VanDerWaalsContact C-N 3.28Å; N365-F367 PolarHBondContact O-N 3.15Å; N365-S368 VanDerWaalsContact O-CB 3.25Å; N365-S368 WeakPolarHBondContact O-CB 3.37Å; N365-S368 PolarHBondContact O-N 3.26Å; N365-S368 PolarHBondContact O-OG 3.45Å
366	I	81.5	Confident	83	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-34.6	-174.2	-164	166.1	0	0	0	112.3	F362 P363 W370 Y631 I634	F362-I366 HydrophobicContact CB-CG2 4.44Å; F362-I366 HydrophobicContact CD1-CG2 4.43Å; P363-I366 VanDerWaalsContact O-CG2 3.23Å; P363-I366 WeakPolarHBondContact O-CG2 3.11Å; P363-I366 PolarHBondContact O-N 3.08Å; I366-W370 WeakPolarHBondContact O-CZ3 3.3Å; I366-Y631 HydrophobicContact CD1-CD1 3.78Å; I366-Y631 HydrophobicContact CD1-CG 4.32Å; I366-I634 HydrophobicContact CD1-CB 3.99Å; I366-I634 HydrophobicContact CD1-CG2 3.67Å; I366-I634 HydrophobicContact CG1-CG2 4.3Å
367	F	83.7	Confident	83.2	Confident	38 Å²	38	51.4 Å²	51.4	17%	0.167	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	5.1	176.6	-52.1	-61.5	0	0	0	113.3	F362 N365 P369 W370 E371 P374 P375 V377 F391 I634 S638	F362-F367 HydrophobicContact CB-CE2 4.33Å; F362-F367 AromaticContact CD1-CE2 3.91Å; F362-F367 HydrophobicContact CD1-CE2 3.91Å; F362-F367 AromaticContact CD1-CZ 3.59Å; F362-F367 HydrophobicContact CD1-CZ 3.59Å; F362-F367 AromaticContact CE1-CZ 3.93Å; F362-F367 HydrophobicContact CE1-CZ 3.93Å; F362-F367 HydrophobicContact CG-CE2 4.26Å; F362-F367 HydrophobicContact CG-CZ 4.36Å; N365-F367 VanDerWaalsContact C-N 3.28Å; N365-F367 PolarHBondContact O-N 3.15Å; F367-P369 VanDerWaalsContact C-N 3.34Å; F367-W370 HydrophobicContact CB-CE3 4.33Å; F367-W370 HydrophobicContact CD1-CE3 4.38Å; F367-W370 HydrophobicContact CD1-CZ3 4.41Å; F367-W370 CarbonylContact O-C 3.6Å; F367-W370 WeakPolarHBondContact O-CA 3.48Å; F367-W370 PolarHBondContact O-N 3.47Å; F367-E371 PolarHBondContact O-N 2.92Å; F367-P374 HydrophobicContact CB-CB 4.19Å; F367-P375 HydrophobicContact CD1-CG 3.63Å; F367-P375 HydrophobicContact CE1-CG 3.68Å; F367-P375 HydrophobicContact CG-CG 4.42Å; F367-P375 HydrophobicContact CZ-CG 4.49Å; F367-V377 HydrophobicContact CE1-CG2 4.39Å; F367-V377 HydrophobicContact CE2-CG2 4.29Å; F367-V377 HydrophobicContact CZ-CG2 3.79Å; F367-F391 HydrophobicContact CZ-CE1 4.37Å; F367-I634 HydrophobicContact CE1-CG2 3.8Å; F367-I634 HydrophobicContact CZ-CG2 4.07Å; F367-S638 VanDerWaalsContact CE1-OG 3.29Å; F367-S638 WeakPolarHBondContact CE1-OG 3.49Å
368	S	78.4	Confident	83.5	Confident	5 Å²	5	53.6 Å²	53.6	4%	0.035	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-59.5	-31.6	-173.5	66.5	0	0	0	0	116.3	Y341 R344 N365 W370 E371	Y341-S368 WeakPolarHBondContact CE1-O 3.48Å; R344-S368 WeakPolarHBondContact CD-OG 3.46Å; R344-S368 PolarHBondContact NH1-OG 2.83Å; N365-S368 VanDerWaalsContact O-CB 3.25Å; N365-S368 WeakPolarHBondContact O-CB 3.37Å; N365-S368 PolarHBondContact O-N 3.26Å; N365-S368 PolarHBondContact O-OG 3.45Å; S368-W370 PolarHBondContact O-N 3.37Å; S368-W370 VanDerWaalsContact O-N 3.11Å; S368-E371 WeakPolarHBondContact CB-OE1 3.43Å; S368-E371 VanDerWaalsContact O-CG 3.28Å; S368-E371 WeakPolarHBondContact O-CG 2.98Å; S368-E371 PolarHBondContact O-N 3.45Å
369	P	78.3	Confident	83.9	Confident	43 Å²	43	53.5 Å²	53.5	28%	0.279	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-59.3	-21.7	172.5	-21	33.1	0	0	0	113.3	V345 F367	V345-P369 HydrophobicContact CG2-CG 3.76Å; F367-P369 VanDerWaalsContact C-N 3.34Å
370	W	81.4	Confident	84.1	Confident	35 Å²	35	52.4 Å²	52.4	13%	0.133	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-115.5	26.6	-178.5	-44.4	-73.7	0	0	0	112.2	I366 F367 S368 K372 Q373 P374 N635 S638 G639 C642	I366-W370 WeakPolarHBondContact O-CZ3 3.3Å; F367-W370 HydrophobicContact CB-CE3 4.33Å; F367-W370 HydrophobicContact CD1-CE3 4.38Å; F367-W370 HydrophobicContact CD1-CZ3 4.41Å; F367-W370 CarbonylContact O-C 3.6Å; F367-W370 WeakPolarHBondContact O-CA 3.48Å; F367-W370 PolarHBondContact O-N 3.47Å; S368-W370 PolarHBondContact O-N 3.37Å; S368-W370 VanDerWaalsContact O-N 3.11Å; W370-K372 PolarHBondContact O-N 3.26Å; W370-Q373 CarbonylContact O-C 3.53Å; W370-Q373 PolarHBondContact O-N 3.39Å; W370-P374 WeakPolarHBondContact O-CA 3.43Å; W370-P374 WeakPolarHBondContact O-CD 3.28Å; W370-N635 WeakPolarHBondContact CH2-O 3.29Å; W370-N635 VanDerWaalsContact CH2-OD1 3.28Å; W370-N635 WeakPolarHBondContact CH2-OD1 3.23Å; W370-S638 VanDerWaalsContact CZ3-CB 3.46Å; W370-G639 VanDerWaalsContact CE2-CA 3.44Å; W370-G639 VanDerWaalsContact CZ2-N 3.34Å; W370-C642 HydrophobicContact CB-CB 3.87Å; W370-C642 HydrophobicContact CD2-CB 4.28Å; W370-C642 HydrophobicContact CG-CB 3.52Å
371	E	74.2	Confident	84.1	Confident	91 Å²	91	53.2 Å²	53.2	43%	0.425	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.4	-33.2	-179.6	-95.7	159.9	-163.7	0	0	114.7	Y341 R344 F367 S368	Y341-E371 PolarHBondContact OH-OE2 3.02Å; R344-E371 IonicContact CZ-OE1 3.49Å; R344-E371 IonicContact NH1-OE1 3.13Å; R344-E371 PolarHBondContact NH1-OE1 3.33Å; F367-E371 PolarHBondContact O-N 2.92Å; S368-E371 WeakPolarHBondContact CB-OE1 3.43Å; S368-E371 VanDerWaalsContact O-CG 3.28Å; S368-E371 WeakPolarHBondContact O-CG 2.98Å; S368-E371 PolarHBondContact O-N 3.45Å
372	K	79.6	Confident	84	Confident	199 Å²	199	56.6 Å²	56.6	87%	0.865	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-34.4	-179.1	-66.9	-173.5	173.5	-168.7	0	114	W370	W370-K372 PolarHBondContact O-N 3.26Å
373	Q	84	Confident	83.9	Confident	111 Å²	111	62.8 Å²	62.8	52%	0.519	32%	0.316	S	S	.	.	S	Bend	trans	-149.1	72.7	-176.5	-75.6	179.3	-32.7	0	0	107.9	W370 C642	W370-Q373 CarbonylContact O-C 3.53Å; W370-Q373 PolarHBondContact O-N 3.39Å; Q373-C642 PolarHBondContact O-SG 3.12Å
374	P	87	Confident	84.1	Confident	67 Å²	67	65 Å²	65	44%	0.435	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-67.6	159.3	177	30	-35.1	0	0	0	110.1	F367 W370	F367-P374 HydrophobicContact CB-CB 4.19Å; W370-P374 WeakPolarHBondContact O-CA 3.43Å; W370-P374 WeakPolarHBondContact O-CD 3.28Å
375	P	91.6	Very high	84.6	Confident	9 Å²	9	63.2 Å²	63.2	6%	0.058	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-67.1	145.8	171.7	32.1	-33.7	0	0	0	109.6	F367 V377 L641 C642	F367-P375 HydrophobicContact CD1-CG 3.63Å; F367-P375 HydrophobicContact CE1-CG 3.68Å; F367-P375 HydrophobicContact CG-CG 4.42Å; F367-P375 HydrophobicContact CZ-CG 4.49Å; P375-V377 HydrophobicContact CG-CG2 4.37Å; P375-L641 HydrophobicContact CB-CD1 4.46Å; P375-C642 WeakPolarHBondContact CD-SG 3.28Å
376	I	91.9	Very high	84.9	Confident	61 Å²	61	68.1 Å²	68.1	31%	0.313	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.3	165.3	-59.5	170.1	0	0	0	106.9	F391 Y392 N394	I376-F391 WeakPolarHBondContact O-CA 3.44Å; I376-Y392 HydrophobicContact CB-CD2 4.07Å; I376-Y392 HydrophobicContact CB-CE1 4.47Å; I376-Y392 HydrophobicContact CB-CE2 3.81Å; I376-Y392 HydrophobicContact CD1-CD2 4.2Å; I376-Y392 HydrophobicContact CD1-CE2 3.82Å; I376-Y392 HydrophobicContact CG1-CE2 4.42Å; I376-Y392 HydrophobicContact CG2-CD2 4.4Å; I376-Y392 HydrophobicContact CG2-CE1 4.03Å; I376-Y392 HydrophobicContact CG2-CE2 3.67Å; I376-Y392 VanDerWaalsContact CG2-CZ 3.47Å; I376-Y392 WeakPolarHBondContact CG2-OH 3.39Å; I376-Y392 PolarHBondContact N-O 3.44Å; I376-Y392 PolarHBondContact O-N 3.42Å; I376-N394 VanDerWaalsContact CD1-OD1 3.24Å; I376-N394 WeakPolarHBondContact CD1-OD1 3.23Å
377	V	92.5	Very high	85.4	Confident	44 Å²	44	68.6 Å²	68.6	27%	0.267	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	111.8	-178	-172	0	0	0	0	109.1	F362 F367 P375 F389 V390 F391	F362-V377 HydrophobicContact CE1-CG1 4.21Å; F362-V377 HydrophobicContact CE2-CG1 3.84Å; F362-V377 HydrophobicContact CZ-CG1 3.52Å; F367-V377 HydrophobicContact CE1-CG2 4.39Å; F367-V377 HydrophobicContact CE2-CG2 4.29Å; F367-V377 HydrophobicContact CZ-CG2 3.79Å; P375-V377 HydrophobicContact CG-CG2 4.37Å; V377-F389 HydrophobicContact CG1-CD1 4.49Å; V377-V390 CarbonylContact C-O 3.09Å; V377-V390 WeakPolarHBondContact CA-O 3.28Å; V377-F391 HydrophobicContact CB-CD1 4.39Å; V377-F391 HydrophobicContact CB-CE1 4.36Å; V377-F391 HydrophobicContact CG1-CD1 4.08Å; V377-F391 HydrophobicContact CG1-CE1 3.7Å; V377-F391 HydrophobicContact CG1-CZ 4.1Å; V377-F391 HydrophobicContact CG2-CD1 3.61Å; V377-F391 HydrophobicContact CG2-CE1 3.72Å
378	Y	94.4	Very high	85.9	Confident	78 Å²	78	66.8 Å²	66.8	31%	0.306	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	136.8	163.8	178.3	-94.5	0	0	0	109.2	M388 F389 V390 E451 V455	Y378-M388 HydrophobicContact CE1-CG 4.43Å; Y378-F389 CarbonylContact O-C 3.17Å; Y378-F389 VanDerWaalsContact O-CA 3.27Å; Y378-F389 WeakPolarHBondContact O-CA 3.32Å; Y378-V390 HydrophobicContact CD1-CG2 4.06Å; Y378-V390 PolarHBondContact N-O 2.83Å; Y378-V390 PolarHBondContact O-N 2.86Å; Y378-E451 PolarHBondContact OH-OE1 2.94Å; Y378-V455 HydrophobicContact CD1-CB 4.43Å; Y378-V455 HydrophobicContact CD1-CG1 4.03Å; Y378-V455 HydrophobicContact CD1-CG2 3.53Å; Y378-V455 HydrophobicContact CD2-CG1 3.82Å; Y378-V455 HydrophobicContact CD2-CG2 3.87Å; Y378-V455 HydrophobicContact CE1-CG2 3.37Å; Y378-V455 HydrophobicContact CE2-CG1 4.49Å; Y378-V455 HydrophobicContact CE2-CG2 3.75Å; Y378-V455 HydrophobicContact CG-CB 4.34Å; Y378-V455 HydrophobicContact CG-CG1 3.55Å; Y378-V455 HydrophobicContact CG-CG2 3.77Å; Y378-V455 VanDerWaalsContact CZ-CG2 3.49Å
379	D	93.9	Very high	86.7	Confident	55 Å²	55	66.6 Å²	66.6	29%	0.294	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	114.9	176.3	178.2	-1.4	0	0	0	107.1	G381 R387 F389	D379-G381 PolarHBondContact O-N 3.01Å; D379-G381 VanDerWaalsContact O-N 3.11Å; D379-G381 WeakPolarHBondContact OD1-CA 3.18Å; D379-G381 PolarHBondContact OD1-N 3.03Å; D379-R387 IonicContact OD1-CZ 3.65Å; D379-R387 IonicContact OD1-NE 3.81Å; D379-R387 PolarHBondContact OD1-NE 2.94Å; D379-R387 IonicContact OD1-NH2 3.47Å; D379-R387 PolarHBondContact OD1-NH2 3.3Å; D379-R387 IonicContact OD2-CZ 2.78Å; D379-R387 IonicContact OD2-NE 3.19Å; D379-R387 IonicContact OD2-NH2 2.92Å; D379-R387 PolarHBondContact OD2-NH2 3.44Å; D379-F389 HydrophobicContact CB-CD1 3.97Å; D379-F389 HydrophobicContact CB-CE1 3.99Å; D379-F389 VanDerWaalsContact CG-CE1 3.42Å; D379-F389 WeakPolarHBondContact OD2-CE1 3.41Å
380	S	92.6	Very high	87.6	Confident	28 Å²	28	64.5 Å²	64.5	20%	0.196	32%	0.323	C	S	.	.			trans	-66.4	-11.3	-179.7	64.4	0	0	0	0	112.9	D384 R387 M388 E451	S380-D384 WeakPolarHBondContact CB-OD2 3.49Å; S380-D384 PolarHBondContact OG-OD2 3.4Å; S380-R387 VanDerWaalsContact OG-CA 3.29Å; S380-R387 WeakPolarHBondContact OG-CA 3.37Å; S380-M388 PolarHBondContact N-O 3.32Å; S380-M388 PolarHBondContact OG-N 3.24Å; S380-E451 WeakPolarHBondContact CB-OE1 3.41Å
381	G	87.6	Confident	88.3	Confident	21 Å²	21	62.9 Å²	62.9	22%	0.216	32%	0.317	C	S	.	.			trans	112.3	156.2	165	0	0	0	0	0	114.1	D379 K383 D384 R387	D379-G381 PolarHBondContact O-N 3.01Å; D379-G381 VanDerWaalsContact O-N 3.11Å; D379-G381 WeakPolarHBondContact OD1-CA 3.18Å; D379-G381 PolarHBondContact OD1-N 3.03Å; G381-K383 PolarHBondContact O-N 3.03Å; G381-D384 WeakPolarHBondContact O-CB 3.36Å; G381-D384 PolarHBondContact O-N 2.9Å; G381-D384 VanDerWaalsContact O-N 3.13Å; G381-R387 WeakPolarHBondContact O-CD 3.23Å; G381-R387 WeakPolarHBondContact O-CG 3.37Å
382	F	82	Confident	89.4	Confident	135 Å²	135	59.6 Å²	59.6	59%	0.592	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.2	-174.6	69.2	-88.2	0	0	0	114.9
383	K	79.7	Confident	90.1	Very high	182 Å²	182	50.6 Å²	50.6	79%	0.791	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-11.7	176.8	-62.4	-169.7	-179.8	179.6	0	113	G381 G385	G381-K383 PolarHBondContact O-N 3.03Å; K383-G385 PolarHBondContact O-N 2.99Å
384	D	79.6	Confident	90.6	Very high	49 Å²	49	51 Å²	51	26%	0.262	27%	0.268	S	S	.	.			trans	-75.8	117	-179.9	-177.7	11.8	0	0	0	109.9	S380 G381 R386 R387	S380-D384 WeakPolarHBondContact CB-OD2 3.49Å; S380-D384 PolarHBondContact OG-OD2 3.4Å; G381-D384 WeakPolarHBondContact O-CB 3.36Å; G381-D384 PolarHBondContact O-N 2.9Å; G381-D384 VanDerWaalsContact O-N 3.13Å; D384-R386 PolarHBondContact O-N 3.35Å; D384-R386 WeakPolarHBondContact OD1-CA 3.35Å; D384-R386 PolarHBondContact OD1-N 3.13Å; D384-R387 HydrophobicContact CB-CB 4.33Å; D384-R387 WeakPolarHBondContact O-CB 3.46Å; D384-R387 PolarHBondContact O-N 3.38Å; D384-R387 VanDerWaalsContact O-N 3.13Å; D384-R387 WeakPolarHBondContact OD2-CA 3.21Å; D384-R387 PolarHBondContact OD2-N 3.47Å
385	G	81.7	Confident	90.9	Very high	60 Å²	60	49.5 Å²	49.5	62%	0.619	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.2	172.7	0	0	0	0	0	112.6	K383	K383-G385 PolarHBondContact O-N 2.99Å
386	R	87.7	Confident	91.1	Very high	119 Å²	119	49.1 Å²	49.1	45%	0.449	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	28.4	176.1	-50.9	-166.2	-179.8	172	1.9	113.2	D384 M388 S442 D448	D384-R386 PolarHBondContact O-N 3.35Å; D384-R386 WeakPolarHBondContact OD1-CA 3.35Å; D384-R386 PolarHBondContact OD1-N 3.13Å; R386-M388 PolarHBondContact O-N 2.92Å; R386-S442 WeakPolarHBondContact CA-OG 3.5Å; R386-S442 PolarHBondContact O-OG 3.49Å; R386-S442 VanDerWaalsContact O-OG 3.05Å; R386-D448 VanDerWaalsContact CD-OD1 3.31Å; R386-D448 WeakPolarHBondContact CD-OD1 3.4Å; R386-D448 IonicContact NH1-OD1 3.87Å
387	R	93.1	Very high	91.3	Very high	10 Å²	10	46.8 Å²	46.8	4%	0.038	24%	0.242	C	C	.	.			trans	-42.3	125.6	-175.6	-169.3	177.1	-175.8	-164.4	0.8	112	L357 I360 D379 S380 G381 D384 F389 S442	L357-R387 HydrophobicContact CB-CB 4.33Å; L357-R387 PolarHBondContact O-NH1 3.27Å; I360-R387 PolarHBondContact O-NH1 3.18Å; I360-R387 PolarHBondContact O-NH2 2.84Å; D379-R387 IonicContact OD1-CZ 3.65Å; D379-R387 IonicContact OD1-NE 3.81Å; D379-R387 PolarHBondContact OD1-NE 2.94Å; D379-R387 IonicContact OD1-NH2 3.47Å; D379-R387 PolarHBondContact OD1-NH2 3.3Å; D379-R387 IonicContact OD2-CZ 2.78Å; D379-R387 IonicContact OD2-NE 3.19Å; D379-R387 IonicContact OD2-NH2 2.92Å; D379-R387 PolarHBondContact OD2-NH2 3.44Å; S380-R387 VanDerWaalsContact OG-CA 3.29Å; S380-R387 WeakPolarHBondContact OG-CA 3.37Å; G381-R387 WeakPolarHBondContact O-CD 3.23Å; G381-R387 WeakPolarHBondContact O-CG 3.37Å; D384-R387 HydrophobicContact CB-CB 4.33Å; D384-R387 WeakPolarHBondContact O-CB 3.46Å; D384-R387 PolarHBondContact O-N 3.38Å; D384-R387 VanDerWaalsContact O-N 3.13Å; D384-R387 WeakPolarHBondContact OD2-CA 3.21Å; D384-R387 PolarHBondContact OD2-N 3.47Å; R387-F389 HydrophobicContact CG-CE2 4.29Å; R387-F389 HydrophobicContact CG-CZ 4.26Å; R387-F389 VanDerWaalsContact NE-CZ 3.29Å; R387-S442 PolarHBondContact O-OG 3.13Å
388	M	93.9	Very high	91.4	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.253	C	S	.	.			trans	-124.5	155.5	177	70.6	175.2	75.1	0	0	111.3	Y378 S380 R386 V390 L440 L441 D448 E451	Y378-M388 HydrophobicContact CE1-CG 4.43Å; S380-M388 PolarHBondContact N-O 3.32Å; S380-M388 PolarHBondContact OG-N 3.24Å; R386-M388 PolarHBondContact O-N 2.92Å; M388-V390 HydrophobicContact SD-CG2 4.44Å; M388-L440 WeakPolarHBondContact CA-O 3.45Å; M388-L441 HydrophobicContact CB-CD2 3.94Å; M388-L441 HydrophobicContact CE-CD2 4.46Å; M388-L441 HydrophobicContact SD-CD2 4.08Å; M388-D448 HydrophobicContact CE-CB 4.24Å; M388-E451 HydrophobicContact CE-CB 3.88Å; M388-E451 HydrophobicContact CE-CG 3.89Å; M388-E451 WeakPolarHBondContact CE-OE2 3.21Å; M388-E451 HydrophobicContact SD-CB 4.37Å; M388-E451 HydrophobicContact SD-CG 4.08Å
389	F	94.8	Very high	91.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127	174	-59.9	-82.8	0	0	0	110.1	I360 F362 V377 Y378 D379 R387 F391 F419 A439 L440	I360-F389 HydrophobicContact CB-CE2 4.42Å; I360-F389 HydrophobicContact CB-CZ 4.08Å; I360-F389 HydrophobicContact CD1-CE2 4.03Å; I360-F389 HydrophobicContact CG2-CE2 4.04Å; I360-F389 HydrophobicContact CG2-CZ 3.68Å; F362-F389 AromaticContact CE2-CD1 3.56Å; F362-F389 HydrophobicContact CE2-CD1 3.56Å; F362-F389 AromaticContact CE2-CE1 3.39Å; F362-F389 HydrophobicContact CE2-CE1 3.39Å; F362-F389 HydrophobicContact CE2-CZ 4.41Å; F362-F389 AromaticContact CZ-CD1 3.38Å; F362-F389 HydrophobicContact CZ-CD1 3.38Å; F362-F389 AromaticContact CZ-CE1 3.58Å; F362-F389 HydrophobicContact CZ-CE1 3.58Å; F362-F389 HydrophobicContact CZ-CG 4.12Å; F362-F389 HydrophobicContact CZ-CZ 4.47Å; V377-F389 HydrophobicContact CG1-CD1 4.49Å; Y378-F389 CarbonylContact O-C 3.17Å; Y378-F389 VanDerWaalsContact O-CA 3.27Å; Y378-F389 WeakPolarHBondContact O-CA 3.32Å; D379-F389 HydrophobicContact CB-CD1 3.97Å; D379-F389 HydrophobicContact CB-CE1 3.99Å; D379-F389 VanDerWaalsContact CG-CE1 3.42Å; D379-F389 WeakPolarHBondContact OD2-CE1 3.41Å; R387-F389 HydrophobicContact CG-CE2 4.29Å; R387-F389 HydrophobicContact CG-CZ 4.26Å; R387-F389 VanDerWaalsContact NE-CZ 3.29Å; F389-F391 HydrophobicContact CB-CD2 4.41Å; F389-F391 HydrophobicContact CB-CE2 3.49Å; F389-F391 VanDerWaalsContact CB-CE2 3.49Å; F389-F391 HydrophobicContact CB-CZ 3.8Å; F389-F419 AromaticContact CD2-CE1 3.81Å; F389-F419 HydrophobicContact CD2-CE1 3.81Å; F389-F419 AromaticContact CD2-CZ 3.63Å; F389-F419 HydrophobicContact CD2-CZ 3.63Å; F389-F419 HydrophobicContact CE2-CE1 4.05Å; F389-F419 AromaticContact CE2-CZ 3.62Å; F389-F419 HydrophobicContact CE2-CZ 3.62Å; F389-A439 CarbonylContact O-C 3.58Å; F389-A439 WeakPolarHBondContact O-CA 3.45Å; F389-L440 HydrophobicContact CB-CB 4.35Å; F389-L440 HydrophobicContact CD2-CB 4.48Å; F389-L440 PolarHBondContact N-O 3.33Å; F389-L440 VanDerWaalsContact N-O 3.1Å; F389-L440 PolarHBondContact O-N 3.1Å
390	V	96.5	Very high	91.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.8	177.4	-167.8	0	0	0	0	109.2	V377 Y378 M388 Y392 V437 Y438 A439 L452 V455 L456	V377-V390 CarbonylContact C-O 3.09Å; V377-V390 WeakPolarHBondContact CA-O 3.28Å; Y378-V390 HydrophobicContact CD1-CG2 4.06Å; Y378-V390 PolarHBondContact N-O 2.83Å; Y378-V390 PolarHBondContact O-N 2.86Å; M388-V390 HydrophobicContact SD-CG2 4.44Å; V390-Y392 HydrophobicContact CG1-CD1 4.1Å; V390-V437 HydrophobicContact CG1-CG1 3.5Å; V390-V437 VanDerWaalsContact CG1-CG1 3.5Å; V390-Y438 CarbonylContact C-O 3.46Å; V390-Y438 WeakPolarHBondContact CA-O 3.47Å; V390-A439 HydrophobicContact CG1-CB 4.48Å; V390-A439 HydrophobicContact CG2-CB 4.29Å; V390-L452 HydrophobicContact CB-CD1 4.12Å; V390-L452 HydrophobicContact CG1-CD1 3.39Å; V390-L452 HydrophobicContact CG2-CD1 3.54Å; V390-V455 HydrophobicContact CB-CG1 4.39Å; V390-V455 HydrophobicContact CG2-CG1 4.44Å; V390-L456 HydrophobicContact CG1-CD2 4.5Å
391	F	96.4	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.9	-177.1	-56.4	-97.6	0	0	0	109.3	F362 F367 I376 V377 F389 V437 Y438 L440 I634 I637 L641	F362-F391 AromaticContact CE1-CE1 3.81Å; F362-F391 HydrophobicContact CE1-CE1 3.81Å; F362-F391 AromaticContact CE1-CZ 3.84Å; F362-F391 HydrophobicContact CE1-CZ 3.84Å; F362-F391 HydrophobicContact CZ-CE1 4.12Å; F362-F391 AromaticContact CZ-CZ 3.93Å; F362-F391 HydrophobicContact CZ-CZ 3.93Å; F367-F391 HydrophobicContact CZ-CE1 4.37Å; I376-F391 WeakPolarHBondContact O-CA 3.44Å; V377-F391 HydrophobicContact CB-CD1 4.39Å; V377-F391 HydrophobicContact CB-CE1 4.36Å; V377-F391 HydrophobicContact CG1-CD1 4.08Å; V377-F391 HydrophobicContact CG1-CE1 3.7Å; V377-F391 HydrophobicContact CG1-CZ 4.1Å; V377-F391 HydrophobicContact CG2-CD1 3.61Å; V377-F391 HydrophobicContact CG2-CE1 3.72Å; F389-F391 HydrophobicContact CB-CD2 4.41Å; F389-F391 HydrophobicContact CB-CE2 3.49Å; F389-F391 VanDerWaalsContact CB-CE2 3.49Å; F389-F391 HydrophobicContact CB-CZ 3.8Å; F391-V437 WeakPolarHBondContact O-CA 3.45Å; F391-Y438 PolarHBondContact N-O 2.84Å; F391-Y438 PolarHBondContact O-N 2.9Å; F391-L440 HydrophobicContact CE2-CD1 4.02Å; F391-L440 HydrophobicContact CE2-CG 4.22Å; F391-L440 HydrophobicContact CZ-CD1 4.46Å; F391-I634 HydrophobicContact CE1-CG1 4.42Å; F391-I634 HydrophobicContact CE1-CG2 3.92Å; F391-I634 HydrophobicContact CZ-CG1 3.89Å; F391-I634 HydrophobicContact CZ-CG2 4.25Å; F391-I637 HydrophobicContact CB-CD1 4.45Å; F391-I637 HydrophobicContact CD1-CD1 4.26Å; F391-I637 HydrophobicContact CD2-CD1 3.46Å; F391-I637 VanDerWaalsContact CD2-CD1 3.46Å; F391-I637 HydrophobicContact CE1-CD1 4.44Å; F391-I637 HydrophobicContact CE2-CD1 3.66Å; F391-I637 HydrophobicContact CG-CD1 3.8Å; F391-I637 HydrophobicContact CG-CG1 4.46Å; F391-I637 HydrophobicContact CZ-CD1 4.17Å; F391-L641 HydrophobicContact CB-CD1 3.58Å; F391-L641 WeakPolarHBondContact O-CD1 3.25Å
392	Y	96.4	Very high	92.3	Very high	22 Å²	22	51.9 Å²	51.9	9%	0.086	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	176.5	176.8	58.5	-86.2	0	0	0	110.5	I376 V390 L397 V455 L456 A459	I376-Y392 HydrophobicContact CB-CD2 4.07Å; I376-Y392 HydrophobicContact CB-CE1 4.47Å; I376-Y392 HydrophobicContact CB-CE2 3.81Å; I376-Y392 HydrophobicContact CD1-CD2 4.2Å; I376-Y392 HydrophobicContact CD1-CE2 3.82Å; I376-Y392 HydrophobicContact CG1-CE2 4.42Å; I376-Y392 HydrophobicContact CG2-CD2 4.4Å; I376-Y392 HydrophobicContact CG2-CE1 4.03Å; I376-Y392 HydrophobicContact CG2-CE2 3.67Å; I376-Y392 VanDerWaalsContact CG2-CZ 3.47Å; I376-Y392 WeakPolarHBondContact CG2-OH 3.39Å; I376-Y392 PolarHBondContact N-O 3.44Å; I376-Y392 PolarHBondContact O-N 3.42Å; V390-Y392 HydrophobicContact CG1-CD1 4.1Å; Y392-L397 HydrophobicContact CD2-CD1 3.95Å; Y392-L397 HydrophobicContact CD2-CD2 4.08Å; Y392-L397 HydrophobicContact CD2-CG 3.91Å; Y392-L397 HydrophobicContact CE2-CD1 3.8Å; Y392-L397 HydrophobicContact CE2-CD2 4.39Å; Y392-L397 HydrophobicContact CE2-CG 4.26Å; Y392-V455 HydrophobicContact CE1-CG1 4.32Å; Y392-L456 HydrophobicContact CD1-CD2 4.13Å; Y392-L456 HydrophobicContact CE1-CD2 4.47Å; Y392-L456 HydrophobicContact CG-CD2 4.35Å; Y392-A459 HydrophobicContact CE2-CB 4.01Å; Y392-A459 WeakPolarHBondContact OH-CB 3.49Å
393	T	95.3	Very high	92.9	Very high	11 Å²	11	47.2 Å²	47.2	7%	0.067	23%	0.234	C	C	.	.			trans	-131.1	167.5	173.8	67.1	0	0	0	0	109.6	I395 S396 L397 L641	T393-I395 PolarHBondContact O-N 2.93Å; T393-I395 PolarHBondContact OG1-N 3.39Å; T393-S396 PolarHBondContact N-OG 3.28Å; T393-S396 VanDerWaalsContact N-OG 3.1Å; T393-S396 WeakPolarHBondContact O-CB 3.31Å; T393-S396 PolarHBondContact O-N 3.37Å; T393-S396 VanDerWaalsContact O-N 3.09Å; T393-S396 PolarHBondContact OG1-N 3.27Å; T393-S396 PolarHBondContact OG1-OG 3.46Å; T393-L397 PolarHBondContact O-N 2.95Å; T393-L397 VanDerWaalsContact O-N 3.13Å; T393-L641 HydrophobicContact CG2-CB 4.14Å
394	N	94.6	Very high	93.6	Very high	118 Å²	118	40.4 Å²	40.4	63%	0.631	21%	0.208	S	C	*	.	H	α-helix	trans	-60.2	-34.8	173	-67	-21.2	0	0	0	111.8	I376 S396 L397 K398	I376-N394 VanDerWaalsContact CD1-OD1 3.24Å; I376-N394 WeakPolarHBondContact CD1-OD1 3.23Å; N394-S396 VanDerWaalsContact C-N 3.34Å; N394-L397 PolarHBondContact O-N 3.48Å; N394-K398 PolarHBondContact O-N 2.88Å
395	I	93.7	Very high	94.3	Very high	37 Å²	37	39 Å²	39	19%	0.19	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-39.3	175.5	-58.9	122.6	0	0	0	110.4	T393 L397 K398 L399 I644 D645 L648	T393-I395 PolarHBondContact O-N 2.93Å; T393-I395 PolarHBondContact OG1-N 3.39Å; I395-L397 VanDerWaalsContact C-N 3.31Å; I395-L397 PolarHBondContact O-N 2.86Å; I395-K398 PolarHBondContact O-N 2.65Å; I395-L399 HydrophobicContact CG2-CD1 4.07Å; I395-L399 HydrophobicContact CG2-CG 4.24Å; I395-L399 WeakPolarHBondContact O-CB 3.12Å; I395-L399 VanDerWaalsContact O-CG 3.29Å; I395-L399 WeakPolarHBondContact O-CG 3.46Å; I395-L399 PolarHBondContact O-N 2.78Å; I395-I644 HydrophobicContact CG2-CG2 3.84Å; I395-D645 WeakPolarHBondContact CD1-OD1 3.33Å; I395-D645 WeakPolarHBondContact CD1-OD2 3.27Å; I395-D645 WeakPolarHBondContact CG1-OD1 3.41Å; I395-D645 WeakPolarHBondContact CG2-OD1 3.31Å; I395-L648 HydrophobicContact CG2-CD2 4.42Å
396	S	94.6	Very high	95	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-45.8	174.3	-56	0	0	0	0	112	T393 N394 L399 L400 C436	T393-S396 PolarHBondContact N-OG 3.28Å; T393-S396 VanDerWaalsContact N-OG 3.1Å; T393-S396 WeakPolarHBondContact O-CB 3.31Å; T393-S396 PolarHBondContact O-N 3.37Å; T393-S396 VanDerWaalsContact O-N 3.09Å; T393-S396 PolarHBondContact OG1-N 3.27Å; T393-S396 PolarHBondContact OG1-OG 3.46Å; N394-S396 VanDerWaalsContact C-N 3.34Å; S396-L399 PolarHBondContact O-N 3.08Å; S396-L400 VanDerWaalsContact O-CG 3.25Å; S396-L400 WeakPolarHBondContact O-CG 3.31Å; S396-L400 PolarHBondContact O-N 3.29Å; S396-C436 WeakPolarHBondContact CB-O 3.28Å; S396-C436 PolarHBondContact OG-O 3.43Å
397	L	96.4	Very high	95.2	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.063	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-46.8	179.3	-65.2	175.9	0	0	0	111.2	Y392 T393 N394 I395 L399 L400 E401 L456 A459 E460 L463	Y392-L397 HydrophobicContact CD2-CD1 3.95Å; Y392-L397 HydrophobicContact CD2-CD2 4.08Å; Y392-L397 HydrophobicContact CD2-CG 3.91Å; Y392-L397 HydrophobicContact CE2-CD1 3.8Å; Y392-L397 HydrophobicContact CE2-CD2 4.39Å; Y392-L397 HydrophobicContact CE2-CG 4.26Å; T393-L397 PolarHBondContact O-N 2.95Å; T393-L397 VanDerWaalsContact O-N 3.13Å; N394-L397 PolarHBondContact O-N 3.48Å; I395-L397 VanDerWaalsContact C-N 3.31Å; I395-L397 PolarHBondContact O-N 2.86Å; L397-L399 VanDerWaalsContact C-N 3.32Å; L397-L399 PolarHBondContact O-N 3.27Å; L397-L400 WeakPolarHBondContact O-CB 3.46Å; L397-L400 PolarHBondContact O-N 3.49Å; L397-L400 VanDerWaalsContact O-N 3.11Å; L397-E401 PolarHBondContact O-N 3.19Å; L397-L456 HydrophobicContact CD2-CD2 4.19Å; L397-A459 HydrophobicContact CD1-CB 3.91Å; L397-A459 HydrophobicContact CD2-CB 4.45Å; L397-E460 HydrophobicContact CB-CB 4.39Å; L397-E460 HydrophobicContact CD1-CB 4.28Å; L397-E460 HydrophobicContact CD2-CB 4.44Å; L397-L463 HydrophobicContact CD2-CD1 4.29Å
398	K	95.9	Very high	95.2	Very high	119 Å²	119	30.1 Å²	30.1	52%	0.517	15%	0.149	S	C	.	.	H	α-helix	trans	-57	-44.4	175.8	-177.3	177.4	173.1	-178.1	0	112.2	N394 I395 L400 E401 E402	N394-K398 PolarHBondContact O-N 2.88Å; I395-K398 PolarHBondContact O-N 2.65Å; K398-L400 VanDerWaalsContact C-N 3.34Å; K398-L400 PolarHBondContact O-N 2.93Å; K398-E401 PolarHBondContact O-N 3.17Å; K398-E402 WeakPolarHBondContact CE-OE1 3.33Å; K398-E402 HydrophobicContact CG-CG 4.41Å; K398-E402 IonicContact NZ-OE1 2.86Å; K398-E402 WeakPolarHBondContact O-CB 3.36Å; K398-E402 WeakPolarHBondContact O-CG 3.19Å; K398-E402 PolarHBondContact O-N 3.29Å
399	L	96.5	Very high	94.9	Very high	6 Å²	6	30.1 Å²	30.1	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-64.5	-37.2	177.1	-74.5	178.2	0	0	0	112.7	I395 S396 L397 E401 I403 V427 I429 V434 I644 L648	I395-L399 HydrophobicContact CG2-CD1 4.07Å; I395-L399 HydrophobicContact CG2-CG 4.24Å; I395-L399 WeakPolarHBondContact O-CB 3.12Å; I395-L399 VanDerWaalsContact O-CG 3.29Å; I395-L399 WeakPolarHBondContact O-CG 3.46Å; I395-L399 PolarHBondContact O-N 2.78Å; S396-L399 PolarHBondContact O-N 3.08Å; L397-L399 VanDerWaalsContact C-N 3.32Å; L397-L399 PolarHBondContact O-N 3.27Å; L399-E401 VanDerWaalsContact C-N 3.34Å; L399-I403 WeakPolarHBondContact O-CB 3.36Å; L399-I403 PolarHBondContact O-N 2.99Å; L399-V427 HydrophobicContact CB-CG2 4.19Å; L399-I429 HydrophobicContact CD2-CD1 4.03Å; L399-V434 HydrophobicContact CD1-CG1 3.92Å; L399-I644 HydrophobicContact CD1-CG2 3.82Å; L399-L648 HydrophobicContact CD2-CD1 4.17Å; L399-L648 HydrophobicContact CD2-CD2 4.42Å
400	L	97.8	Very high	94.2	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-69.6	-32.2	176.2	-72.7	170.9	0	0	0	112.4	S396 L397 K398 W406 I425 V427 C436 V437 L463	S396-L400 VanDerWaalsContact O-CG 3.25Å; S396-L400 WeakPolarHBondContact O-CG 3.31Å; S396-L400 PolarHBondContact O-N 3.29Å; L397-L400 WeakPolarHBondContact O-CB 3.46Å; L397-L400 PolarHBondContact O-N 3.49Å; L397-L400 VanDerWaalsContact O-N 3.11Å; K398-L400 VanDerWaalsContact C-N 3.34Å; K398-L400 PolarHBondContact O-N 2.93Å; L400-W406 HydrophobicContact CB-CZ2 3.75Å; L400-W406 HydrophobicContact CD2-CD2 3.74Å; L400-W406 HydrophobicContact CD2-CE3 4.35Å; L400-W406 HydrophobicContact CD2-CG 3.91Å; L400-W406 HydrophobicContact CD2-CZ2 4.14Å; L400-W406 HydrophobicContact CG-CZ2 4.39Å; L400-W406 PolarHBondContact O-NE1 3.25Å; L400-I425 HydrophobicContact CD2-CG2 3.74Å; L400-V427 HydrophobicContact CD2-CG1 3.82Å; L400-C436 HydrophobicContact CD1-CB 4.07Å; L400-C436 HydrophobicContact CD2-CB 4.06Å; L400-C436 HydrophobicContact CG-CB 3.88Å; L400-V437 HydrophobicContact CD1-CG2 3.78Å; L400-L463 HydrophobicContact CB-CD2 3.83Å
401	E	96.7	Very high	93.2	Very high	91 Å²	91	31 Å²	31	43%	0.425	16%	0.155	S	C	.	.	H	α-helix	trans	-71.2	-47.3	173.5	-176.7	-178.5	-156.2	0	0	111.5	L397 K398 L399 S462 L463	L397-E401 PolarHBondContact O-N 3.19Å; K398-E401 PolarHBondContact O-N 3.17Å; L399-E401 VanDerWaalsContact C-N 3.34Å; E401-S462 VanDerWaalsContact OE1-CB 3.27Å; E401-S462 WeakPolarHBondContact OE1-CB 3.43Å; E401-S462 PolarHBondContact OE1-OG 3.03Å; E401-L463 HydrophobicContact CB-CD2 4.11Å
402	E	95.5	Very high	91.7	Very high	116 Å²	116	35.7 Å²	35.7	54%	0.542	17%	0.173	S	C	.	.	H	α-helix	trans	-71.4	-31.1	-177.2	-72.8	178.7	167.1	0	0	113.4	K398 P404	K398-E402 WeakPolarHBondContact CE-OE1 3.33Å; K398-E402 HydrophobicContact CG-CG 4.41Å; K398-E402 IonicContact NZ-OE1 2.86Å; K398-E402 WeakPolarHBondContact O-CB 3.36Å; K398-E402 WeakPolarHBondContact O-CG 3.19Å; K398-E402 PolarHBondContact O-N 3.29Å; E402-P404 WeakPolarHBondContact O-CD 3.25Å
403	I	95.1	Very high	90.1	Very high	38 Å²	38	41.7 Å²	41.7	20%	0.195	20%	0.2	C	C	.	.			trans	-112.7	101.2	-177	-57	172.7	0	0	0	109	L399 T405 W406 V427 I429	L399-I403 WeakPolarHBondContact O-CB 3.36Å; L399-I403 PolarHBondContact O-N 2.99Å; I403-T405 PolarHBondContact O-N 2.72Å; I403-T405 VanDerWaalsContact O-N 3.17Å; I403-W406 PolarHBondContact O-NE1 2.88Å; I403-V427 HydrophobicContact CB-CB 4.08Å; I403-V427 HydrophobicContact CB-CG1 4.02Å; I403-V427 HydrophobicContact CD1-CB 3.95Å; I403-V427 HydrophobicContact CD1-CG2 3.85Å; I403-V427 HydrophobicContact CG2-CB 4.02Å; I403-V427 HydrophobicContact CG2-CG1 4.26Å; I403-I429 HydrophobicContact CD1-CD1 4.17Å; I403-I429 HydrophobicContact CD1-CG1 3.59Å
404	P	94.1	Very high	88.8	Confident	38 Å²	38	41.2 Å²	41.2	25%	0.247	20%	0.197	C	C	.	.			trans	-76.6	-4.9	-171.6	31.5	-37.4	0	0	0	113.7	E402 P465 E466 N467	E402-P404 WeakPolarHBondContact O-CD 3.25Å; P404-P465 CarbonylContact O-C 3.41Å; P404-P465 WeakPolarHBondContact O-CA 3.41Å; P404-E466 HydrophobicContact CB-CB 3.93Å; P404-E466 HydrophobicContact CB-CG 3.7Å; P404-E466 HydrophobicContact CG-CG 4.34Å; P404-E466 PolarHBondContact O-N 2.92Å; P404-N467 PolarHBondContact O-N 3.11Å; P404-N467 VanDerWaalsContact O-N 3.13Å
405	T	93.8	Very high	88	Confident	21 Å²	21	36.8 Å²	36.8	13%	0.129	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	110.3	173.4	-56.1	0	0	0	0	110.1	I403 N467 I469 Y605	I403-T405 PolarHBondContact O-N 2.72Å; I403-T405 VanDerWaalsContact O-N 3.17Å; T405-N467 CarbonylContact C-O 3.6Å; T405-N467 VanDerWaalsContact CA-O 3.28Å; T405-N467 WeakPolarHBondContact CA-O 3.26Å; T405-N467 HydrophobicContact CG2-CB 4.1Å; T405-I469 HydrophobicContact CG2-CD1 4.08Å; T405-Y605 HydrophobicContact CG2-CD1 4.15Å; T405-Y605 HydrophobicContact CG2-CE1 3.58Å; T405-Y605 PolarHBondContact OG1-OH 2.95Å; T405-Y605 VanDerWaalsContact OG1-OH 3.1Å
406	W	95.9	Very high	87.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	146.5	178.8	-59.4	-1.5	0	0	0	111.3	L400 I403 M408 I425 H426 L463 P465 N467 V468 I469 F484	L400-W406 HydrophobicContact CB-CZ2 3.75Å; L400-W406 HydrophobicContact CD2-CD2 3.74Å; L400-W406 HydrophobicContact CD2-CE3 4.35Å; L400-W406 HydrophobicContact CD2-CG 3.91Å; L400-W406 HydrophobicContact CD2-CZ2 4.14Å; L400-W406 HydrophobicContact CG-CZ2 4.39Å; L400-W406 PolarHBondContact O-NE1 3.25Å; I403-W406 PolarHBondContact O-NE1 2.88Å; W406-M408 HydrophobicContact CE3-CE 3.48Å; W406-M408 VanDerWaalsContact CE3-CE 3.48Å; W406-M408 HydrophobicContact CZ3-CE 4.06Å; W406-I425 HydrophobicContact CB-CG2 4.25Å; W406-I425 HydrophobicContact CD2-CG2 4.31Å; W406-I425 HydrophobicContact CE3-CG2 4.02Å; W406-I425 HydrophobicContact CG-CG2 4.44Å; W406-H426 CarbonylContact C-O 3.56Å; W406-H426 WeakPolarHBondContact CA-O 3.5Å; W406-L463 HydrophobicContact CH2-CB 4.1Å; W406-L463 HydrophobicContact CH2-CD1 4.28Å; W406-L463 HydrophobicContact CH2-CD2 4.47Å; W406-L463 HydrophobicContact CZ2-CB 4.27Å; W406-L463 HydrophobicContact CZ2-CD2 4.12Å; W406-P465 HydrophobicContact CD2-CB 3.68Å; W406-P465 HydrophobicContact CD2-CG 4.09Å; W406-P465 HydrophobicContact CE3-CB 4.03Å; W406-P465 HydrophobicContact CE3-CG 3.93Å; W406-P465 HydrophobicContact CG-CB 4.04Å; W406-P465 HydrophobicContact CH2-CB 4.47Å; W406-P465 HydrophobicContact CH2-CG 4Å; W406-P465 HydrophobicContact CZ2-CB 4.13Å; W406-P465 HydrophobicContact CZ2-CG 4.12Å; W406-P465 HydrophobicContact CZ3-CB 4.42Å; W406-P465 HydrophobicContact CZ3-CG 3.9Å; W406-N467 PolarHBondContact N-O 2.9Å; W406-V468 HydrophobicContact CB-CG2 4.17Å; W406-V468 CarbonylContact O-C 3.55Å; W406-V468 WeakPolarHBondContact O-CA 3.43Å; W406-I469 PolarHBondContact O-N 3.2Å; W406-F484 HydrophobicContact CH2-CE2 4.44Å; W406-F484 HydrophobicContact CH2-CZ 4.08Å; W406-F484 HydrophobicContact CZ3-CE2 4.07Å; W406-F484 HydrophobicContact CZ3-CZ 4.17Å
407	L	93.1	Very high	86.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.5	171.1	-59.6	104.2	0	0	0	110.3	I425 H426 A428 I433 I469 V608 F612	L407-I425 CarbonylContact O-C 3.59Å; L407-I425 WeakPolarHBondContact O-CA 3.49Å; L407-H426 HydrophobicContact CB-CB 4.23Å; L407-H426 PolarHBondContact N-O 3.46Å; L407-H426 PolarHBondContact O-N 3.44Å; L407-H426 PolarHBondContact O-ND1 2.98Å; L407-A428 HydrophobicContact CD1-CB 4.23Å; L407-I433 HydrophobicContact CD1-CD1 4.3Å; L407-I469 CarbonylContact C-O 3.54Å; L407-I469 WeakPolarHBondContact CA-O 3.47Å; L407-I469 HydrophobicContact CD2-CB 4.07Å; L407-I469 HydrophobicContact CD2-CD1 3.93Å; L407-I469 HydrophobicContact CD2-CG2 4.19Å; L407-I469 HydrophobicContact CG-CB 4.19Å; L407-I469 HydrophobicContact CG-CD1 4.21Å; L407-V608 HydrophobicContact CD1-CG1 3.61Å; L407-V608 HydrophobicContact CD2-CG1 3.67Å; L407-V608 HydrophobicContact CG-CG1 4.23Å; L407-F612 HydrophobicContact CB-CD1 4.02Å; L407-F612 HydrophobicContact CB-CD2 4.23Å; L407-F612 HydrophobicContact CB-CE1 3.88Å; L407-F612 HydrophobicContact CB-CE2 4.16Å; L407-F612 HydrophobicContact CB-CG 4.16Å; L407-F612 HydrophobicContact CB-CZ 3.93Å; L407-F612 HydrophobicContact CD2-CB 3.89Å; L407-F612 HydrophobicContact CD2-CD1 3.78Å; L407-F612 HydrophobicContact CD2-CE1 4.42Å; L407-F612 HydrophobicContact CD2-CG 3.86Å
408	M	92.9	Very high	86.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.3	-176.1	-61.1	-169.8	-174.6	0	0	111.4	W406 F423 T424 I425 L453 V468 I469 T470 I480	W406-M408 HydrophobicContact CE3-CE 3.48Å; W406-M408 VanDerWaalsContact CE3-CE 3.48Å; W406-M408 HydrophobicContact CZ3-CE 4.06Å; M408-F423 HydrophobicContact CB-CE1 4.07Å; M408-F423 HydrophobicContact CB-CZ 3.69Å; M408-F423 HydrophobicContact CG-CE1 4.29Å; M408-F423 HydrophobicContact CG-CZ 4.28Å; M408-F423 HydrophobicContact SD-CE1 3.95Å; M408-F423 HydrophobicContact SD-CZ 3.91Å; M408-T424 VanDerWaalsContact CA-O 3.28Å; M408-T424 WeakPolarHBondContact CA-O 3.45Å; M408-I425 HydrophobicContact CE-CD1 4.22Å; M408-I425 HydrophobicContact CE-CG1 4.47Å; M408-I425 HydrophobicContact CE-CG2 4.28Å; M408-I425 HydrophobicContact CG-CG1 4.16Å; M408-I425 HydrophobicContact CG-CG2 4.18Å; M408-L453 HydrophobicContact CE-CD2 3.94Å; M408-V468 HydrophobicContact CE-CG1 4.14Å; M408-V468 HydrophobicContact CE-CG2 4.17Å; M408-V468 HydrophobicContact CG-CG1 4.01Å; M408-V468 HydrophobicContact SD-CG1 3.96Å; M408-I469 PolarHBondContact N-O 3.12Å; M408-T470 VanDerWaalsContact O-CA 3.26Å; M408-T470 WeakPolarHBondContact O-CA 3.45Å; M408-T470 WeakPolarHBondContact O-CB 3.41Å; M408-T470 PolarHBondContact O-OG1 2.89Å; M408-I480 HydrophobicContact CE-CG1 4.3Å; M408-I480 HydrophobicContact SD-CD1 3.57Å; M408-I480 VanDerWaalsContact SD-CD1 3.57Å; M408-I480 HydrophobicContact SD-CG1 3.83Å
409	C	86.2	Confident	85.9	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.014	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156	179.4	-176.5	0	0	0	0	111.5	T424 D471 F612	C409-T424 PolarHBondContact N-O 3.1Å; C409-T424 VanDerWaalsContact N-O 3.12Å; C409-T424 PolarHBondContact O-N 2.98Å; C409-T424 PolarHBondContact O-OG1 2.93Å; C409-D471 PolarHBondContact SG-OD2 2.83Å; C409-F612 HydrophobicContact CB-CE1 3.48Å; C409-F612 VanDerWaalsContact CB-CE1 3.48Å; C409-F612 HydrophobicContact CB-CE2 4.24Å; C409-F612 HydrophobicContact CB-CZ 3.19Å
410	E	81.5	Confident	85.4	Confident	13 Å²	13	46 Å²	46	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.4	177.7	60.9	-174.7	-178.7	0	0	113	Y412 Q421 L422 F423 Q473 H616	E410-Y412 HydrophobicContact CB-CE2 4.46Å; E410-Y412 HydrophobicContact CG-CD2 4.2Å; E410-Y412 HydrophobicContact CG-CE2 3.56Å; E410-Y412 WeakPolarHBondContact OE1-CE2 3.45Å; E410-Y412 PolarHBondContact OE1-OH 2.95Å; E410-Y412 PolarHBondContact OE2-OH 3.42Å; E410-Q421 VanDerWaalsContact OE2-CD 3.27Å; E410-Q421 PolarHBondContact OE2-NE2 3.05Å; E410-Q421 PolarHBondContact OE2-OE1 3.5Å; E410-Q421 VanDerWaalsContact OE2-OE1 3.11Å; E410-L422 CarbonylContact C-O 3.6Å; E410-L422 WeakPolarHBondContact CA-O 3.44Å; E410-F423 HydrophobicContact CB-CD2 4.13Å; E410-Q473 PolarHBondContact OE2-NE2 2.85Å; E410-Q473 PolarHBondContact OE2-OE1 2.85Å; E410-H616 PolarHBondContact O-NE2 2.81Å
411	A	74.5	Confident	85	Confident	6 Å²	6	46 Å²	46	5%	0.05	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.2	173	0	0	0	0	0	109.9	L422	A411-L422 HydrophobicContact CB-CB 4.31Å; A411-L422 PolarHBondContact N-O 2.87Å; A411-L422 PolarHBondContact O-N 2.88Å
412	Y	65	Low	84.7	Confident	97 Å²	97	41.7 Å²	41.7	38%	0.38	19%	0.189	S	C	.	.			trans	-82.8	-43.8	175.1	-64.4	-79.9	0	0	0	113.2	E410 V414 M415 N420 Q421 Q473	E410-Y412 HydrophobicContact CB-CE2 4.46Å; E410-Y412 HydrophobicContact CG-CD2 4.2Å; E410-Y412 HydrophobicContact CG-CE2 3.56Å; E410-Y412 WeakPolarHBondContact OE1-CE2 3.45Å; E410-Y412 PolarHBondContact OE1-OH 2.95Å; E410-Y412 PolarHBondContact OE2-OH 3.42Å; Y412-V414 PolarHBondContact O-N 3.11Å; Y412-M415 PolarHBondContact O-N 3.17Å; Y412-N420 WeakPolarHBondContact CD1-O 3.46Å; Y412-Q421 HydrophobicContact CD1-CB 3.92Å; Y412-Q421 HydrophobicContact CE1-CB 4.05Å; Y412-Q473 PolarHBondContact OH-NE2 2.86Å
413	K	63.9	Low	84.6	Confident	148 Å²	148	36.4 Å²	36.4	64%	0.643	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-2.9	-159.8	-70.6	179.1	-175.7	171.8	0	114.9	Y620	K413-Y620 HydrophobicContact CB-CD2 4.45Å; K413-Y620 HydrophobicContact CB-CE2 3.57Å
414	V	67.6	Low	84.6	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.012	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	8.4	-174	-143.3	0	0	0	0	113.5	Y412 Y620 L623 V624 S627	Y412-V414 PolarHBondContact O-N 3.11Å; V414-Y620 HydrophobicContact CG2-CD2 3.04Å; V414-Y620 HydrophobicContact CG2-CE2 3.31Å; V414-Y620 HydrophobicContact CG2-CG 4.04Å; V414-L623 HydrophobicContact CB-CB 4.18Å; V414-L623 VanDerWaalsContact CG1-C 3.44Å; V414-L623 HydrophobicContact CG1-CB 3.37Å; V414-V624 HydrophobicContact CG1-CG2 4.24Å; V414-S627 VanDerWaalsContact O-CB 3.27Å; V414-S627 WeakPolarHBondContact O-CB 3.29Å
415	M	78.5	Confident	84.7	Confident	25 Å²	25	32.8 Å²	32.8	12%	0.123	14%	0.143	C	C	.	.			trans	-83	145.3	-173.7	-70.3	-55.3	102.4	0	0	113.3	Y412 F419 L422 L440 I633	Y412-M415 PolarHBondContact O-N 3.17Å; M415-F419 HydrophobicContact CB-CB 4.31Å; M415-F419 WeakPolarHBondContact CB-O 3.46Å; M415-L422 HydrophobicContact CE-CB 3.32Å; M415-L422 HydrophobicContact CE-CD2 4.02Å; M415-L422 HydrophobicContact CE-CG 4.29Å; M415-L422 HydrophobicContact CG-CB 4.42Å; M415-L422 HydrophobicContact SD-CB 3.44Å; M415-L422 WeakPolarHBondContact SD-CB 3.24Å; M415-L422 PolarHBondContact SD-N 2.95Å; M415-L440 HydrophobicContact SD-CD2 3.8Å; M415-I633 HydrophobicContact CE-CD1 4.11Å
416	P	77.6	Confident	84.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.013	14%	0.137	C	C	.	.			trans	-62.4	152.1	167.2	-11.7	28.1	0	0	0	108.5	L418 F419 S627 V630 I633	P416-L418 PolarHBondContact O-N 3.47Å; P416-F419 HydrophobicContact CG-CD2 4.36Å; P416-F419 PolarHBondContact O-N 2.92Å; P416-S627 WeakPolarHBondContact CA-O 3.16Å; P416-S627 WeakPolarHBondContact CG-O 3.32Å; P416-V630 HydrophobicContact CG-CB 4.07Å; P416-I633 VanDerWaalsContact CD-CD1 3.42Å; P416-I633 HydrophobicContact CG-CD1 3.58Å
417	R	82.2	Confident	84.7	Confident	253 Å²	253	31.8 Å²	31.8	96%	0.955	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-19.4	-175.7	-71.5	-176.9	174.9	174.1	-3.5	115.6
418	L	86.9	Confident	84.5	Confident	32 Å²	32	32.8 Å²	32.8	17%	0.168	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-17	179.9	-61.1	178.9	0	0	0	113.7	P354 L357 I360 P416	P354-L418 HydrophobicContact CB-CD1 4.07Å; P354-L418 HydrophobicContact CG-CD1 3.86Å; P354-L418 WeakPolarHBondContact O-CD1 3.02Å; L357-L418 HydrophobicContact CD2-CB 4.05Å; L357-L418 WeakPolarHBondContact CD2-O 3.44Å; L357-L418 HydrophobicContact CG-CB 4.49Å; I360-L418 HydrophobicContact CD1-CD1 3.96Å; I360-L418 HydrophobicContact CG1-CD1 4.18Å; P416-L418 PolarHBondContact O-N 3.47Å
419	F	89	Confident	84.2	Confident	7 Å²	7	33.8 Å²	33.8	3%	0.031	15%	0.151	C	C	.	.			trans	-117.8	140.7	-179.2	-62.9	-80.3	0	0	0	110.6	L357 I360 F389 M415 P416 L440 V630	L357-F419 HydrophobicContact CD2-CD1 4.34Å; L357-F419 HydrophobicContact CD2-CE1 3.9Å; L357-F419 HydrophobicContact CD2-CZ 4.06Å; I360-F419 HydrophobicContact CD1-CE2 3.71Å; I360-F419 HydrophobicContact CD1-CZ 3.56Å; F389-F419 AromaticContact CD2-CE1 3.81Å; F389-F419 HydrophobicContact CD2-CE1 3.81Å; F389-F419 AromaticContact CD2-CZ 3.63Å; F389-F419 HydrophobicContact CD2-CZ 3.63Å; F389-F419 HydrophobicContact CE2-CE1 4.05Å; F389-F419 AromaticContact CE2-CZ 3.62Å; F389-F419 HydrophobicContact CE2-CZ 3.62Å; M415-F419 HydrophobicContact CB-CB 4.31Å; M415-F419 WeakPolarHBondContact CB-O 3.46Å; P416-F419 HydrophobicContact CG-CD2 4.36Å; P416-F419 PolarHBondContact O-N 2.92Å; F419-L440 HydrophobicContact CD1-CB 3.72Å; F419-L440 HydrophobicContact CE1-CB 3.64Å; F419-L440 HydrophobicContact CE2-CD1 4.28Å; F419-L440 HydrophobicContact CG-CB 4.19Å; F419-L440 HydrophobicContact CZ-CB 4.06Å; F419-L440 HydrophobicContact CZ-CD1 4.22Å; F419-V630 HydrophobicContact CD2-CG2 4.41Å; F419-V630 HydrophobicContact CE2-CB 4.49Å; F419-V630 HydrophobicContact CE2-CG2 3.59Å; F419-V630 HydrophobicContact CZ-CG2 4.36Å
420	N	86.4	Confident	83.9	Confident	74 Å²	74	36 Å²	36	40%	0.396	16%	0.162	S	C	.	.	S	Bend	trans	-77	-40	175.1	-77.4	-2.2	0	0	0	111	Y412 L441 S442	Y412-N420 WeakPolarHBondContact CD1-O 3.46Å; N420-L441 PolarHBondContact N-O 3.49Å; N420-S442 PolarHBondContact ND2-O 3.04Å; N420-S442 PolarHBondContact OD1-O 3.16Å
421	Q	88.9	Confident	83.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155.6	-175.1	60.6	-173	71.2	0	0	113.4	E410 Y412 L441 F449	E410-Q421 VanDerWaalsContact OE2-CD 3.27Å; E410-Q421 PolarHBondContact OE2-NE2 3.05Å; E410-Q421 PolarHBondContact OE2-OE1 3.5Å; E410-Q421 VanDerWaalsContact OE2-OE1 3.11Å; Y412-Q421 HydrophobicContact CD1-CB 3.92Å; Y412-Q421 HydrophobicContact CE1-CB 4.05Å; Q421-L441 HydrophobicContact CG-CB 4.01Å; Q421-L441 HydrophobicContact CG-CD1 4.26Å; Q421-L441 PolarHBondContact N-O 2.91Å; Q421-L441 PolarHBondContact O-N 2.95Å; Q421-F449 VanDerWaalsContact NE2-CZ 3.29Å
422	L	91.2	Very high	83.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.3	159.9	169.2	69.7	0	0	0	108	E410 A411 M415 T424 Y438 A439 L440 L619 L623	E410-L422 CarbonylContact C-O 3.6Å; E410-L422 WeakPolarHBondContact CA-O 3.44Å; A411-L422 HydrophobicContact CB-CB 4.31Å; A411-L422 PolarHBondContact N-O 2.87Å; A411-L422 PolarHBondContact O-N 2.88Å; M415-L422 HydrophobicContact CE-CB 3.32Å; M415-L422 HydrophobicContact CE-CD2 4.02Å; M415-L422 HydrophobicContact CE-CG 4.29Å; M415-L422 HydrophobicContact CG-CB 4.42Å; M415-L422 HydrophobicContact SD-CB 3.44Å; M415-L422 WeakPolarHBondContact SD-CB 3.24Å; M415-L422 PolarHBondContact SD-N 2.95Å; L422-T424 HydrophobicContact CD1-CG2 4.37Å; L422-T424 HydrophobicContact CD2-CG2 4.24Å; L422-T424 HydrophobicContact CG-CG2 3.93Å; L422-Y438 HydrophobicContact CD1-CD1 3.84Å; L422-Y438 HydrophobicContact CD1-CG 4.44Å; L422-Y438 HydrophobicContact CD2-CD1 4.02Å; L422-Y438 HydrophobicContact CD2-CE1 4.41Å; L422-Y438 HydrophobicContact CG-CD1 4.27Å; L422-A439 CarbonylContact C-O 3.55Å; L422-A439 WeakPolarHBondContact CA-O 3.5Å; L422-L440 HydrophobicContact CB-CD2 4.32Å; L422-L440 HydrophobicContact CD1-CD2 3.84Å; L422-L440 HydrophobicContact CD1-CG 4.49Å; L422-L619 HydrophobicContact CD2-CD2 3.98Å; L422-L623 HydrophobicContact CD2-CD1 4.01Å
423	F	92.9	Very high	84.9	Confident	5 Å²	5	34.1 Å²	34.1	2%	0.022	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	146.1	172.8	-166	-96.6	0	0	0	110	M408 E410 I425 Y438 A439 L441 F449 L452	M408-F423 HydrophobicContact CB-CE1 4.07Å; M408-F423 HydrophobicContact CB-CZ 3.69Å; M408-F423 HydrophobicContact CG-CE1 4.29Å; M408-F423 HydrophobicContact CG-CZ 4.28Å; M408-F423 HydrophobicContact SD-CE1 3.95Å; M408-F423 HydrophobicContact SD-CZ 3.91Å; E410-F423 HydrophobicContact CB-CD2 4.13Å; F423-I425 HydrophobicContact CD1-CG1 4.38Å; F423-I425 HydrophobicContact CE1-CG1 4.11Å; F423-Y438 CarbonylContact O-C 3.47Å; F423-A439 HydrophobicContact CB-CB 4.29Å; F423-A439 PolarHBondContact N-O 3.02Å; F423-A439 PolarHBondContact O-N 3.07Å; F423-L441 HydrophobicContact CB-CD1 3.84Å; F423-L441 HydrophobicContact CB-CG 4.38Å; F423-L441 HydrophobicContact CG-CD1 4.49Å; F423-F449 HydrophobicContact CD2-CD1 4.1Å; F423-F449 AromaticContact CD2-CE1 3.48Å; F423-F449 HydrophobicContact CD2-CE1 3.48Å; F423-F449 VanDerWaalsContact CD2-CE1 3.48Å; F423-F449 HydrophobicContact CD2-CZ 4.47Å; F423-F449 HydrophobicContact CE2-CD1 4.04Å; F423-F449 AromaticContact CE2-CE1 3.69Å; F423-F449 HydrophobicContact CE2-CE1 3.69Å; F423-F449 HydrophobicContact CG-CD1 4.36Å; F423-F449 HydrophobicContact CG-CE1 4.01Å; F423-F449 HydrophobicContact CZ-CD1 4.27Å; F423-F449 HydrophobicContact CZ-CE1 4.36Å; F423-L452 HydrophobicContact CB-CD2 4.47Å; F423-L452 HydrophobicContact CD1-CD2 3.42Å; F423-L452 VanDerWaalsContact CD1-CD2 3.42Å; F423-L452 HydrophobicContact CE1-CD2 3.94Å; F423-L452 HydrophobicContact CG-CD2 4.24Å
424	T	93.9	Very high	86.3	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.4	-171.6	56.7	0	0	0	0	111.3	M408 C409 L422 H426 V437 Y438	M408-T424 VanDerWaalsContact CA-O 3.28Å; M408-T424 WeakPolarHBondContact CA-O 3.45Å; C409-T424 PolarHBondContact N-O 3.1Å; C409-T424 VanDerWaalsContact N-O 3.12Å; C409-T424 PolarHBondContact O-N 2.98Å; C409-T424 PolarHBondContact O-OG1 2.93Å; L422-T424 HydrophobicContact CD1-CG2 4.37Å; L422-T424 HydrophobicContact CD2-CG2 4.24Å; L422-T424 HydrophobicContact CG-CG2 3.93Å; T424-H426 WeakPolarHBondContact CB-CE1 3.37Å; T424-H426 PolarHBondContact OG1-CE1 3.16Å; T424-V437 CarbonylContact C-O 3.6Å; T424-V437 VanDerWaalsContact CA-O 3.29Å; T424-V437 WeakPolarHBondContact CA-O 3.38Å; T424-Y438 HydrophobicContact CG2-CD1 3.48Å; T424-Y438 VanDerWaalsContact CG2-CD1 3.48Å; T424-Y438 HydrophobicContact CG2-CE1 3.77Å; T424-Y438 HydrophobicContact CG2-CG 4.28Å
425	I	96.1	Very high	87.5	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.2	178	-48.1	176.4	0	0	0	108.7	L400 W406 L407 M408 F423 C436 V437 L453 L456	L400-I425 HydrophobicContact CD2-CG2 3.74Å; W406-I425 HydrophobicContact CB-CG2 4.25Å; W406-I425 HydrophobicContact CD2-CG2 4.31Å; W406-I425 HydrophobicContact CE3-CG2 4.02Å; W406-I425 HydrophobicContact CG-CG2 4.44Å; L407-I425 CarbonylContact O-C 3.59Å; L407-I425 WeakPolarHBondContact O-CA 3.49Å; M408-I425 HydrophobicContact CE-CD1 4.22Å; M408-I425 HydrophobicContact CE-CG1 4.47Å; M408-I425 HydrophobicContact CE-CG2 4.28Å; M408-I425 HydrophobicContact CG-CG1 4.16Å; M408-I425 HydrophobicContact CG-CG2 4.18Å; F423-I425 HydrophobicContact CD1-CG1 4.38Å; F423-I425 HydrophobicContact CE1-CG1 4.11Å; I425-C436 PolarHBondContact O-N 2.94Å; I425-V437 HydrophobicContact CB-CB 3.96Å; I425-V437 HydrophobicContact CB-CG2 4.29Å; I425-V437 HydrophobicContact CD1-CB 4.21Å; I425-V437 HydrophobicContact CD1-CG1 4.46Å; I425-V437 HydrophobicContact CD1-CG2 4.41Å; I425-V437 HydrophobicContact CG1-CB 4.17Å; I425-V437 PolarHBondContact N-O 2.87Å; I425-V437 PolarHBondContact O-N 3.42Å; I425-L453 HydrophobicContact CD1-CD2 4.25Å; I425-L456 HydrophobicContact CD1-CD1 3.48Å; I425-L456 VanDerWaalsContact CD1-CD1 3.48Å
426	H	95.1	Very high	88.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	161.3	-172.9	-56.7	74.6	0	0	0	111.5	W406 L407 T424 I433 V434 P435 F612 W615	W406-H426 CarbonylContact C-O 3.56Å; W406-H426 WeakPolarHBondContact CA-O 3.5Å; L407-H426 HydrophobicContact CB-CB 4.23Å; L407-H426 PolarHBondContact N-O 3.46Å; L407-H426 PolarHBondContact O-N 3.44Å; L407-H426 PolarHBondContact O-ND1 2.98Å; T424-H426 WeakPolarHBondContact CB-CE1 3.37Å; T424-H426 PolarHBondContact OG1-CE1 3.16Å; H426-I433 HydrophobicContact CB-CG2 4.05Å; H426-I433 WeakPolarHBondContact CD2-CG2 3.41Å; H426-V434 VanDerWaalsContact CA-O 3.26Å; H426-V434 WeakPolarHBondContact CA-O 3.35Å; H426-V434 WeakPolarHBondContact CB-O 3.42Å; H426-P435 WeakPolarHBondContact CD2-CA 3.36Å; H426-F612 HydrophobicContact CB-CE2 4.37Å; H426-F612 AromaticContact CE1-CE2 3.52Å; H426-F612 AromaticContact CG-CE2 3.75Å; H426-F612 AromaticContact ND1-CE2 3.3Å; H426-F612 VanDerWaalsContact ND1-CE2 3.3Å; H426-F612 WeakPolarHBondContact ND1-CE2 3.28Å; H426-F612 AromaticContact ND1-CZ 3.9Å; H426-W615 AromaticContact CE1-CE3 3.98Å; H426-W615 AromaticContact CE1-CH2 3.65Å; H426-W615 AromaticContact CE1-CZ3 3.41Å; H426-W615 VanDerWaalsContact CE1-CZ3 3.41Å; H426-W615 WeakPolarHBondContact CE1-CZ3 3.48Å; H426-W615 AromaticContact NE2-CD2 3.79Å; H426-W615 AromaticContact NE2-CE2 3.75Å; H426-W615 AromaticContact NE2-CE3 3.4Å; H426-W615 AromaticContact NE2-CH2 2.95Å; H426-W615 WeakPolarHBondContact NE2-CH2 3.49Å; H426-W615 AromaticContact NE2-CZ2 3.39Å; H426-W615 WeakPolarHBondContact NE2-CZ2 3.45Å; H426-W615 AromaticContact NE2-CZ3 2.99Å; H426-W615 WeakPolarHBondContact NE2-CZ3 3.48Å
427	V	94.7	Very high	89.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	166.4	163.3	-59.4	0	0	0	0	109.4	L399 L400 I403 V434	L399-V427 HydrophobicContact CB-CG2 4.19Å; L400-V427 HydrophobicContact CD2-CG1 3.82Å; I403-V427 HydrophobicContact CB-CB 4.08Å; I403-V427 HydrophobicContact CB-CG1 4.02Å; I403-V427 HydrophobicContact CD1-CB 3.95Å; I403-V427 HydrophobicContact CD1-CG2 3.85Å; I403-V427 HydrophobicContact CG2-CB 4.02Å; I403-V427 HydrophobicContact CG2-CG1 4.26Å; V427-V434 HydrophobicContact CG2-CB 3.99Å; V427-V434 PolarHBondContact N-O 2.94Å; V427-V434 PolarHBondContact O-N 2.96Å
428	A	89.7	Confident	89.9	Confident	22 Å²	22	13.8 Å²	13.8	18%	0.182	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.9	175.8	0	0	0	0	0	110.9	L407 T432 I433 V608	L407-A428 HydrophobicContact CD1-CB 4.23Å; A428-T432 CarbonylContact C-O 3.54Å; A428-T432 WeakPolarHBondContact CA-O 3.29Å; A428-I433 HydrophobicContact CB-CD1 4.2Å; A428-V608 HydrophobicContact CB-CB 4.32Å; A428-V608 HydrophobicContact CB-CG1 3.36Å; A428-V608 HydrophobicContact CB-CG2 4Å
429	I	86.9	Confident	90.3	Very high	21 Å²	21	12.3 Å²	12.3	11%	0.108	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120	174	-58.6	176.7	0	0	0	107	L399 I403 Q431 T432 V434 L648 L651	L399-I429 HydrophobicContact CD2-CD1 4.03Å; I403-I429 HydrophobicContact CD1-CD1 4.17Å; I403-I429 HydrophobicContact CD1-CG1 3.59Å; I429-Q431 VanDerWaalsContact C-N 3.27Å; I429-Q431 PolarHBondContact O-N 3.31Å; I429-T432 PolarHBondContact N-O 3.31Å; I429-T432 WeakPolarHBondContact O-CA 3.28Å; I429-T432 WeakPolarHBondContact O-CB 3.3Å; I429-T432 PolarHBondContact O-N 2.77Å; I429-V434 HydrophobicContact CD1-CG2 4.09Å; I429-V434 HydrophobicContact CG1-CG2 4.29Å; I429-L648 HydrophobicContact CD1-CD1 3.34Å; I429-L651 HydrophobicContact CB-CB 4.47Å; I429-L651 HydrophobicContact CG2-CB 4.06Å
430	N	79.8	Confident	90.5	Very high	48 Å²	48	12 Å²	12	26%	0.257	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	48.3	-179.2	-67.1	-34	0	0	0	112.7	T432 L651 L654	N430-T432 PolarHBondContact O-N 2.78Å; N430-L651 PolarHBondContact ND2-O 3.39Å; N430-L654 HydrophobicContact CB-CB 4.33Å; N430-L654 PolarHBondContact ND2-O 3.4Å; N430-L654 VanDerWaalsContact ND2-O 3.11Å
431	Q	74.5	Confident	90.9	Very high	43 Å²	43	8.5 Å²	8.5	20%	0.201	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	7.3	-178.1	-52.5	166.9	25.1	0	0	115.2	I429 R607 S611 P659	I429-Q431 VanDerWaalsContact C-N 3.27Å; I429-Q431 PolarHBondContact O-N 3.31Å; Q431-R607 HydrophobicContact CG-CB 4.18Å; Q431-S611 WeakPolarHBondContact O-CB 3.22Å; Q431-S611 PolarHBondContact O-OG 3.39Å; Q431-P659 HydrophobicContact CB-CG 4.13Å
432	T	81.2	Confident	91	Very high	23 Å²	23	8.8 Å²	8.8	14%	0.141	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.5	173.9	-57.5	0	0	0	0	109.9	A428 I429 N430 L651	A428-T432 CarbonylContact C-O 3.54Å; A428-T432 WeakPolarHBondContact CA-O 3.29Å; I429-T432 PolarHBondContact N-O 3.31Å; I429-T432 WeakPolarHBondContact O-CA 3.28Å; I429-T432 WeakPolarHBondContact O-CB 3.3Å; I429-T432 PolarHBondContact O-N 2.77Å; N430-T432 PolarHBondContact O-N 2.78Å; T432-L651 HydrophobicContact CG2-CD1 4.44Å; T432-L651 HydrophobicContact CG2-CD2 3.63Å
433	I	86.9	Confident	91	Very high	11 Å²	11	12.4 Å²	12.4	6%	0.056	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131	-173.7	-60.7	-67	0	0	0	110.2	L407 H426 A428 V608 F612 W615	L407-I433 HydrophobicContact CD1-CD1 4.3Å; H426-I433 HydrophobicContact CB-CG2 4.05Å; H426-I433 WeakPolarHBondContact CD2-CG2 3.41Å; A428-I433 HydrophobicContact CB-CD1 4.2Å; I433-V608 HydrophobicContact CD1-CG1 4Å; I433-F612 HydrophobicContact CD1-CB 3.75Å; I433-F612 HydrophobicContact CD1-CD2 4.37Å; I433-F612 HydrophobicContact CD1-CG 4.46Å; I433-F612 HydrophobicContact CG1-CB 4.15Å; I433-F612 HydrophobicContact CG2-CD2 4.06Å; I433-W615 HydrophobicContact CB-CB 4.14Å; I433-W615 HydrophobicContact CB-CG 4.21Å; I433-W615 HydrophobicContact CG1-CB 4.45Å; I433-W615 HydrophobicContact CG2-CB 4.09Å; I433-W615 HydrophobicContact CG2-CD2 4.17Å; I433-W615 HydrophobicContact CG2-CG 3.84Å
434	V	91.5	Very high	90.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.2	176.5	-175.5	0	0	0	0	108.6	L399 H426 V427 I429 C436 I644 Y647 L651	L399-V434 HydrophobicContact CD1-CG1 3.92Å; H426-V434 VanDerWaalsContact CA-O 3.26Å; H426-V434 WeakPolarHBondContact CA-O 3.35Å; H426-V434 WeakPolarHBondContact CB-O 3.42Å; V427-V434 HydrophobicContact CG2-CB 3.99Å; V427-V434 PolarHBondContact N-O 2.94Å; V427-V434 PolarHBondContact O-N 2.96Å; I429-V434 HydrophobicContact CD1-CG2 4.09Å; I429-V434 HydrophobicContact CG1-CG2 4.29Å; V434-C436 PolarHBondContact O-N 3.33Å; V434-I644 HydrophobicContact CG1-CG1 4.27Å; V434-I644 HydrophobicContact CG1-CG2 3.94Å; V434-Y647 HydrophobicContact CG1-CE2 4.32Å; V434-Y647 HydrophobicContact CG2-CE2 4.45Å; V434-L651 HydrophobicContact CG2-CD1 3.51Å
435	P	93.4	Very high	90.7	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.006	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	119.6	174.8	29.1	-33.3	0	0	0	110.8	H426 Y438 W615 I644	H426-P435 WeakPolarHBondContact CD2-CA 3.36Å; P435-Y438 HydrophobicContact CB-CE2 3.72Å; P435-Y438 HydrophobicContact CG-CE2 4.37Å; P435-W615 HydrophobicContact CB-CH2 4.16Å; P435-W615 HydrophobicContact CB-CZ2 3.64Å; P435-W615 HydrophobicContact CG-CZ2 3.82Å; P435-I644 WeakPolarHBondContact O-CD1 3.24Å
436	C	96.3	Very high	90.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-40.7	-179.7	-70.5	0	0	0	0	111.8	S396 L400 I425 V434 L641	S396-C436 WeakPolarHBondContact CB-O 3.28Å; S396-C436 PolarHBondContact OG-O 3.43Å; L400-C436 HydrophobicContact CD1-CB 4.07Å; L400-C436 HydrophobicContact CD2-CB 4.06Å; L400-C436 HydrophobicContact CG-CB 3.88Å; I425-C436 PolarHBondContact O-N 2.94Å; V434-C436 PolarHBondContact O-N 3.33Å; C436-L641 WeakPolarHBondContact O-CD2 3.49Å
437	V	97	Very high	90.6	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.7	-175.1	-173.4	0	0	0	0	110.4	V390 F391 L400 T424 I425 L452 L456	V390-V437 HydrophobicContact CG1-CG1 3.5Å; V390-V437 VanDerWaalsContact CG1-CG1 3.5Å; F391-V437 WeakPolarHBondContact O-CA 3.45Å; L400-V437 HydrophobicContact CD1-CG2 3.78Å; T424-V437 CarbonylContact C-O 3.6Å; T424-V437 VanDerWaalsContact CA-O 3.29Å; T424-V437 WeakPolarHBondContact CA-O 3.38Å; I425-V437 HydrophobicContact CB-CB 3.96Å; I425-V437 HydrophobicContact CB-CG2 4.29Å; I425-V437 HydrophobicContact CD1-CB 4.21Å; I425-V437 HydrophobicContact CD1-CG1 4.46Å; I425-V437 HydrophobicContact CD1-CG2 4.41Å; I425-V437 HydrophobicContact CG1-CB 4.17Å; I425-V437 PolarHBondContact N-O 2.87Å; I425-V437 PolarHBondContact O-N 3.42Å; V437-L452 HydrophobicContact CG1-CD1 4.43Å; V437-L456 HydrophobicContact CG1-CD1 4.38Å; V437-L456 HydrophobicContact CG1-CD2 4.18Å; V437-L456 HydrophobicContact CG2-CD1 4.07Å; V437-L456 HydrophobicContact CG2-CD2 3.9Å
438	Y	95.5	Very high	90.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137	166.9	-69.7	-98.2	0	0	0	109.4	V390 F391 L422 F423 T424 P435 W615 L619 I637 E640 L641	V390-Y438 CarbonylContact C-O 3.46Å; V390-Y438 WeakPolarHBondContact CA-O 3.47Å; F391-Y438 PolarHBondContact N-O 2.84Å; F391-Y438 PolarHBondContact O-N 2.9Å; L422-Y438 HydrophobicContact CD1-CD1 3.84Å; L422-Y438 HydrophobicContact CD1-CG 4.44Å; L422-Y438 HydrophobicContact CD2-CD1 4.02Å; L422-Y438 HydrophobicContact CD2-CE1 4.41Å; L422-Y438 HydrophobicContact CG-CD1 4.27Å; F423-Y438 CarbonylContact O-C 3.47Å; T424-Y438 HydrophobicContact CG2-CD1 3.48Å; T424-Y438 VanDerWaalsContact CG2-CD1 3.48Å; T424-Y438 HydrophobicContact CG2-CE1 3.77Å; T424-Y438 HydrophobicContact CG2-CG 4.28Å; P435-Y438 HydrophobicContact CB-CE2 3.72Å; P435-Y438 HydrophobicContact CG-CE2 4.37Å; Y438-W615 AromaticContact CE1-CH2 3.98Å; Y438-W615 HydrophobicContact CE1-CH2 3.98Å; Y438-W615 AromaticContact CZ-CH2 3.95Å; Y438-W615 WeakPolarHBondContact OH-CH2 3.36Å; Y438-W615 WeakPolarHBondContact OH-CZ2 3.43Å; Y438-L619 HydrophobicContact CE1-CD1 4.18Å; Y438-L619 HydrophobicContact CE1-CD2 4Å; Y438-I637 HydrophobicContact CD1-CB 3.94Å; Y438-I637 HydrophobicContact CD1-CG2 3.55Å; Y438-I637 HydrophobicContact CD2-CB 4.06Å; Y438-I637 HydrophobicContact CE1-CB 4.21Å; Y438-I637 HydrophobicContact CE1-CG2 3.75Å; Y438-I637 HydrophobicContact CE2-CB 4.31Å; Y438-I637 HydrophobicContact CG-CB 3.84Å; Y438-I637 HydrophobicContact CG-CG2 3.98Å; Y438-E640 HydrophobicContact CE2-CB 4.48Å; Y438-L641 HydrophobicContact CD2-CD1 3.87Å; Y438-L641 HydrophobicContact CD2-CD2 3.82Å; Y438-L641 HydrophobicContact CD2-CG 3.73Å; Y438-L641 HydrophobicContact CE2-CD1 4.49Å; Y438-L641 HydrophobicContact CE2-CD2 3.91Å; Y438-L641 HydrophobicContact CE2-CG 3.86Å
439	A	95.3	Very high	90.8	Very high	1 Å²	1	21 Å²	21	1%	0.008	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122	176.6	0	0	0	0	0	110.7	F389 V390 L422 F423 L441 L452	F389-A439 CarbonylContact O-C 3.58Å; F389-A439 WeakPolarHBondContact O-CA 3.45Å; V390-A439 HydrophobicContact CG1-CB 4.48Å; V390-A439 HydrophobicContact CG2-CB 4.29Å; L422-A439 CarbonylContact C-O 3.55Å; L422-A439 WeakPolarHBondContact CA-O 3.5Å; F423-A439 HydrophobicContact CB-CB 4.29Å; F423-A439 PolarHBondContact N-O 3.02Å; F423-A439 PolarHBondContact O-N 3.07Å; A439-L441 HydrophobicContact CB-CD2 4.02Å; A439-L441 HydrophobicContact CB-CG 4.35Å; A439-L452 HydrophobicContact CB-CD1 3.68Å; A439-L452 HydrophobicContact CB-CD2 3.74Å; A439-L452 HydrophobicContact CB-CG 4.32Å
440	L	93.8	Very high	91.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.4	170.2	-65	174.8	0	0	0	108.1	M388 F389 F391 M415 F419 L422 V630 I633 I634	M388-L440 WeakPolarHBondContact CA-O 3.45Å; F389-L440 HydrophobicContact CB-CB 4.35Å; F389-L440 HydrophobicContact CD2-CB 4.48Å; F389-L440 PolarHBondContact N-O 3.33Å; F389-L440 VanDerWaalsContact N-O 3.1Å; F389-L440 PolarHBondContact O-N 3.1Å; F391-L440 HydrophobicContact CE2-CD1 4.02Å; F391-L440 HydrophobicContact CE2-CG 4.22Å; F391-L440 HydrophobicContact CZ-CD1 4.46Å; M415-L440 HydrophobicContact SD-CD2 3.8Å; F419-L440 HydrophobicContact CD1-CB 3.72Å; F419-L440 HydrophobicContact CE1-CB 3.64Å; F419-L440 HydrophobicContact CE2-CD1 4.28Å; F419-L440 HydrophobicContact CG-CB 4.19Å; F419-L440 HydrophobicContact CZ-CB 4.06Å; F419-L440 HydrophobicContact CZ-CD1 4.22Å; L422-L440 HydrophobicContact CB-CD2 4.32Å; L422-L440 HydrophobicContact CD1-CD2 3.84Å; L422-L440 HydrophobicContact CD1-CG 4.49Å; L440-V630 HydrophobicContact CD1-CG2 4.27Å; L440-I633 HydrophobicContact CD2-CG2 4.26Å; L440-I634 HydrophobicContact CD1-CG1 4.16Å
441	L	93.5	Very high	92.1	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.6	-176.1	-52.4	179.2	0	0	0	110.2	M388 N420 Q421 F423 A439 H443 F449	M388-L441 HydrophobicContact CB-CD2 3.94Å; M388-L441 HydrophobicContact CE-CD2 4.46Å; M388-L441 HydrophobicContact SD-CD2 4.08Å; N420-L441 PolarHBondContact N-O 3.49Å; Q421-L441 HydrophobicContact CG-CB 4.01Å; Q421-L441 HydrophobicContact CG-CD1 4.26Å; Q421-L441 PolarHBondContact N-O 2.91Å; Q421-L441 PolarHBondContact O-N 2.95Å; F423-L441 HydrophobicContact CB-CD1 3.84Å; F423-L441 HydrophobicContact CB-CG 4.38Å; F423-L441 HydrophobicContact CG-CD1 4.49Å; A439-L441 HydrophobicContact CB-CD2 4.02Å; A439-L441 HydrophobicContact CB-CG 4.35Å; L441-H443 VanDerWaalsContact C-N 3.35Å; L441-H443 VanDerWaalsContact CB-O 3.24Å; L441-H443 WeakPolarHBondContact CB-O 3.44Å; L441-F449 HydrophobicContact CD1-CD1 3.87Å; L441-F449 HydrophobicContact CD1-CE1 3.52Å; L441-F449 HydrophobicContact CD1-CZ 4.24Å
442	S	91.9	Very high	93.1	Very high	6 Å²	6	21.7 Å²	21.7	4%	0.042	11%	0.111	C	C	.	.	S	Bend	trans	-78.5	-22.4	173.8	52.9	0	0	0	0	112.5	L357 R386 R387 N420	L357-S442 VanDerWaalsContact CD1-CB 3.5Å; R386-S442 WeakPolarHBondContact CA-OG 3.5Å; R386-S442 PolarHBondContact O-OG 3.49Å; R386-S442 VanDerWaalsContact O-OG 3.05Å; R387-S442 PolarHBondContact O-OG 3.13Å; N420-S442 PolarHBondContact ND2-O 3.04Å; N420-S442 PolarHBondContact OD1-O 3.16Å
443	H	90.6	Very high	93.9	Very high	76 Å²	76	20.8 Å²	20.8	35%	0.352	11%	0.106	S	C	.	.			trans	-129.2	167.5	173.4	-69	-90.1	0	0	0	110.9	L441 D448	L441-H443 VanDerWaalsContact C-N 3.35Å; L441-H443 VanDerWaalsContact CB-O 3.24Å; L441-H443 WeakPolarHBondContact CB-O 3.44Å; H443-D448 WeakPolarHBondContact CB-OD2 3.31Å
444	N	89.1	Confident	94.4	Very high	56 Å²	56	22.2 Å²	22.2	30%	0.299	12%	0.115	S	C	.	.			trans	-134	31.4	-176	66.1	-13.7	0	0	0	112.2	D448 F449 N475	N444-D448 PolarHBondContact N-OD2 2.7Å; N444-F449 HydrophobicContact CB-CE2 4.37Å; N444-F449 HydrophobicContact CB-CZ 4.29Å; N444-F449 WeakPolarHBondContact O-CE2 2.95Å; N444-N475 PolarHBondContact O-ND2 2.73Å
445	G	91.9	Very high	94.6	Very high	21 Å²	21	22.6 Å²	22.6	22%	0.216	12%	0.117	C	C	.	.	S	Bend	trans	-78.8	168.4	173.3	0	0	0	0	0	112.2	E447 D448 F449	G445-E447 VanDerWaalsContact C-N 3.27Å; G445-E447 PolarHBondContact O-N 3.44Å; G445-D448 VanDerWaalsContact CA-OD2 3.32Å; G445-D448 WeakPolarHBondContact CA-OD2 3.41Å; G445-D448 PolarHBondContact N-OD2 2.76Å; G445-D448 PolarHBondContact O-N 3Å; G445-F449 WeakPolarHBondContact O-CD2 2.99Å; G445-F449 PolarHBondContact O-N 2.95Å
446	V	94.6	Very high	94.8	Very high	34 Å²	34	22.6 Å²	22.6	21%	0.206	12%	0.117	C	C	.	.	H	α-helix	trans	-57.2	-41.9	177.8	176.4	0	0	0	0	111.5	D448 F449 Y450 N475 V478 A479	V446-D448 VanDerWaalsContact C-N 3.33Å; V446-D448 PolarHBondContact O-N 2.92Å; V446-F449 PolarHBondContact O-N 3.05Å; V446-Y450 VanDerWaalsContact O-CB 3.31Å; V446-Y450 WeakPolarHBondContact O-CB 3.3Å; V446-Y450 PolarHBondContact O-N 3.36Å; V446-N475 HydrophobicContact CG2-CB 3.97Å; V446-V478 HydrophobicContact CG1-CB 4.33Å; V446-V478 HydrophobicContact CG1-CG1 3.75Å; V446-V478 HydrophobicContact CG2-CB 4.22Å; V446-V478 HydrophobicContact CG2-CG1 4.12Å; V446-A479 HydrophobicContact CG1-CB 4.25Å; V446-A479 WeakPolarHBondContact O-CB 3.46Å
447	E	94.7	Very high	94.8	Very high	90 Å²	90	26.1 Å²	26.1	42%	0.421	13%	0.132	S	C	.	.	H	α-helix	trans	-65.9	-33.9	-178.8	-58.1	-49.2	121.1	0	0	112.5	G445 Y450 E451 R482	G445-E447 VanDerWaalsContact C-N 3.27Å; G445-E447 PolarHBondContact O-N 3.44Å; E447-Y450 PolarHBondContact O-N 3Å; E447-E451 WeakPolarHBondContact O-CB 3.3Å; E447-E451 PolarHBondContact O-N 3.43Å; E447-R482 VanDerWaalsContact CD-NH1 3.26Å; E447-R482 IonicContact OE1-NH1 2.78Å; E447-R482 PolarHBondContact OE1-NH1 2.95Å; E447-R482 IonicContact OE2-CZ 2.63Å; E447-R482 IonicContact OE2-NH1 3.05Å; E447-R482 PolarHBondContact OE2-NH1 3Å; E447-R482 IonicContact OE2-NH2 2.68Å
448	D	94	Very high	94.8	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-67.6	-41.6	-179.2	-49.7	-63.3	0	0	0	111	R386 M388 H443 N444 G445 V446 L452	R386-D448 VanDerWaalsContact CD-OD1 3.31Å; R386-D448 WeakPolarHBondContact CD-OD1 3.4Å; R386-D448 IonicContact NH1-OD1 3.87Å; M388-D448 HydrophobicContact CE-CB 4.24Å; H443-D448 WeakPolarHBondContact CB-OD2 3.31Å; N444-D448 PolarHBondContact N-OD2 2.7Å; G445-D448 VanDerWaalsContact CA-OD2 3.32Å; G445-D448 WeakPolarHBondContact CA-OD2 3.41Å; G445-D448 PolarHBondContact N-OD2 2.76Å; G445-D448 PolarHBondContact O-N 3Å; V446-D448 VanDerWaalsContact C-N 3.33Å; V446-D448 PolarHBondContact O-N 2.92Å; D448-L452 PolarHBondContact O-N 2.82Å; D448-L452 VanDerWaalsContact O-N 3.1Å
449	F	95.3	Very high	94.8	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-69.8	-37.9	173.1	-64.5	-64.9	0	0	0	112.2	Q421 F423 L441 N444 G445 V446 E451 L452 L453 Q473 N475 A479	Q421-F449 VanDerWaalsContact NE2-CZ 3.29Å; F423-F449 HydrophobicContact CD2-CD1 4.1Å; F423-F449 AromaticContact CD2-CE1 3.48Å; F423-F449 HydrophobicContact CD2-CE1 3.48Å; F423-F449 VanDerWaalsContact CD2-CE1 3.48Å; F423-F449 HydrophobicContact CD2-CZ 4.47Å; F423-F449 HydrophobicContact CE2-CD1 4.04Å; F423-F449 AromaticContact CE2-CE1 3.69Å; F423-F449 HydrophobicContact CE2-CE1 3.69Å; F423-F449 HydrophobicContact CG-CD1 4.36Å; F423-F449 HydrophobicContact CG-CE1 4.01Å; F423-F449 HydrophobicContact CZ-CD1 4.27Å; F423-F449 HydrophobicContact CZ-CE1 4.36Å; L441-F449 HydrophobicContact CD1-CD1 3.87Å; L441-F449 HydrophobicContact CD1-CE1 3.52Å; L441-F449 HydrophobicContact CD1-CZ 4.24Å; N444-F449 HydrophobicContact CB-CE2 4.37Å; N444-F449 HydrophobicContact CB-CZ 4.29Å; N444-F449 WeakPolarHBondContact O-CE2 2.95Å; G445-F449 WeakPolarHBondContact O-CD2 2.99Å; G445-F449 PolarHBondContact O-N 2.95Å; V446-F449 PolarHBondContact O-N 3.05Å; F449-E451 VanDerWaalsContact C-N 3.35Å; F449-L452 WeakPolarHBondContact O-CB 3.44Å; F449-L452 PolarHBondContact O-N 3.28Å; F449-L453 WeakPolarHBondContact O-CG 3.48Å; F449-L453 PolarHBondContact O-N 3.44Å; F449-Q473 VanDerWaalsContact CZ-CD 3.5Å; F449-N475 HydrophobicContact CD2-CB 4.1Å; F449-N475 HydrophobicContact CE2-CB 3.96Å; F449-A479 HydrophobicContact CB-CB 3.41Å; F449-A479 VanDerWaalsContact CB-CB 3.41Å
450	Y	96.5	Very high	94.9	Very high	70 Å²	70	37.1 Å²	37.1	28%	0.275	20%	0.195	S	C	.	.	H	α-helix	trans	-66.1	-40.5	179.3	-177.4	-106.3	0	0	0	111.1	V446 E447 L453 T454 R482 A483	V446-Y450 VanDerWaalsContact O-CB 3.31Å; V446-Y450 WeakPolarHBondContact O-CB 3.3Å; V446-Y450 PolarHBondContact O-N 3.36Å; E447-Y450 PolarHBondContact O-N 3Å; Y450-L453 PolarHBondContact O-N 3.45Å; Y450-T454 WeakPolarHBondContact O-CB 3.37Å; Y450-T454 PolarHBondContact O-N 3.45Å; Y450-T454 PolarHBondContact O-OG1 3.23Å; Y450-R482 HydrophobicContact CD2-CB 4.05Å; Y450-R482 HydrophobicContact CD2-CG 3.86Å; Y450-R482 HydrophobicContact CE2-CB 4.1Å; Y450-R482 HydrophobicContact CE2-CG 3.57Å; Y450-A483 HydrophobicContact CD2-CB 4.16Å; Y450-A483 HydrophobicContact CE2-CB 4.11Å
451	E	96	Very high	94.9	Very high	56 Å²	56	42.3 Å²	42.3	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-47.4	173.1	-177.5	175.2	171.6	0	0	111	Y378 S380 M388 E447 F449 L453 T454 V455	Y378-E451 PolarHBondContact OH-OE1 2.94Å; S380-E451 WeakPolarHBondContact CB-OE1 3.41Å; M388-E451 HydrophobicContact CE-CB 3.88Å; M388-E451 HydrophobicContact CE-CG 3.89Å; M388-E451 WeakPolarHBondContact CE-OE2 3.21Å; M388-E451 HydrophobicContact SD-CB 4.37Å; M388-E451 HydrophobicContact SD-CG 4.08Å; E447-E451 WeakPolarHBondContact O-CB 3.3Å; E447-E451 PolarHBondContact O-N 3.43Å; F449-E451 VanDerWaalsContact C-N 3.35Å; E451-L453 VanDerWaalsContact C-N 3.31Å; E451-L453 PolarHBondContact O-N 3.35Å; E451-T454 CarbonylContact O-C 3.53Å; E451-T454 WeakPolarHBondContact O-CA 3.45Å; E451-T454 WeakPolarHBondContact O-CB 3.3Å; E451-T454 PolarHBondContact O-N 3.19Å; E451-V455 WeakPolarHBondContact O-CG2 3.45Å; E451-V455 PolarHBondContact O-N 3.06Å
452	L	96.4	Very high	95	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-51.2	-48.8	172.9	165.2	61.8	0	0	0	112.3	V390 F423 V437 A439 D448 F449 T454 V455 L456	V390-L452 HydrophobicContact CB-CD1 4.12Å; V390-L452 HydrophobicContact CG1-CD1 3.39Å; V390-L452 HydrophobicContact CG2-CD1 3.54Å; F423-L452 HydrophobicContact CB-CD2 4.47Å; F423-L452 HydrophobicContact CD1-CD2 3.42Å; F423-L452 VanDerWaalsContact CD1-CD2 3.42Å; F423-L452 HydrophobicContact CE1-CD2 3.94Å; F423-L452 HydrophobicContact CG-CD2 4.24Å; V437-L452 HydrophobicContact CG1-CD1 4.43Å; A439-L452 HydrophobicContact CB-CD1 3.68Å; A439-L452 HydrophobicContact CB-CD2 3.74Å; A439-L452 HydrophobicContact CB-CG 4.32Å; D448-L452 PolarHBondContact O-N 2.82Å; D448-L452 VanDerWaalsContact O-N 3.1Å; F449-L452 WeakPolarHBondContact O-CB 3.44Å; F449-L452 PolarHBondContact O-N 3.28Å; L452-T454 VanDerWaalsContact C-N 3.3Å; L452-T454 PolarHBondContact O-N 3.3Å; L452-V455 WeakPolarHBondContact O-CB 3.15Å; L452-V455 PolarHBondContact O-N 3.22Å; L452-L456 PolarHBondContact O-N 2.9Å
453	L	97.6	Very high	95.3	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-68.7	-32	179.2	-62.8	176.6	0	0	0	112	M408 I425 F449 Y450 E451 L456 K457 I480 A483 F484	M408-L453 HydrophobicContact CE-CD2 3.94Å; I425-L453 HydrophobicContact CD1-CD2 4.25Å; F449-L453 WeakPolarHBondContact O-CG 3.48Å; F449-L453 PolarHBondContact O-N 3.44Å; Y450-L453 PolarHBondContact O-N 3.45Å; E451-L453 VanDerWaalsContact C-N 3.31Å; E451-L453 PolarHBondContact O-N 3.35Å; L453-L456 PolarHBondContact O-N 2.77Å; L453-K457 PolarHBondContact O-N 3.14Å; L453-I480 HydrophobicContact CD1-CB 4.36Å; L453-I480 HydrophobicContact CD1-CG1 3.92Å; L453-A483 HydrophobicContact CB-CB 3.9Å; L453-A483 HydrophobicContact CD1-CB 3.7Å; L453-A483 HydrophobicContact CG-CB 4.46Å; L453-F484 HydrophobicContact CB-CE2 4.36Å; L453-F484 HydrophobicContact CD1-CE2 4.3Å; L453-F484 HydrophobicContact CD2-CE2 4.25Å
454	T	96.9	Very high	95.6	Very high	41 Å²	41	45 Å²	45	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-67.1	-40.1	175.3	-59.6	0	0	0	0	111.7	Y450 E451 L452 L456 K457 N458	Y450-T454 WeakPolarHBondContact O-CB 3.37Å; Y450-T454 PolarHBondContact O-N 3.45Å; Y450-T454 PolarHBondContact O-OG1 3.23Å; E451-T454 CarbonylContact O-C 3.53Å; E451-T454 WeakPolarHBondContact O-CA 3.45Å; E451-T454 WeakPolarHBondContact O-CB 3.3Å; E451-T454 PolarHBondContact O-N 3.19Å; L452-T454 VanDerWaalsContact C-N 3.3Å; L452-T454 PolarHBondContact O-N 3.3Å; T454-L456 VanDerWaalsContact C-N 3.27Å; T454-L456 PolarHBondContact O-N 2.86Å; T454-K457 PolarHBondContact O-N 3.44Å; T454-N458 WeakPolarHBondContact O-CB 3.4Å; T454-N458 PolarHBondContact O-N 2.91Å; T454-N458 PolarHBondContact O-ND2 2.82Å
455	V	96.9	Very high	95.9	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.055	25%	0.245	C	C	.	.	H	α-helix	trans	-55.9	-45.4	173.5	169	0	0	0	0	110.5	Y378 V390 Y392 E451 L452 N458 A459	Y378-V455 HydrophobicContact CD1-CB 4.43Å; Y378-V455 HydrophobicContact CD1-CG1 4.03Å; Y378-V455 HydrophobicContact CD1-CG2 3.53Å; Y378-V455 HydrophobicContact CD2-CG1 3.82Å; Y378-V455 HydrophobicContact CD2-CG2 3.87Å; Y378-V455 HydrophobicContact CE1-CG2 3.37Å; Y378-V455 HydrophobicContact CE2-CG1 4.49Å; Y378-V455 HydrophobicContact CE2-CG2 3.75Å; Y378-V455 HydrophobicContact CG-CB 4.34Å; Y378-V455 HydrophobicContact CG-CG1 3.55Å; Y378-V455 HydrophobicContact CG-CG2 3.77Å; Y378-V455 VanDerWaalsContact CZ-CG2 3.49Å; V390-V455 HydrophobicContact CB-CG1 4.39Å; V390-V455 HydrophobicContact CG2-CG1 4.44Å; Y392-V455 HydrophobicContact CE1-CG1 4.32Å; E451-V455 WeakPolarHBondContact O-CG2 3.45Å; E451-V455 PolarHBondContact O-N 3.06Å; L452-V455 WeakPolarHBondContact O-CB 3.15Å; L452-V455 PolarHBondContact O-N 3.22Å; V455-N458 PolarHBondContact O-N 2.96Å; V455-A459 WeakPolarHBondContact O-CB 3.43Å; V455-A459 PolarHBondContact O-N 2.81Å
456	L	97.5	Very high	96.1	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-42.8	178.8	-61.7	175.5	0	0	0	112	V390 Y392 L397 I425 V437 L452 L453 T454 N458 A459 E460 L463	V390-L456 HydrophobicContact CG1-CD2 4.5Å; Y392-L456 HydrophobicContact CD1-CD2 4.13Å; Y392-L456 HydrophobicContact CE1-CD2 4.47Å; Y392-L456 HydrophobicContact CG-CD2 4.35Å; L397-L456 HydrophobicContact CD2-CD2 4.19Å; I425-L456 HydrophobicContact CD1-CD1 3.48Å; I425-L456 VanDerWaalsContact CD1-CD1 3.48Å; V437-L456 HydrophobicContact CG1-CD1 4.38Å; V437-L456 HydrophobicContact CG1-CD2 4.18Å; V437-L456 HydrophobicContact CG2-CD1 4.07Å; V437-L456 HydrophobicContact CG2-CD2 3.9Å; L452-L456 PolarHBondContact O-N 2.9Å; L453-L456 PolarHBondContact O-N 2.77Å; T454-L456 VanDerWaalsContact C-N 3.27Å; T454-L456 PolarHBondContact O-N 2.86Å; L456-N458 VanDerWaalsContact C-N 3.3Å; L456-N458 PolarHBondContact O-N 3.13Å; L456-A459 WeakPolarHBondContact O-CB 3.24Å; L456-A459 PolarHBondContact O-N 2.87Å; L456-A459 VanDerWaalsContact O-N 3.12Å; L456-E460 PolarHBondContact O-N 3.47Å; L456-L463 HydrophobicContact CB-CD1 3.93Å; L456-L463 WeakPolarHBondContact O-CD1 3.04Å
457	K	96.3	Very high	96	Very high	73 Å²	73	46.4 Å²	46.4	32%	0.317	26%	0.256	S	S	.	.	H	α-helix	trans	-61.8	-35.8	175.1	-78.9	-170.2	166.7	-158.8	0	113.7	L453 T454 A459 E460 S461 A483 F484	L453-K457 PolarHBondContact O-N 3.14Å; T454-K457 PolarHBondContact O-N 3.44Å; K457-A459 VanDerWaalsContact C-N 3.3Å; K457-E460 CarbonylContact C-O 3.59Å; K457-E460 WeakPolarHBondContact CA-O 3.33Å; K457-E460 CarbonylContact O-C 3.57Å; K457-E460 VanDerWaalsContact O-O 3.11Å; K457-S461 WeakPolarHBondContact O-CA 3.44Å; K457-S461 PolarHBondContact O-N 3.15Å; K457-A483 WeakPolarHBondContact CE-O 3.48Å; K457-A483 PolarHBondContact NZ-O 3.33Å; K457-F484 HydrophobicContact CD-CE1 4.23Å; K457-F484 HydrophobicContact CD-CZ 4.33Å; K457-F484 VanDerWaalsContact CE-CZ 3.47Å; K457-F484 HydrophobicContact CG-CE1 4.19Å; K457-F484 HydrophobicContact CG-CZ 4.04Å
458	N	96.8	Very high	96	Very high	135 Å²	135	42.1 Å²	42.1	72%	0.722	24%	0.236	S	C	*	.	H	α-helix	trans	-72.5	-29.8	176.5	-69.5	-16.9	0	0	0	111.4	T454 V455 L456	T454-N458 WeakPolarHBondContact O-CB 3.4Å; T454-N458 PolarHBondContact O-N 2.91Å; T454-N458 PolarHBondContact O-ND2 2.82Å; V455-N458 PolarHBondContact O-N 2.96Å; L456-N458 VanDerWaalsContact C-N 3.3Å; L456-N458 PolarHBondContact O-N 3.13Å
459	A	96.1	Very high	95.7	Very high	39 Å²	39	42 Å²	42	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-76.6	-38.8	175.2	0	0	0	0	0	112.2	Y392 L397 V455 L456 K457	Y392-A459 HydrophobicContact CE2-CB 4.01Å; Y392-A459 WeakPolarHBondContact OH-CB 3.49Å; L397-A459 HydrophobicContact CD1-CB 3.91Å; L397-A459 HydrophobicContact CD2-CB 4.45Å; V455-A459 WeakPolarHBondContact O-CB 3.43Å; V455-A459 PolarHBondContact O-N 2.81Å; L456-A459 WeakPolarHBondContact O-CB 3.24Å; L456-A459 PolarHBondContact O-N 2.87Å; L456-A459 VanDerWaalsContact O-N 3.12Å; K457-A459 VanDerWaalsContact C-N 3.3Å
460	E	96	Very high	95.4	Very high	60 Å²	60	41.9 Å²	41.9	28%	0.28	24%	0.235	S	C	.	.			trans	-142.6	113.2	172.8	-177.8	51.6	-98.7	0	0	110.3	L397 L456 K457 S462 L463	L397-E460 HydrophobicContact CB-CB 4.39Å; L397-E460 HydrophobicContact CD1-CB 4.28Å; L397-E460 HydrophobicContact CD2-CB 4.44Å; L456-E460 PolarHBondContact O-N 3.47Å; K457-E460 CarbonylContact C-O 3.59Å; K457-E460 WeakPolarHBondContact CA-O 3.33Å; K457-E460 CarbonylContact O-C 3.57Å; K457-E460 VanDerWaalsContact O-O 3.11Å; E460-S462 WeakPolarHBondContact CG-OG 3.48Å; E460-S462 PolarHBondContact OE1-N 2.78Å; E460-S462 PolarHBondContact OE1-OG 2.83Å; E460-S462 VanDerWaalsContact OE1-OG 3.08Å; E460-L463 HydrophobicContact CB-CD1 4.14Å; E460-L463 HydrophobicContact CB-CD2 4.38Å; E460-L463 HydrophobicContact CB-CG 3.88Å; E460-L463 HydrophobicContact CG-CD2 4.19Å; E460-L463 HydrophobicContact CG-CG 3.97Å; E460-L463 VanDerWaalsContact O-CG 3.31Å; E460-L463 WeakPolarHBondContact O-CG 3.35Å
461	S	95.2	Very high	94.5	Very high	108 Å²	108	39 Å²	39	76%	0.755	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-19.8	-173	65.5	0	0	0	0	113.4	K457 L463	K457-S461 WeakPolarHBondContact O-CA 3.44Å; K457-S461 PolarHBondContact O-N 3.15Å; S461-L463 VanDerWaalsContact C-N 3.27Å; S461-L463 PolarHBondContact O-N 2.79Å
462	S	95.7	Very high	93.3	Very high	50 Å²	50	36.9 Å²	36.9	35%	0.35	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.6	178.6	64.5	0	0	0	0	113.8	E401 E460 S464	E401-S462 VanDerWaalsContact OE1-CB 3.27Å; E401-S462 WeakPolarHBondContact OE1-CB 3.43Å; E401-S462 PolarHBondContact OE1-OG 3.03Å; E460-S462 WeakPolarHBondContact CG-OG 3.48Å; E460-S462 PolarHBondContact OE1-N 2.78Å; E460-S462 PolarHBondContact OE1-OG 2.83Å; E460-S462 VanDerWaalsContact OE1-OG 3.08Å; S462-S464 PolarHBondContact O-N 2.8Å; S462-S464 VanDerWaalsContact O-N 3.1Å
463	L	97.1	Very high	92.5	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.026	22%	0.218	C	C	.	.			trans	-56	118.7	179.4	-64.9	178.9	0	0	0	110.9	L397 L400 E401 W406 L456 E460 S461 F484	L397-L463 HydrophobicContact CD2-CD1 4.29Å; L400-L463 HydrophobicContact CB-CD2 3.83Å; E401-L463 HydrophobicContact CB-CD2 4.11Å; W406-L463 HydrophobicContact CH2-CB 4.1Å; W406-L463 HydrophobicContact CH2-CD1 4.28Å; W406-L463 HydrophobicContact CH2-CD2 4.47Å; W406-L463 HydrophobicContact CZ2-CB 4.27Å; W406-L463 HydrophobicContact CZ2-CD2 4.12Å; L456-L463 HydrophobicContact CB-CD1 3.93Å; L456-L463 WeakPolarHBondContact O-CD1 3.04Å; E460-L463 HydrophobicContact CB-CD1 4.14Å; E460-L463 HydrophobicContact CB-CD2 4.38Å; E460-L463 HydrophobicContact CB-CG 3.88Å; E460-L463 HydrophobicContact CG-CD2 4.19Å; E460-L463 HydrophobicContact CG-CG 3.97Å; E460-L463 VanDerWaalsContact O-CG 3.31Å; E460-L463 WeakPolarHBondContact O-CG 3.35Å; S461-L463 VanDerWaalsContact C-N 3.27Å; S461-L463 PolarHBondContact O-N 2.79Å; L463-F484 VanDerWaalsContact O-CE1 3.32Å; L463-F484 WeakPolarHBondContact O-CE1 3.39Å
464	S	96.4	Very high	91.8	Very high	84 Å²	84	41.1 Å²	41.1	59%	0.587	24%	0.238	S	C	*	.			trans	-147.6	81.6	178.9	-178.3	0	0	0	0	110.4	S462 E466	S462-S464 PolarHBondContact O-N 2.8Å; S462-S464 VanDerWaalsContact O-N 3.1Å; S464-E466 PolarHBondContact O-N 3.29Å
465	P	96.8	Very high	91.4	Very high	4 Å²	4	42 Å²	42	3%	0.026	24%	0.242	C	C	.	.			trans	-62.3	133.8	175.5	26.4	-33.2	0	0	0	111	P404 W406 V468 F484 V487	P404-P465 CarbonylContact O-C 3.41Å; P404-P465 WeakPolarHBondContact O-CA 3.41Å; W406-P465 HydrophobicContact CD2-CB 3.68Å; W406-P465 HydrophobicContact CD2-CG 4.09Å; W406-P465 HydrophobicContact CE3-CB 4.03Å; W406-P465 HydrophobicContact CE3-CG 3.93Å; W406-P465 HydrophobicContact CG-CB 4.04Å; W406-P465 HydrophobicContact CH2-CB 4.47Å; W406-P465 HydrophobicContact CH2-CG 4Å; W406-P465 HydrophobicContact CZ2-CB 4.13Å; W406-P465 HydrophobicContact CZ2-CG 4.12Å; W406-P465 HydrophobicContact CZ3-CB 4.42Å; W406-P465 HydrophobicContact CZ3-CG 3.9Å; P465-V468 HydrophobicContact CB-CG2 4.01Å; P465-V468 HydrophobicContact CG-CG2 4.28Å; P465-F484 VanDerWaalsContact CD-CD1 3.48Å; P465-F484 HydrophobicContact CG-CB 4.26Å; P465-F484 HydrophobicContact CG-CD1 3.98Å; P465-F484 HydrophobicContact CG-CD2 3.81Å; P465-F484 HydrophobicContact CG-CE1 4.22Å; P465-F484 HydrophobicContact CG-CE2 4.08Å; P465-F484 HydrophobicContact CG-CG 3.75Å; P465-F484 HydrophobicContact CG-CZ 4.27Å; P465-V487 HydrophobicContact CB-CG2 4.22Å; P465-V487 HydrophobicContact CG-CG2 4.27Å; P465-V487 WeakPolarHBondContact O-CG2 3.4Å
466	E	95.4	Very high	91.2	Very high	120 Å²	120	41.6 Å²	41.6	56%	0.561	24%	0.239	S	C	*	.	S	Bend	trans	-82.9	-39.9	171.4	-67.3	172.2	-170.1	0	0	110.6	P404 S464 V487 E488	P404-E466 HydrophobicContact CB-CB 3.93Å; P404-E466 HydrophobicContact CB-CG 3.7Å; P404-E466 HydrophobicContact CG-CG 4.34Å; P404-E466 PolarHBondContact O-N 2.92Å; S464-E466 PolarHBondContact O-N 3.29Å; E466-V487 CarbonylContact O-C 3.56Å; E466-E488 PolarHBondContact O-N 2.76Å
467	N	93.1	Very high	90.8	Very high	17 Å²	17	42.5 Å²	42.5	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.1	-173.5	-58.5	-68.9	0	0	0	109.8	P404 T405 W406 E488 Y490 Y605	P404-N467 PolarHBondContact O-N 3.11Å; P404-N467 VanDerWaalsContact O-N 3.13Å; T405-N467 CarbonylContact C-O 3.6Å; T405-N467 VanDerWaalsContact CA-O 3.28Å; T405-N467 WeakPolarHBondContact CA-O 3.26Å; T405-N467 HydrophobicContact CG2-CB 4.1Å; W406-N467 PolarHBondContact N-O 2.9Å; N467-E488 CarbonylContact C-O 3.56Å; N467-E488 WeakPolarHBondContact CA-O 3.36Å; N467-Y490 HydrophobicContact CB-CD2 4.32Å; N467-Y490 HydrophobicContact CB-CE2 4.01Å; N467-Y490 WeakPolarHBondContact OD1-CE2 3.38Å; N467-Y605 PolarHBondContact ND2-OH 3.49Å
468	V	93.2	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120	173.4	170.9	0	0	0	0	109.7	W406 M408 P465 I480 V487 E488 L489 Y490	W406-V468 HydrophobicContact CB-CG2 4.17Å; W406-V468 CarbonylContact O-C 3.55Å; W406-V468 WeakPolarHBondContact O-CA 3.43Å; M408-V468 HydrophobicContact CE-CG1 4.14Å; M408-V468 HydrophobicContact CE-CG2 4.17Å; M408-V468 HydrophobicContact CG-CG1 4.01Å; M408-V468 HydrophobicContact SD-CG1 3.96Å; P465-V468 HydrophobicContact CB-CG2 4.01Å; P465-V468 HydrophobicContact CG-CG2 4.28Å; V468-I480 HydrophobicContact CB-CG2 4.35Å; V468-I480 HydrophobicContact CG1-CD1 3.97Å; V468-I480 HydrophobicContact CG1-CG2 4.35Å; V468-I480 HydrophobicContact CG2-CG2 4.21Å; V468-V487 HydrophobicContact CB-CG2 3.96Å; V468-V487 HydrophobicContact CG2-CG2 3.48Å; V468-V487 VanDerWaalsContact CG2-CG2 3.48Å; V468-E488 PolarHBondContact N-O 3.41Å; V468-L489 HydrophobicContact CB-CD2 3.9Å; V468-L489 HydrophobicContact CG1-CD2 4.08Å; V468-L489 WeakPolarHBondContact O-CA 3.37Å; V468-Y490 PolarHBondContact O-N 2.89Å
469	I	89.4	Confident	90.6	Very high	1 Å²	1	36 Å²	36	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.3	174.2	-57	164.1	0	0	0	107.8	T405 W406 L407 M408 Y490 M600 Y605 V609	T405-I469 HydrophobicContact CG2-CD1 4.08Å; W406-I469 PolarHBondContact O-N 3.2Å; L407-I469 CarbonylContact C-O 3.54Å; L407-I469 WeakPolarHBondContact CA-O 3.47Å; L407-I469 HydrophobicContact CD2-CB 4.07Å; L407-I469 HydrophobicContact CD2-CD1 3.93Å; L407-I469 HydrophobicContact CD2-CG2 4.19Å; L407-I469 HydrophobicContact CG-CB 4.19Å; L407-I469 HydrophobicContact CG-CD1 4.21Å; M408-I469 PolarHBondContact N-O 3.12Å; I469-Y490 CarbonylContact C-O 3.59Å; I469-Y490 WeakPolarHBondContact CA-O 3.33Å; I469-Y490 HydrophobicContact CG1-CD2 4.43Å; I469-M600 HydrophobicContact CG2-SD 4.28Å; I469-Y605 HydrophobicContact CD1-CD1 4.1Å; I469-Y605 HydrophobicContact CD1-CD2 4.34Å; I469-Y605 HydrophobicContact CD1-CG 3.85Å; I469-V609 HydrophobicContact CD1-CG2 4.39Å; I469-V609 HydrophobicContact CG2-CG2 3.91Å
470	T	88	Confident	90.5	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	176.2	-177.7	-165.4	0	0	0	0	113.3	M408 Q477 I480 Y490 T491 C492	M408-T470 VanDerWaalsContact O-CA 3.26Å; M408-T470 WeakPolarHBondContact O-CA 3.45Å; M408-T470 WeakPolarHBondContact O-CB 3.41Å; M408-T470 PolarHBondContact O-OG1 2.89Å; T470-Q477 HydrophobicContact CG2-CG 3.89Å; T470-I480 HydrophobicContact CG2-CD1 4.27Å; T470-Y490 PolarHBondContact N-O 3.21Å; T470-T491 VanDerWaalsContact O-CA 3.23Å; T470-T491 WeakPolarHBondContact O-CA 3.34Å; T470-C492 PolarHBondContact O-N 3.48Å; T470-C492 VanDerWaalsContact O-N 3.08Å
471	D	77.8	Confident	90.4	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.053	21%	0.205	C	C	.	.			trans	-80.8	178.5	177.6	-74.1	-5	0	0	0	111.4	C409 Q473 Q477 C492 H495	C409-D471 PolarHBondContact SG-OD2 2.83Å; D471-Q473 PolarHBondContact O-N 3.44Å; D471-Q477 PolarHBondContact O-NE2 2.87Å; D471-C492 PolarHBondContact OD1-SG 3.4Å; D471-H495 IonicContact OD2-CE1 3.31Å
472	F	70.6	Confident	90.5	Very high	11 Å²	11	36.2 Å²	36.2	5%	0.048	19%	0.191	C	C	.	.	S	Bend	trans	-73	15.6	-176.7	-79.8	-82.3	0	0	0	115.8	V474 C492 H495 F590 M594 W595	F472-V474 PolarHBondContact O-N 3.13Å; F472-C492 WeakPolarHBondContact CE2-O 3.4Å; F472-H495 HydrophobicContact CB-CB 4.23Å; F472-H495 HydrophobicContact CD2-CB 3.39Å; F472-H495 AromaticContact CD2-CG 3.76Å; F472-H495 AromaticContact CD2-ND1 3.77Å; F472-H495 HydrophobicContact CE2-CB 3.99Å; F472-H495 HydrophobicContact CG-CB 4.09Å; F472-F590 HydrophobicContact CB-CE1 4.3Å; F472-F590 AromaticContact CD1-CD1 3.88Å; F472-F590 HydrophobicContact CD1-CD1 3.88Å; F472-F590 HydrophobicContact CD1-CE1 4.28Å; F472-F590 HydrophobicContact CD1-CG 4.35Å; F472-M594 HydrophobicContact CD1-CG 3.85Å; F472-M594 HydrophobicContact CD1-SD 3.99Å; F472-M594 HydrophobicContact CE1-CG 4.08Å; F472-M594 WeakPolarHBondContact CE1-O 3.41Å; F472-M594 WeakPolarHBondContact CZ-O 3.19Å; F472-W595 HydrophobicContact CE1-CB 3.52Å; F472-W595 HydrophobicContact CZ-CB 3.42Å; F472-W595 VanDerWaalsContact CZ-CB 3.42Å
473	Q	79.5	Confident	90.5	Very high	20 Å²	20	34 Å²	34	9%	0.093	18%	0.176	C	C	.	.			trans	-78.4	108.2	-176.4	-171.5	-176.8	38.4	0	0	110.6	E410 Y412 F449 D471 N475 S476 Q477	E410-Q473 PolarHBondContact OE2-NE2 2.85Å; E410-Q473 PolarHBondContact OE2-OE1 2.85Å; Y412-Q473 PolarHBondContact OH-NE2 2.86Å; F449-Q473 VanDerWaalsContact CZ-CD 3.5Å; D471-Q473 PolarHBondContact O-N 3.44Å; Q473-N475 VanDerWaalsContact C-N 3.26Å; Q473-N475 HydrophobicContact CG-CB 4.47Å; Q473-N475 PolarHBondContact O-N 3.01Å; Q473-S476 PolarHBondContact O-N 3.02Å; Q473-S476 PolarHBondContact O-OG 2.96Å; Q473-S476 PolarHBondContact OE1-OG 3.23Å; Q473-Q477 WeakPolarHBondContact O-CG 3.48Å; Q473-Q477 PolarHBondContact O-N 2.86Å
474	V	82.8	Confident	90.5	Very high	73 Å²	73	34.3 Å²	34.3	44%	0.442	18%	0.177	S	C	.	.	H	α-helix	trans	-57	-40.7	-178.8	-179.2	0	0	0	0	111.8	F472 S476 Q477 V478 M594	F472-V474 PolarHBondContact O-N 3.13Å; V474-S476 PolarHBondContact O-N 3.4Å; V474-Q477 PolarHBondContact O-N 2.9Å; V474-V478 HydrophobicContact CG1-CG2 4.17Å; V474-V478 VanDerWaalsContact O-CG2 3.25Å; V474-V478 WeakPolarHBondContact O-CG2 3.48Å; V474-V478 PolarHBondContact O-N 3.11Å; V474-M594 HydrophobicContact CG2-CE 4.05Å
475	N	89.9	Confident	90.5	Very high	60 Å²	60	34.5 Å²	34.5	32%	0.321	18%	0.176	S	C	.	.	H	α-helix	trans	-63.8	-42.6	-176.7	-68.2	-10.7	0	0	0	112.8	N444 V446 F449 Q473 A479	N444-N475 PolarHBondContact O-ND2 2.73Å; V446-N475 HydrophobicContact CG2-CB 3.97Å; F449-N475 HydrophobicContact CD2-CB 4.1Å; F449-N475 HydrophobicContact CE2-CB 3.96Å; Q473-N475 VanDerWaalsContact C-N 3.26Å; Q473-N475 HydrophobicContact CG-CB 4.47Å; Q473-N475 PolarHBondContact O-N 3.01Å; N475-A479 WeakPolarHBondContact O-CB 3.46Å; N475-A479 PolarHBondContact O-N 3.45Å
476	S	91.1	Very high	90.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-68.9	-42.1	177.6	64.7	0	0	0	0	110.8	Q473 V474 V478 A479 I480	Q473-S476 PolarHBondContact O-N 3.02Å; Q473-S476 PolarHBondContact O-OG 2.96Å; Q473-S476 PolarHBondContact OE1-OG 3.23Å; V474-S476 PolarHBondContact O-N 3.4Å; S476-V478 PolarHBondContact O-N 2.8Å; S476-A479 PolarHBondContact O-N 2.96Å; S476-I480 WeakPolarHBondContact O-CB 3.16Å; S476-I480 VanDerWaalsContact O-CD1 3.32Å; S476-I480 WeakPolarHBondContact O-CD1 3.41Å; S476-I480 WeakPolarHBondContact O-CG1 3.19Å; S476-I480 PolarHBondContact O-N 3.1Å
477	Q	89.9	Confident	90.3	Very high	19 Å²	19	37 Å²	37	9%	0.089	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-42.8	176.6	-68.8	-178.8	18.9	0	0	112.5	T470 D471 Q473 V474 I480 K481 L489	T470-Q477 HydrophobicContact CG2-CG 3.89Å; D471-Q477 PolarHBondContact O-NE2 2.87Å; Q473-Q477 WeakPolarHBondContact O-CG 3.48Å; Q473-Q477 PolarHBondContact O-N 2.86Å; V474-Q477 PolarHBondContact O-N 2.9Å; Q477-I480 PolarHBondContact O-N 2.78Å; Q477-K481 PolarHBondContact O-N 2.69Å; Q477-L489 HydrophobicContact CB-CD1 3.86Å; Q477-L489 HydrophobicContact CG-CD1 4.13Å
478	V	92.1	Very high	90.2	Very high	72 Å²	72	41.1 Å²	41.1	44%	0.436	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-44.8	175.3	172.3	0	0	0	0	110.7	V446 V474 S476 K481 R482	V446-V478 HydrophobicContact CG1-CB 4.33Å; V446-V478 HydrophobicContact CG1-CG1 3.75Å; V446-V478 HydrophobicContact CG2-CB 4.22Å; V446-V478 HydrophobicContact CG2-CG1 4.12Å; V474-V478 HydrophobicContact CG1-CG2 4.17Å; V474-V478 VanDerWaalsContact O-CG2 3.25Å; V474-V478 WeakPolarHBondContact O-CG2 3.48Å; V474-V478 PolarHBondContact O-N 3.11Å; S476-V478 PolarHBondContact O-N 2.8Å; V478-K481 PolarHBondContact O-N 3.43Å; V478-R482 WeakPolarHBondContact O-CB 3.39Å; V478-R482 PolarHBondContact O-N 3.04Å
479	A	95.7	Very high	89.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-41.5	177.3	0	0	0	0	0	112.7	V446 F449 N475 S476 R482 A483	V446-A479 HydrophobicContact CG1-CB 4.25Å; V446-A479 WeakPolarHBondContact O-CB 3.46Å; F449-A479 HydrophobicContact CB-CB 3.41Å; F449-A479 VanDerWaalsContact CB-CB 3.41Å; N475-A479 WeakPolarHBondContact O-CB 3.46Å; N475-A479 PolarHBondContact O-N 3.45Å; S476-A479 PolarHBondContact O-N 2.96Å; A479-R482 PolarHBondContact O-N 2.97Å; A479-A483 WeakPolarHBondContact O-CB 3.37Å; A479-A483 PolarHBondContact O-N 3.17Å
480	I	95.3	Very high	89.7	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-48.8	176.4	-68	156.4	0	0	0	110.2	M408 L453 V468 T470 S476 Q477 R482 A483 F484 V487 L489	M408-I480 HydrophobicContact CE-CG1 4.3Å; M408-I480 HydrophobicContact SD-CD1 3.57Å; M408-I480 VanDerWaalsContact SD-CD1 3.57Å; M408-I480 HydrophobicContact SD-CG1 3.83Å; L453-I480 HydrophobicContact CD1-CB 4.36Å; L453-I480 HydrophobicContact CD1-CG1 3.92Å; V468-I480 HydrophobicContact CB-CG2 4.35Å; V468-I480 HydrophobicContact CG1-CD1 3.97Å; V468-I480 HydrophobicContact CG1-CG2 4.35Å; V468-I480 HydrophobicContact CG2-CG2 4.21Å; T470-I480 HydrophobicContact CG2-CD1 4.27Å; S476-I480 WeakPolarHBondContact O-CB 3.16Å; S476-I480 VanDerWaalsContact O-CD1 3.32Å; S476-I480 WeakPolarHBondContact O-CD1 3.41Å; S476-I480 WeakPolarHBondContact O-CG1 3.19Å; S476-I480 PolarHBondContact O-N 3.1Å; Q477-I480 PolarHBondContact O-N 2.78Å; I480-R482 VanDerWaalsContact C-N 3.33Å; I480-R482 PolarHBondContact O-N 2.62Å; I480-A483 PolarHBondContact O-N 2.79Å; I480-F484 PolarHBondContact O-N 3.06Å; I480-V487 HydrophobicContact CG2-CG1 3.69Å; I480-L489 HydrophobicContact CB-CD2 4.36Å; I480-L489 HydrophobicContact CD1-CD2 4.43Å; I480-L489 HydrophobicContact CG2-CD2 3.72Å
481	K	94.1	Very high	89.2	Confident	89 Å²	89	44.3 Å²	44.3	39%	0.387	22%	0.221	S	C	.	.	H	α-helix	trans	-64.8	-34.6	176.7	-80.6	-70.9	-170.1	177.3	0	113	Q477 V478 F484 P485 V487 L489	Q477-K481 PolarHBondContact O-N 2.69Å; V478-K481 PolarHBondContact O-N 3.43Å; K481-F484 CarbonylContact O-C 3.57Å; K481-P485 VanDerWaalsContact O-CA 3.25Å; K481-P485 WeakPolarHBondContact O-CA 3.43Å; K481-V487 HydrophobicContact CD-CG1 4.16Å; K481-V487 VanDerWaalsContact CE-O 3.28Å; K481-V487 WeakPolarHBondContact CE-O 3.42Å; K481-V487 PolarHBondContact NZ-O 2.8Å; K481-L489 HydrophobicContact CD-CD1 4.4Å; K481-L489 HydrophobicContact CG-CD1 3.71Å; K481-L489 HydrophobicContact CG-CG 4.35Å
482	R	96.8	Very high	89.1	Confident	121 Å²	121	43.9 Å²	43.9	46%	0.457	22%	0.218	S	C	.	.	H	α-helix	trans	-67.8	-40.4	174.5	-173.9	-176.7	172.3	-172	-6.6	111.6	E447 Y450 V478 A479 I480	E447-R482 VanDerWaalsContact CD-NH1 3.26Å; E447-R482 IonicContact OE1-NH1 2.78Å; E447-R482 PolarHBondContact OE1-NH1 2.95Å; E447-R482 IonicContact OE2-CZ 2.63Å; E447-R482 IonicContact OE2-NH1 3.05Å; E447-R482 PolarHBondContact OE2-NH1 3Å; E447-R482 IonicContact OE2-NH2 2.68Å; Y450-R482 HydrophobicContact CD2-CB 4.05Å; Y450-R482 HydrophobicContact CD2-CG 3.86Å; Y450-R482 HydrophobicContact CE2-CB 4.1Å; Y450-R482 HydrophobicContact CE2-CG 3.57Å; V478-R482 WeakPolarHBondContact O-CB 3.39Å; V478-R482 PolarHBondContact O-N 3.04Å; A479-R482 PolarHBondContact O-N 2.97Å; I480-R482 VanDerWaalsContact C-N 3.33Å; I480-R482 PolarHBondContact O-N 2.62Å
483	A	96.5	Very high	89.3	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.033	22%	0.221	C	C	.	.	H	α-helix	trans	-75.2	-41.1	178.8	0	0	0	0	0	112.1	Y450 L453 K457 A479 I480	Y450-A483 HydrophobicContact CD2-CB 4.16Å; Y450-A483 HydrophobicContact CE2-CB 4.11Å; L453-A483 HydrophobicContact CB-CB 3.9Å; L453-A483 HydrophobicContact CD1-CB 3.7Å; L453-A483 HydrophobicContact CG-CB 4.46Å; K457-A483 WeakPolarHBondContact CE-O 3.48Å; K457-A483 PolarHBondContact NZ-O 3.33Å; A479-A483 WeakPolarHBondContact O-CB 3.37Å; A479-A483 PolarHBondContact O-N 3.17Å; I480-A483 PolarHBondContact O-N 2.79Å
484	F	96.4	Very high	88.9	Confident	11 Å²	11	44 Å²	44	5%	0.048	22%	0.221	C	C	.	.			trans	-130.1	83.6	-176.7	-54.7	-75.8	0	0	0	109.7	W406 L453 K457 L463 P465 I480 K481 Q486 V487	W406-F484 HydrophobicContact CH2-CE2 4.44Å; W406-F484 HydrophobicContact CH2-CZ 4.08Å; W406-F484 HydrophobicContact CZ3-CE2 4.07Å; W406-F484 HydrophobicContact CZ3-CZ 4.17Å; L453-F484 HydrophobicContact CB-CE2 4.36Å; L453-F484 HydrophobicContact CD1-CE2 4.3Å; L453-F484 HydrophobicContact CD2-CE2 4.25Å; K457-F484 HydrophobicContact CD-CE1 4.23Å; K457-F484 HydrophobicContact CD-CZ 4.33Å; K457-F484 VanDerWaalsContact CE-CZ 3.47Å; K457-F484 HydrophobicContact CG-CE1 4.19Å; K457-F484 HydrophobicContact CG-CZ 4.04Å; L463-F484 VanDerWaalsContact O-CE1 3.32Å; L463-F484 WeakPolarHBondContact O-CE1 3.39Å; P465-F484 VanDerWaalsContact CD-CD1 3.48Å; P465-F484 HydrophobicContact CG-CB 4.26Å; P465-F484 HydrophobicContact CG-CD1 3.98Å; P465-F484 HydrophobicContact CG-CD2 3.81Å; P465-F484 HydrophobicContact CG-CE1 4.22Å; P465-F484 HydrophobicContact CG-CE2 4.08Å; P465-F484 HydrophobicContact CG-CG 3.75Å; P465-F484 HydrophobicContact CG-CZ 4.27Å; I480-F484 PolarHBondContact O-N 3.06Å; K481-F484 CarbonylContact O-C 3.57Å; F484-Q486 PolarHBondContact O-N 2.91Å; F484-Q486 VanDerWaalsContact O-N 3.15Å; F484-V487 HydrophobicContact CB-CB 3.99Å; F484-V487 HydrophobicContact CB-CG1 4.11Å; F484-V487 WeakPolarHBondContact O-CB 3.45Å; F484-V487 WeakPolarHBondContact O-CG1 3.29Å; F484-V487 PolarHBondContact O-N 3.47Å; F484-V487 VanDerWaalsContact O-N 3.14Å
485	P	95.5	Very high	88.4	Confident	87 Å²	87	43.3 Å²	43.3	57%	0.565	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-32	-174	-28.4	36.6	0	0	0	114.7	K481 V487	K481-P485 VanDerWaalsContact O-CA 3.25Å; K481-P485 WeakPolarHBondContact O-CA 3.43Å; P485-V487 VanDerWaalsContact C-N 3.35Å
486	Q	94.4	Very high	87.9	Confident	176 Å²	176	40.5 Å²	40.5	82%	0.822	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-5.7	-176.9	-54.3	-58.8	-6.3	0	0	114.3	F484	F484-Q486 PolarHBondContact O-N 2.91Å; F484-Q486 VanDerWaalsContact O-N 3.15Å
487	V	93.9	Very high	87.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-69.4	135.3	-175.7	73.7	0	0	0	0	111.6	P465 E466 V468 I480 K481 F484 P485 L489	P465-V487 HydrophobicContact CB-CG2 4.22Å; P465-V487 HydrophobicContact CG-CG2 4.27Å; P465-V487 WeakPolarHBondContact O-CG2 3.4Å; E466-V487 CarbonylContact O-C 3.56Å; V468-V487 HydrophobicContact CB-CG2 3.96Å; V468-V487 HydrophobicContact CG2-CG2 3.48Å; V468-V487 VanDerWaalsContact CG2-CG2 3.48Å; I480-V487 HydrophobicContact CG2-CG1 3.69Å; K481-V487 HydrophobicContact CD-CG1 4.16Å; K481-V487 VanDerWaalsContact CE-O 3.28Å; K481-V487 WeakPolarHBondContact CE-O 3.42Å; K481-V487 PolarHBondContact NZ-O 2.8Å; F484-V487 HydrophobicContact CB-CB 3.99Å; F484-V487 HydrophobicContact CB-CG1 4.11Å; F484-V487 WeakPolarHBondContact O-CB 3.45Å; F484-V487 WeakPolarHBondContact O-CG1 3.29Å; F484-V487 PolarHBondContact O-N 3.47Å; F484-V487 VanDerWaalsContact O-N 3.14Å; P485-V487 VanDerWaalsContact C-N 3.35Å; V487-L489 HydrophobicContact CG1-CD2 4.38Å
488	E	90.5	Very high	86.8	Confident	104 Å²	104	43.5 Å²	43.5	49%	0.486	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	129.5	167.7	-65	-167.7	162.6	0	0	110.1	E466 N467 V468 Y490	E466-E488 PolarHBondContact O-N 2.76Å; N467-E488 CarbonylContact C-O 3.56Å; N467-E488 WeakPolarHBondContact CA-O 3.36Å; V468-E488 PolarHBondContact N-O 3.41Å; E488-Y490 HydrophobicContact CB-CE2 3.93Å; E488-Y490 PolarHBondContact OE2-OH 2.95Å
489	L	87.9	Confident	86.6	Confident	37 Å²	37	42 Å²	42	19%	0.194	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.5	179.4	-73.8	-178.2	0	0	0	110.1	V468 Q477 I480 K481 V487	V468-L489 HydrophobicContact CB-CD2 3.9Å; V468-L489 HydrophobicContact CG1-CD2 4.08Å; V468-L489 WeakPolarHBondContact O-CA 3.37Å; Q477-L489 HydrophobicContact CB-CD1 3.86Å; Q477-L489 HydrophobicContact CG-CD1 4.13Å; I480-L489 HydrophobicContact CB-CD2 4.36Å; I480-L489 HydrophobicContact CD1-CD2 4.43Å; I480-L489 HydrophobicContact CG2-CD2 3.72Å; K481-L489 HydrophobicContact CD-CD1 4.4Å; K481-L489 HydrophobicContact CG-CD1 3.71Å; K481-L489 HydrophobicContact CG-CG 4.35Å; V487-L489 HydrophobicContact CG1-CD2 4.38Å
490	Y	85.2	Confident	86.3	Confident	31 Å²	31	42 Å²	42	12%	0.122	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150.6	170.3	-60.9	-78.6	0	0	0	109.7	N467 V468 I469 T470 E488 D599 M600 Y605	N467-Y490 HydrophobicContact CB-CD2 4.32Å; N467-Y490 HydrophobicContact CB-CE2 4.01Å; N467-Y490 WeakPolarHBondContact OD1-CE2 3.38Å; V468-Y490 PolarHBondContact O-N 2.89Å; I469-Y490 CarbonylContact C-O 3.59Å; I469-Y490 WeakPolarHBondContact CA-O 3.33Å; I469-Y490 HydrophobicContact CG1-CD2 4.43Å; T470-Y490 PolarHBondContact N-O 3.21Å; E488-Y490 HydrophobicContact CB-CE2 3.93Å; E488-Y490 PolarHBondContact OE2-OH 2.95Å; Y490-D599 HydrophobicContact CE1-CB 4.19Å; Y490-M600 HydrophobicContact CD1-CB 3.63Å; Y490-M600 HydrophobicContact CD1-CG 4.26Å; Y490-M600 HydrophobicContact CE1-CB 4.28Å; Y490-M600 HydrophobicContact CG-CB 4.19Å; Y490-M600 HydrophobicContact CG-CG 4.32Å; Y490-Y605 HydrophobicContact CE2-CE2 4.27Å
491	T	78.1	Confident	85.9	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.2	-177	53.7	0	0	0	0	112.1	T470 M594 C597	T470-T491 VanDerWaalsContact O-CA 3.23Å; T470-T491 WeakPolarHBondContact O-CA 3.34Å; T491-M594 WeakPolarHBondContact CB-O 3.4Å; T491-M594 HydrophobicContact CG2-CG 4.1Å; T491-M594 WeakPolarHBondContact CG2-O 3.4Å; T491-M594 VanDerWaalsContact OG1-C 3.22Å; T491-M594 PolarHBondContact OG1-O 3.46Å; T491-C597 PolarHBondContact O-SG 3.25Å
492	C	75.9	Confident	85.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.007	21%	0.214	C	C	.	.			trans	-79.1	157.7	173	81.6	0	0	0	0	111.4	T470 D471 F472 S494 V609	T470-C492 PolarHBondContact O-N 3.48Å; T470-C492 VanDerWaalsContact O-N 3.08Å; D471-C492 PolarHBondContact OD1-SG 3.4Å; F472-C492 WeakPolarHBondContact CE2-O 3.4Å; C492-S494 VanDerWaalsContact C-N 3.31Å; C492-S494 PolarHBondContact O-N 3.29Å; C492-S494 PolarHBondContact SG-OG 3.27Å; C492-V609 HydrophobicContact CB-CG1 4.1Å
493	L	74.8	Confident	85.4	Confident	20 Å²	20	42.5 Å²	42.5	11%	0.105	20%	0.203	C	C	.	.	S	Bend	trans	-84.3	1.3	-179.8	-65	177.8	0	0	0	114.8	H495 M496 D497 A530 F531 C597	L493-H495 VanDerWaalsContact C-N 3.33Å; L493-H495 PolarHBondContact O-N 3.48Å; L493-M496 HydrophobicContact CD2-SD 3.92Å; L493-M496 WeakPolarHBondContact O-CB 3.21Å; L493-M496 PolarHBondContact O-N 3.48Å; L493-M496 VanDerWaalsContact O-N 3.08Å; L493-D497 PolarHBondContact O-N 3.49Å; L493-A530 HydrophobicContact CD1-CB 4.18Å; L493-A530 HydrophobicContact CD2-CB 3.42Å; L493-A530 VanDerWaalsContact CD2-CB 3.42Å; L493-A530 HydrophobicContact CG-CB 4.44Å; L493-F531 HydrophobicContact CD1-CE1 4.19Å; L493-F531 HydrophobicContact CD1-CE2 3.54Å; L493-F531 HydrophobicContact CD1-CZ 3.31Å; L493-C597 WeakPolarHBondContact CD2-SG 3.46Å; L493-C597 VanDerWaalsContact CG-SG 3.5Å
494	S	71.2	Confident	85.1	Confident	13 Å²	13	42.4 Å²	42.4	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-41.2	-169.3	67.9	0	0	0	0	112.9	C492 D497 E498 E613	C492-S494 VanDerWaalsContact C-N 3.31Å; C492-S494 PolarHBondContact O-N 3.29Å; C492-S494 PolarHBondContact SG-OG 3.27Å; S494-D497 WeakPolarHBondContact O-CB 3.33Å; S494-D497 PolarHBondContact O-N 3.36Å; S494-E498 WeakPolarHBondContact O-CG 3.38Å; S494-E498 PolarHBondContact O-N 3.25Å; S494-E613 WeakPolarHBondContact CB-OE1 3.35Å
495	H	71.5	Confident	84.8	Confident	59 Å²	59	42.8 Å²	42.8	27%	0.273	21%	0.209	S	C	.	.	H	α-helix	trans	-77	-28.4	178.9	-62.1	72.2	0	0	0	112.8	D471 F472 L493 D497 E498 W499	D471-H495 IonicContact OD2-CE1 3.31Å; F472-H495 HydrophobicContact CB-CB 4.23Å; F472-H495 HydrophobicContact CD2-CB 3.39Å; F472-H495 AromaticContact CD2-CG 3.76Å; F472-H495 AromaticContact CD2-ND1 3.77Å; F472-H495 HydrophobicContact CE2-CB 3.99Å; F472-H495 HydrophobicContact CG-CB 4.09Å; L493-H495 VanDerWaalsContact C-N 3.33Å; L493-H495 PolarHBondContact O-N 3.48Å; H495-D497 VanDerWaalsContact C-N 3.33Å; H495-E498 PolarHBondContact O-N 3.47Å; H495-W499 WeakPolarHBondContact O-CB 3.39Å; H495-W499 PolarHBondContact O-N 3.38Å
496	M	80.3	Confident	84.5	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-41.3	173.6	-167	-173.6	-175	0	0	110	L493 W499 L500 L526 L527 A530 F560 F564 W595	L493-M496 HydrophobicContact CD2-SD 3.92Å; L493-M496 WeakPolarHBondContact O-CB 3.21Å; L493-M496 PolarHBondContact O-N 3.48Å; L493-M496 VanDerWaalsContact O-N 3.08Å; M496-W499 PolarHBondContact O-N 2.75Å; M496-L500 VanDerWaalsContact O-CB 3.32Å; M496-L500 WeakPolarHBondContact O-CB 3.46Å; M496-L500 PolarHBondContact O-N 2.92Å; M496-L526 WeakPolarHBondContact CE-O 3.39Å; M496-L527 HydrophobicContact CB-CD2 4.37Å; M496-L527 HydrophobicContact CE-CD2 4.49Å; M496-L527 HydrophobicContact CG-CD2 3.83Å; M496-L527 HydrophobicContact SD-CD2 4.11Å; M496-A530 HydrophobicContact SD-CB 4.16Å; M496-F560 HydrophobicContact CE-CE2 3.32Å; M496-F560 HydrophobicContact CE-CZ 3.4Å; M496-F564 HydrophobicContact CG-CE1 4.39Å; M496-F564 HydrophobicContact CG-CZ 4.17Å; M496-W595 HydrophobicContact CE-CE3 3.9Å; M496-W595 HydrophobicContact CE-CZ3 3.93Å; M496-W595 HydrophobicContact SD-CE3 4.22Å
497	D	79	Confident	84.4	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-48.3	171.5	-70.9	-22.3	0	0	0	111.4	L493 S494 H495 L500 W501 L527 L707 R710	L493-D497 PolarHBondContact O-N 3.49Å; S494-D497 WeakPolarHBondContact O-CB 3.33Å; S494-D497 PolarHBondContact O-N 3.36Å; H495-D497 VanDerWaalsContact C-N 3.33Å; D497-L500 PolarHBondContact O-N 3.25Å; D497-W501 PolarHBondContact O-N 3.32Å; D497-L527 VanDerWaalsContact OD1-CD1 3.23Å; D497-L527 WeakPolarHBondContact OD1-CD1 3.37Å; D497-L527 WeakPolarHBondContact OD1-CD2 3.46Å; D497-L707 HydrophobicContact CB-CD2 4.26Å; D497-R710 IonicContact OD2-NH1 3.52Å; D497-R710 PolarHBondContact OD2-NH1 3Å
498	E	78.7	Confident	84.2	Confident	74 Å²	74	40.4 Å²	40.4	35%	0.346	21%	0.21	S	C	.	.	H	α-helix	trans	-65.2	-41.8	179.5	-73.7	-167.7	172	0	0	112.5	S494 H495 W501 K502 K714	S494-E498 WeakPolarHBondContact O-CG 3.38Å; S494-E498 PolarHBondContact O-N 3.25Å; H495-E498 PolarHBondContact O-N 3.47Å; E498-W501 PolarHBondContact O-N 3.17Å; E498-K502 WeakPolarHBondContact O-CB 3.43Å; E498-K502 PolarHBondContact O-N 3.05Å; E498-K714 IonicContact OE1-NZ 3.53Å; E498-K714 PolarHBondContact OE1-NZ 3.49Å
499	W	86.2	Confident	84.2	Confident	40 Å²	40	35.6 Å²	35.6	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-48	175.6	176.1	97	0	0	0	110.9	H495 M496 W501 K502 K503 A559 F560 T563 F564	H495-W499 WeakPolarHBondContact O-CB 3.39Å; H495-W499 PolarHBondContact O-N 3.38Å; M496-W499 PolarHBondContact O-N 2.75Å; W499-W501 VanDerWaalsContact C-N 3.31Å; W499-W501 PolarHBondContact O-N 3.4Å; W499-K502 PolarHBondContact O-N 3.39Å; W499-K503 HydrophobicContact CD2-CG 4.02Å; W499-K503 HydrophobicContact CE3-CG 4.35Å; W499-K503 HydrophobicContact CH2-CG 3.93Å; W499-K503 HydrophobicContact CZ2-CD 4.33Å; W499-K503 HydrophobicContact CZ2-CG 3.65Å; W499-K503 HydrophobicContact CZ3-CG 4.28Å; W499-K503 WeakPolarHBondContact O-CG 3.41Å; W499-K503 PolarHBondContact O-N 3.46Å; W499-A559 HydrophobicContact CH2-CB 4.24Å; W499-A559 HydrophobicContact CZ2-CB 4.17Å; W499-F560 VanDerWaalsContact CH2-CA 3.48Å; W499-F560 HydrophobicContact CH2-CB 3.86Å; W499-F560 HydrophobicContact CH2-CD2 4.05Å; W499-F560 HydrophobicContact CH2-CG 4.45Å; W499-F560 HydrophobicContact CZ3-CB 4.3Å; W499-F560 AromaticContact CZ3-CD2 3.72Å; W499-F560 HydrophobicContact CZ3-CD2 3.72Å; W499-T563 HydrophobicContact CZ2-CG2 4.36Å; W499-T563 WeakPolarHBondContact CZ2-OG1 3.38Å; W499-F564 HydrophobicContact CB-CZ 4.49Å; W499-F564 AromaticContact CD2-CE2 3.59Å; W499-F564 HydrophobicContact CD2-CE2 3.59Å; W499-F564 HydrophobicContact CD2-CZ 4.15Å; W499-F564 AromaticContact CE2-CE2 3.84Å; W499-F564 AromaticContact CE3-CE2 3.64Å; W499-F564 HydrophobicContact CE3-CE2 3.64Å; W499-F564 HydrophobicContact CE3-CZ 4.39Å; W499-F564 HydrophobicContact CG-CE2 4.08Å; W499-F564 HydrophobicContact CG-CZ 4.17Å; W499-F564 HydrophobicContact CH2-CE2 4.3Å; W499-F564 HydrophobicContact CZ2-CE2 4.17Å; W499-F564 HydrophobicContact CZ3-CE2 4.04Å
500	L	89.5	Confident	84.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-46	-178.5	175.9	60.3	0	0	0	110.1	M496 D497 K503 I504 A523 L526 L527 L556 L707	M496-L500 VanDerWaalsContact O-CB 3.32Å; M496-L500 WeakPolarHBondContact O-CB 3.46Å; M496-L500 PolarHBondContact O-N 2.92Å; D497-L500 PolarHBondContact O-N 3.25Å; L500-K503 PolarHBondContact O-N 3.05Å; L500-I504 HydrophobicContact CD1-CD1 4.12Å; L500-I504 HydrophobicContact CD1-CG1 4.35Å; L500-I504 HydrophobicContact CG-CD1 3.92Å; L500-I504 VanDerWaalsContact O-CG1 3.29Å; L500-I504 WeakPolarHBondContact O-CG1 3.16Å; L500-I504 PolarHBondContact O-N 3.31Å; L500-A523 WeakPolarHBondContact CD2-O 3.34Å; L500-L526 HydrophobicContact CD1-CD1 4.03Å; L500-L527 HydrophobicContact CB-CD2 4.38Å; L500-L527 HydrophobicContact CD2-CD1 3.79Å; L500-L527 HydrophobicContact CD2-CD2 3.8Å; L500-L527 HydrophobicContact CD2-CG 3.54Å; L500-L556 HydrophobicContact CD1-CD1 4.01Å; L500-L556 HydrophobicContact CD1-CD2 4Å; L500-L556 HydrophobicContact CD1-CG 4.36Å; L500-L707 HydrophobicContact CD2-CD1 4.16Å
501	W	87.5	Confident	84.3	Confident	39 Å²	39	43.4 Å²	43.4	15%	0.148	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-40.5	177.4	-179.4	-111.7	0	0	0	113.8	D497 E498 W499 K503 I504 G505 R510 Y513 L707 Q711	D497-W501 PolarHBondContact O-N 3.32Å; E498-W501 PolarHBondContact O-N 3.17Å; W499-W501 VanDerWaalsContact C-N 3.31Å; W499-W501 PolarHBondContact O-N 3.4Å; W501-K503 VanDerWaalsContact C-N 3.28Å; W501-K503 PolarHBondContact O-N 3.05Å; W501-I504 HydrophobicContact CE3-CD1 4.41Å; W501-I504 HydrophobicContact CE3-CG2 4.44Å; W501-I504 HydrophobicContact CZ3-CG2 4.4Å; W501-I504 PolarHBondContact O-N 3.07Å; W501-G505 PolarHBondContact O-N 3.01Å; W501-R510 HydrophobicContact CH2-CG 4.08Å; W501-R510 HydrophobicContact CZ2-CG 4.14Å; W501-Y513 AromaticContact CZ3-CD1 3.8Å; W501-Y513 HydrophobicContact CZ3-CD1 3.8Å; W501-Y513 AromaticContact CZ3-CE1 3.98Å; W501-Y513 HydrophobicContact CZ3-CE1 3.98Å; W501-L707 HydrophobicContact CB-CD2 4.21Å; W501-Q711 VanDerWaalsContact CD1-CD 3.4Å; W501-Q711 VanDerWaalsContact CG-CD 3.42Å
502	K	88.3	Confident	84.8	Confident	130 Å²	130	47 Å²	47	57%	0.565	24%	0.238	S	C	*	.	H	α-helix	trans	-58.3	-45.8	174.1	-174.9	176	178.7	178.2	0	109.6	E498 W499 G505 D506	E498-K502 WeakPolarHBondContact O-CB 3.43Å; E498-K502 PolarHBondContact O-N 3.05Å; W499-K502 PolarHBondContact O-N 3.39Å; K502-G505 CarbonylContact O-C 3.6Å; K502-G505 WeakPolarHBondContact O-CA 3.38Å; K502-G505 PolarHBondContact O-N 3.41Å; K502-D506 VanDerWaalsContact O-CG 3.27Å; K502-D506 PolarHBondContact O-N 3.14Å
503	K	91.7	Very high	85.3	Confident	54 Å²	54	47.3 Å²	47.3	24%	0.235	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-38.6	178.3	-70.3	-66.5	164.9	-147.8	0	114.3	W499 L500 W501 G505 D506 F507 L556 A559	W499-K503 HydrophobicContact CD2-CG 4.02Å; W499-K503 HydrophobicContact CE3-CG 4.35Å; W499-K503 HydrophobicContact CH2-CG 3.93Å; W499-K503 HydrophobicContact CZ2-CD 4.33Å; W499-K503 HydrophobicContact CZ2-CG 3.65Å; W499-K503 HydrophobicContact CZ3-CG 4.28Å; W499-K503 WeakPolarHBondContact O-CG 3.41Å; W499-K503 PolarHBondContact O-N 3.46Å; L500-K503 PolarHBondContact O-N 3.05Å; W501-K503 VanDerWaalsContact C-N 3.28Å; W501-K503 PolarHBondContact O-N 3.05Å; K503-G505 PolarHBondContact O-N 2.91Å; K503-D506 IonicContact NZ-OD2 2.69Å; K503-D506 PolarHBondContact NZ-OD2 3.33Å; K503-D506 PolarHBondContact O-N 3.17Å; K503-F507 HydrophobicContact CB-CD2 4.35Å; K503-F507 HydrophobicContact CB-CE2 4.07Å; K503-F507 HydrophobicContact CD-CE2 4.1Å; K503-F507 HydrophobicContact CD-CZ 4.15Å; K503-F507 WeakPolarHBondContact O-CB 3.39Å; K503-F507 WeakPolarHBondContact O-CD2 3.4Å; K503-F507 WeakPolarHBondContact O-CG 3.2Å; K503-F507 PolarHBondContact O-N 2.92Å; K503-L556 HydrophobicContact CB-CD1 3.7Å; K503-A559 HydrophobicContact CD-CB 4.45Å
504	I	91.2	Very high	85.8	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-37.6	170.1	-69.3	164.8	0	0	0	110.3	L500 W501 G508 M509 R510 Y513 A523 L556	L500-I504 HydrophobicContact CD1-CD1 4.12Å; L500-I504 HydrophobicContact CD1-CG1 4.35Å; L500-I504 HydrophobicContact CG-CD1 3.92Å; L500-I504 VanDerWaalsContact O-CG1 3.29Å; L500-I504 WeakPolarHBondContact O-CG1 3.16Å; L500-I504 PolarHBondContact O-N 3.31Å; W501-I504 HydrophobicContact CE3-CD1 4.41Å; W501-I504 HydrophobicContact CE3-CG2 4.44Å; W501-I504 HydrophobicContact CZ3-CG2 4.4Å; W501-I504 PolarHBondContact O-N 3.07Å; I504-G508 PolarHBondContact O-N 2.8Å; I504-M509 HydrophobicContact CG2-CB 4Å; I504-M509 PolarHBondContact O-N 3.13Å; I504-R510 HydrophobicContact CG2-CG 4.14Å; I504-Y513 HydrophobicContact CD1-CD2 3.74Å; I504-Y513 HydrophobicContact CD1-CE2 3.93Å; I504-Y513 HydrophobicContact CD1-CG 4.25Å; I504-Y513 HydrophobicContact CG2-CG 4.27Å; I504-A523 HydrophobicContact CD1-CB 4.14Å; I504-L556 HydrophobicContact CG1-CD2 4.36Å
505	G	89.2	Confident	86.5	Confident	19 Å²	19	57.7 Å²	57.7	20%	0.196	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-53	171.5	0	0	0	0	0	114.2	W501 K502 K503 F507 G508	W501-G505 PolarHBondContact O-N 3.01Å; K502-G505 CarbonylContact O-C 3.6Å; K502-G505 WeakPolarHBondContact O-CA 3.38Å; K502-G505 PolarHBondContact O-N 3.41Å; K503-G505 PolarHBondContact O-N 2.91Å; G505-F507 PolarHBondContact O-N 3.19Å; G505-G508 PolarHBondContact O-N 3.2Å
506	D	90.6	Very high	87.2	Confident	88 Å²	88	57.1 Å²	57.1	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-56.9	-32.3	-179.2	-64.3	-9.8	0	0	0	111.6	K502 K503	K502-D506 VanDerWaalsContact O-CG 3.27Å; K502-D506 PolarHBondContact O-N 3.14Å; K503-D506 IonicContact NZ-OD2 2.69Å; K503-D506 PolarHBondContact NZ-OD2 3.33Å; K503-D506 PolarHBondContact O-N 3.17Å
507	F	92	Very high	87.4	Confident	58 Å²	58	66 Å²	66	25%	0.254	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	10	177.9	-59	-40.3	0	0	0	114.2	K503 G505 M509 R555 L556 A559	K503-F507 HydrophobicContact CB-CD2 4.35Å; K503-F507 HydrophobicContact CB-CE2 4.07Å; K503-F507 HydrophobicContact CD-CE2 4.1Å; K503-F507 HydrophobicContact CD-CZ 4.15Å; K503-F507 WeakPolarHBondContact O-CB 3.39Å; K503-F507 WeakPolarHBondContact O-CD2 3.4Å; K503-F507 WeakPolarHBondContact O-CG 3.2Å; K503-F507 PolarHBondContact O-N 2.92Å; G505-F507 PolarHBondContact O-N 3.19Å; F507-M509 HydrophobicContact CB-CE 3.85Å; F507-M509 HydrophobicContact CB-CG 4.25Å; F507-M509 HydrophobicContact CD2-CE 3.96Å; F507-M509 HydrophobicContact CG-CE 4.38Å; F507-M509 PolarHBondContact O-N 3.43Å; F507-M509 VanDerWaalsContact O-N 3.15Å; F507-R555 HydrophobicContact CE1-CB 4.42Å; F507-R555 HydrophobicContact CE2-CB 4.5Å; F507-R555 HydrophobicContact CZ-CB 4.4Å; F507-L556 HydrophobicContact CD2-CB 4.3Å; F507-L556 HydrophobicContact CD2-CD1 4.07Å; F507-L556 HydrophobicContact CE2-CB 4.35Å; F507-L556 HydrophobicContact CE2-CD1 4.03Å; F507-A559 HydrophobicContact CE2-CB 4.06Å; F507-A559 HydrophobicContact CZ-CB 3.94Å
508	G	89.4	Confident	87.8	Confident	68 Å²	68	70 Å²	70	70%	0.701	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	12	177.1	0	0	0	0	0	114.9	I504 G505 R510	I504-G508 PolarHBondContact O-N 2.8Å; G505-G508 PolarHBondContact O-N 3.2Å; G508-R510 PolarHBondContact O-N 3.36Å
509	M	89.2	Confident	88.2	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.02	35%	0.345	C	S	.	.			trans	-88.6	3.7	-172.2	-70.3	-166.4	-75.1	0	0	114.6	I504 F507 E511 M512 Y513 D552 M553 L556	I504-M509 HydrophobicContact CG2-CB 4Å; I504-M509 PolarHBondContact O-N 3.13Å; F507-M509 HydrophobicContact CB-CE 3.85Å; F507-M509 HydrophobicContact CB-CG 4.25Å; F507-M509 HydrophobicContact CD2-CE 3.96Å; F507-M509 HydrophobicContact CG-CE 4.38Å; F507-M509 PolarHBondContact O-N 3.43Å; F507-M509 VanDerWaalsContact O-N 3.15Å; M509-E511 VanDerWaalsContact C-N 3.34Å; M509-E511 PolarHBondContact O-N 3.4Å; M509-M512 PolarHBondContact O-N 3.23Å; M509-Y513 VanDerWaalsContact O-CB 3.28Å; M509-Y513 WeakPolarHBondContact O-CB 3.5Å; M509-Y513 PolarHBondContact O-N 2.88Å; M509-D552 HydrophobicContact CG-CB 3.91Å; M509-D552 HydrophobicContact SD-CB 3.51Å; M509-D552 VanDerWaalsContact SD-CB 3.51Å; M509-M553 HydrophobicContact SD-SD 4.13Å; M509-L556 HydrophobicContact CE-CB 3.87Å; M509-L556 HydrophobicContact CE-CD1 4.34Å; M509-L556 HydrophobicContact CE-CD2 3.99Å; M509-L556 HydrophobicContact CE-CG 4.28Å
510	R	89.5	Confident	88.1	Confident	108 Å²	108	68.4 Å²	68.4	41%	0.408	35%	0.351	S	S	.	.	H	α-helix	trans	-57.2	-45.4	-173.9	-76.6	179	179.2	158	5	113	W501 I504 G508 Y513 C514	W501-R510 HydrophobicContact CH2-CG 4.08Å; W501-R510 HydrophobicContact CZ2-CG 4.14Å; I504-R510 HydrophobicContact CG2-CG 4.14Å; G508-R510 PolarHBondContact O-N 3.36Å; R510-Y513 PolarHBondContact O-N 3.47Å; R510-C514 PolarHBondContact O-N 3.18Å; R510-C514 VanDerWaalsContact O-N 3.11Å; R510-C514 PolarHBondContact O-SG 3.32Å
511	E	87.4	Confident	87.9	Confident	124 Å²	124	71 Å²	71	58%	0.579	36%	0.364	S	S	*	.	H	α-helix	trans	-66	-47.1	179.8	-175.2	177.4	178.6	0	0	111.4	M509 Y513 C514 K515	M509-E511 VanDerWaalsContact C-N 3.34Å; M509-E511 PolarHBondContact O-N 3.4Å; E511-Y513 VanDerWaalsContact C-N 3.33Å; E511-Y513 PolarHBondContact O-N 2.74Å; E511-C514 PolarHBondContact O-N 3.23Å; E511-C514 VanDerWaalsContact O-N 3.15Å; E511-K515 HydrophobicContact CG-CD 3.97Å; E511-K515 PolarHBondContact O-N 3.2Å; E511-K515 WeakPolarHBondContact OE1-CE 3.37Å; E511-K515 IonicContact OE1-NZ 2.82Å; E511-K515 PolarHBondContact OE1-NZ 2.97Å
512	M	87.1	Confident	88	Confident	78 Å²	78	70.7 Å²	70.7	38%	0.384	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-42.2	176.8	-169.9	-169.2	-65.4	0	0	111.7	M509 C514 K515 C516 T519	M509-M512 PolarHBondContact O-N 3.23Å; M512-C514 VanDerWaalsContact C-N 3.3Å; M512-C514 PolarHBondContact O-N 2.66Å; M512-K515 PolarHBondContact O-N 2.83Å; M512-C516 HydrophobicContact CG-CB 4.17Å; M512-C516 WeakPolarHBondContact O-CA 3.26Å; M512-C516 WeakPolarHBondContact O-CB 3.35Å; M512-C516 PolarHBondContact O-N 3.1Å; M512-T519 HydrophobicContact CG-CG2 4.07Å; M512-T519 HydrophobicContact SD-CG2 3.99Å; M512-T519 PolarHBondContact SD-OG1 2.74Å
513	Y	87	Confident	88	Confident	7 Å²	7	64.6 Å²	64.6	3%	0.027	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-37.6	176	175.4	-88.9	0	0	0	112.3	W501 I504 M509 R510 E511 K520 A523 K524 L707	W501-Y513 AromaticContact CZ3-CD1 3.8Å; W501-Y513 HydrophobicContact CZ3-CD1 3.8Å; W501-Y513 AromaticContact CZ3-CE1 3.98Å; W501-Y513 HydrophobicContact CZ3-CE1 3.98Å; I504-Y513 HydrophobicContact CD1-CD2 3.74Å; I504-Y513 HydrophobicContact CD1-CE2 3.93Å; I504-Y513 HydrophobicContact CD1-CG 4.25Å; I504-Y513 HydrophobicContact CG2-CG 4.27Å; M509-Y513 VanDerWaalsContact O-CB 3.28Å; M509-Y513 WeakPolarHBondContact O-CB 3.5Å; M509-Y513 PolarHBondContact O-N 2.88Å; R510-Y513 PolarHBondContact O-N 3.47Å; E511-Y513 VanDerWaalsContact C-N 3.33Å; E511-Y513 PolarHBondContact O-N 2.74Å; Y513-K520 HydrophobicContact CD2-CB 4.29Å; Y513-K520 HydrophobicContact CD2-CG 4.46Å; Y513-K520 HydrophobicContact CE1-CG 4.43Å; Y513-K520 HydrophobicContact CE2-CB 4.12Å; Y513-K520 HydrophobicContact CE2-CG 3.84Å; Y513-A523 HydrophobicContact CD2-CB 3.96Å; Y513-A523 HydrophobicContact CE2-CB 3.85Å; Y513-K524 WeakPolarHBondContact OH-CE 3.38Å; Y513-L707 HydrophobicContact CE2-CD1 4.48Å; Y513-L707 WeakPolarHBondContact OH-CD1 3.47Å
514	C	85.3	Confident	87.7	Confident	92 Å²	92	62.2 Å²	62.2	62%	0.622	33%	0.328	S	S	*	.	H	α-helix	trans	-73.9	-38	177.8	-70.9	0	0	0	0	112.8	R510 E511 M512	R510-C514 PolarHBondContact O-N 3.18Å; R510-C514 VanDerWaalsContact O-N 3.11Å; R510-C514 PolarHBondContact O-SG 3.32Å; E511-C514 PolarHBondContact O-N 3.23Å; E511-C514 VanDerWaalsContact O-N 3.15Å; M512-C514 VanDerWaalsContact C-N 3.3Å; M512-C514 PolarHBondContact O-N 2.66Å
515	K	86.2	Confident	87.6	Confident	158 Å²	158	62.4 Å²	62.4	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-89.9	-34.8	-174.8	-67.2	-178.3	176.9	178.3	0	114.1	E511 M512	E511-K515 HydrophobicContact CG-CD 3.97Å; E511-K515 PolarHBondContact O-N 3.2Å; E511-K515 WeakPolarHBondContact OE1-CE 3.37Å; E511-K515 IonicContact OE1-NZ 2.82Å; E511-K515 PolarHBondContact OE1-NZ 2.97Å; M512-K515 PolarHBondContact O-N 2.83Å
516	C	86	Confident	87.6	Confident	47 Å²	47	61.5 Å²	61.5	32%	0.318	32%	0.32	S	S	.	.			trans	-99.5	113.6	-174	-174.4	0	0	0	0	111.8	M512 T518 T519 K520	M512-C516 HydrophobicContact CG-CB 4.17Å; M512-C516 WeakPolarHBondContact O-CA 3.26Å; M512-C516 WeakPolarHBondContact O-CB 3.35Å; M512-C516 PolarHBondContact O-N 3.1Å; C516-T518 PolarHBondContact O-N 3.32Å; C516-T519 PolarHBondContact O-N 3.26Å; C516-K520 WeakPolarHBondContact O-CB 3.43Å; C516-K520 PolarHBondContact O-N 3.44Å; C516-K520 VanDerWaalsContact O-N 3.07Å
517	K	84.7	Confident	87.4	Confident	187 Å²	187	57.4 Å²	57.4	81%	0.813	30%	0.298	S	S	*	.	H	α-helix	trans	-57.3	-37.7	175.9	-68.3	-178.4	-177.9	175.8	0	112	K520 H521	K517-K520 PolarHBondContact O-N 3.1Å; K517-H521 WeakPolarHBondContact O-CB 3.31Å; K517-H521 PolarHBondContact O-N 2.64Å
518	T	86.8	Confident	87	Confident	93 Å²	93	54.7 Å²	54.7	57%	0.571	29%	0.286	S	S	*	.	H	α-helix	trans	-66	-51.1	179.5	-50.5	0	0	0	0	111.8	C516 K520 H521 L522	C516-T518 PolarHBondContact O-N 3.32Å; T518-K520 VanDerWaalsContact C-N 3.27Å; T518-K520 PolarHBondContact O-N 3.37Å; T518-H521 WeakPolarHBondContact O-CB 3.42Å; T518-H521 PolarHBondContact O-N 3.35Å; T518-H521 VanDerWaalsContact O-N 3.09Å; T518-L522 HydrophobicContact CG2-CD1 4.17Å; T518-L522 HydrophobicContact CG2-CG 4.44Å; T518-L522 WeakPolarHBondContact O-CG 3.31Å; T518-L522 PolarHBondContact O-N 2.75Å
519	T	86.6	Confident	87	Confident	13 Å²	13	51.4 Å²	51.4	8%	0.08	25%	0.252	C	S	.	.	H	α-helix	trans	-57.4	-42.8	176.2	-55.4	0	0	0	0	111.2	M512 C516 A523 M553	M512-T519 HydrophobicContact CG-CG2 4.07Å; M512-T519 HydrophobicContact SD-CG2 3.99Å; M512-T519 PolarHBondContact SD-OG1 2.74Å; C516-T519 PolarHBondContact O-N 3.26Å; T519-A523 WeakPolarHBondContact O-CB 3.32Å; T519-A523 PolarHBondContact O-N 2.91Å; T519-M553 HydrophobicContact CG2-SD 4Å
520	K	85.7	Confident	86.8	Confident	67 Å²	67	51.2 Å²	51.2	29%	0.291	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175.2	-174.6	175.2	-177.4	179	0	112.5	Y513 C516 K517 T518 K524	Y513-K520 HydrophobicContact CD2-CB 4.29Å; Y513-K520 HydrophobicContact CD2-CG 4.46Å; Y513-K520 HydrophobicContact CE1-CG 4.43Å; Y513-K520 HydrophobicContact CE2-CB 4.12Å; Y513-K520 HydrophobicContact CE2-CG 3.84Å; C516-K520 WeakPolarHBondContact O-CB 3.43Å; C516-K520 PolarHBondContact O-N 3.44Å; C516-K520 VanDerWaalsContact O-N 3.07Å; K517-K520 PolarHBondContact O-N 3.1Å; T518-K520 VanDerWaalsContact C-N 3.27Å; T518-K520 PolarHBondContact O-N 3.37Å; K520-K524 HydrophobicContact CG-CD 4.27Å; K520-K524 WeakPolarHBondContact O-CB 3.37Å; K520-K524 VanDerWaalsContact O-CG 3.27Å; K520-K524 WeakPolarHBondContact O-CG 3.5Å; K520-K524 PolarHBondContact O-N 3.03Å
521	H	84.9	Confident	86.4	Confident	57 Å²	57	46.2 Å²	46.2	26%	0.264	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-50.3	178.7	-175.4	91.6	0	0	0	111.3	K517 T518 A523 K524 Q525 V698	K517-H521 WeakPolarHBondContact O-CB 3.31Å; K517-H521 PolarHBondContact O-N 2.64Å; T518-H521 WeakPolarHBondContact O-CB 3.42Å; T518-H521 PolarHBondContact O-N 3.35Å; T518-H521 VanDerWaalsContact O-N 3.09Å; H521-A523 PolarHBondContact O-N 3.2Å; H521-K524 PolarHBondContact O-N 3.44Å; H521-K524 VanDerWaalsContact O-N 3.14Å; H521-Q525 PolarHBondContact CD2-NE2 2.82Å; H521-Q525 PolarHBondContact NE2-NE2 3.07Å; H521-Q525 PolarHBondContact O-N 2.88Å; H521-V698 WeakPolarHBondContact CE1-CG1 3.39Å; H521-V698 VanDerWaalsContact ND1-CG1 3.32Å; H521-V698 WeakPolarHBondContact ND1-CG1 3.49Å
522	L	88.6	Confident	86.2	Confident	32 Å²	32	40.3 Å²	40.3	17%	0.168	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-43.2	179.3	-63.7	174.5	0	0	0	111.9	T518 K524 Q525 I548 M553 Y557	T518-L522 HydrophobicContact CG2-CD1 4.17Å; T518-L522 HydrophobicContact CG2-CG 4.44Å; T518-L522 WeakPolarHBondContact O-CG 3.31Å; T518-L522 PolarHBondContact O-N 2.75Å; L522-K524 VanDerWaalsContact C-N 3.3Å; L522-K524 PolarHBondContact O-N 2.76Å; L522-Q525 WeakPolarHBondContact O-CB 3.25Å; L522-Q525 PolarHBondContact O-N 3.43Å; L522-I548 HydrophobicContact CD1-CD1 4.21Å; L522-I548 HydrophobicContact CD2-CD1 3.95Å; L522-I548 HydrophobicContact CG-CD1 4.46Å; L522-M553 HydrophobicContact CB-CE 3.53Å; L522-M553 HydrophobicContact CB-SD 4.46Å; L522-M553 HydrophobicContact CD1-CG 4.32Å; L522-Y557 PolarHBondContact O-OH 3.11Å
523	A	88.9	Confident	86	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-38.7	175.3	0	0	0	0	0	112.1	L500 I504 Y513 T519 H521 L526 L556	L500-A523 WeakPolarHBondContact CD2-O 3.34Å; I504-A523 HydrophobicContact CD1-CB 4.14Å; Y513-A523 HydrophobicContact CD2-CB 3.96Å; Y513-A523 HydrophobicContact CE2-CB 3.85Å; T519-A523 WeakPolarHBondContact O-CB 3.32Å; T519-A523 PolarHBondContact O-N 2.91Å; H521-A523 PolarHBondContact O-N 3.2Å; A523-L526 WeakPolarHBondContact O-CB 3.27Å; A523-L526 PolarHBondContact O-N 2.71Å; A523-L556 HydrophobicContact CB-CD2 4.12Å
524	K	86.5	Confident	85.9	Confident	5 Å²	5	40.6 Å²	40.6	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-23.6	178.1	-76.8	-177	168.3	-152.3	0	114	Y513 K520 H521 L522 L526 L527 A528 V698 C702 C703 I705 L707	Y513-K524 WeakPolarHBondContact OH-CE 3.38Å; K520-K524 HydrophobicContact CG-CD 4.27Å; K520-K524 WeakPolarHBondContact O-CB 3.37Å; K520-K524 VanDerWaalsContact O-CG 3.27Å; K520-K524 WeakPolarHBondContact O-CG 3.5Å; K520-K524 PolarHBondContact O-N 3.03Å; H521-K524 PolarHBondContact O-N 3.44Å; H521-K524 VanDerWaalsContact O-N 3.14Å; L522-K524 VanDerWaalsContact C-N 3.3Å; L522-K524 PolarHBondContact O-N 2.76Å; K524-L526 PolarHBondContact O-N 3.21Å; K524-L527 PolarHBondContact O-N 2.88Å; K524-L527 VanDerWaalsContact O-N 3.1Å; K524-A528 PolarHBondContact O-N 2.98Å; K524-A528 VanDerWaalsContact O-N 3.08Å; K524-V698 HydrophobicContact CB-CG1 3.99Å; K524-C702 HydrophobicContact CB-CB 4.07Å; K524-C702 HydrophobicContact CD-CB 4.17Å; K524-C702 PolarHBondContact NZ-O 2.92Å; K524-C703 PolarHBondContact NZ-O 3.04Å; K524-I705 PolarHBondContact NZ-O 3.47Å; K524-L707 HydrophobicContact CG-CD1 4.49Å
525	Q	88	Confident	85.9	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.019	22%	0.221	C	C	.	.	H	α-helix	trans	-57	-33.6	170.6	-73.1	171.9	-11.6	0	0	111.8	H521 L522 L527 A528 L529 L544 Y557 V698	H521-Q525 PolarHBondContact CD2-NE2 2.82Å; H521-Q525 PolarHBondContact NE2-NE2 3.07Å; H521-Q525 PolarHBondContact O-N 2.88Å; L522-Q525 WeakPolarHBondContact O-CB 3.25Å; L522-Q525 PolarHBondContact O-N 3.43Å; Q525-L527 VanDerWaalsContact C-N 3.32Å; Q525-L527 PolarHBondContact O-N 3.26Å; Q525-A528 WeakPolarHBondContact O-CB 3.48Å; Q525-A528 PolarHBondContact O-N 3.26Å; Q525-L529 PolarHBondContact O-N 3.44Å; Q525-L544 HydrophobicContact CB-CD1 4.21Å; Q525-Y557 PolarHBondContact OE1-OH 3.44Å; Q525-V698 HydrophobicContact CB-CG2 4.24Å; Q525-V698 HydrophobicContact CG-CB 4.42Å; Q525-V698 HydrophobicContact CG-CG1 4.41Å; Q525-V698 HydrophobicContact CG-CG2 3.74Å
526	L	90.1	Very high	85.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-37.5	176.5	-61.8	176.7	0	0	0	112.4	M496 L500 A523 K524 L529 F541 L556 Y557 F560	M496-L526 WeakPolarHBondContact CE-O 3.39Å; L500-L526 HydrophobicContact CD1-CD1 4.03Å; A523-L526 WeakPolarHBondContact O-CB 3.27Å; A523-L526 PolarHBondContact O-N 2.71Å; K524-L526 PolarHBondContact O-N 3.21Å; L526-L529 HydrophobicContact CD2-CD1 4.29Å; L526-L529 WeakPolarHBondContact O-CB 3.29Å; L526-F541 HydrophobicContact CD2-CE2 4.17Å; L526-L556 HydrophobicContact CD1-CD2 3.98Å; L526-L556 HydrophobicContact CD1-CG 3.88Å; L526-Y557 HydrophobicContact CD1-CD2 4.13Å; L526-Y557 HydrophobicContact CD1-CE2 4.09Å; L526-Y557 HydrophobicContact CD2-CD1 3.81Å; L526-Y557 HydrophobicContact CD2-CD2 4.08Å; L526-Y557 HydrophobicContact CD2-CE1 3.65Å; L526-Y557 HydrophobicContact CD2-CE2 3.91Å; L526-Y557 HydrophobicContact CD2-CG 4.04Å; L526-Y557 HydrophobicContact CG-CD2 4.35Å; L526-Y557 HydrophobicContact CG-CE1 4.5Å; L526-Y557 HydrophobicContact CG-CE2 3.96Å; L526-F560 HydrophobicContact CB-CD2 3.97Å; L526-F560 HydrophobicContact CB-CE2 3.99Å; L526-F560 HydrophobicContact CB-CG 4.47Å; L526-F560 HydrophobicContact CB-CZ 4.49Å; L526-F560 HydrophobicContact CD1-CB 4.14Å; L526-F560 HydrophobicContact CD1-CD2 4.15Å; L526-F560 HydrophobicContact CD1-CG 4.25Å; L526-F560 HydrophobicContact CD2-CB 4.12Å; L526-F560 HydrophobicContact CD2-CD1 3.92Å; L526-F560 HydrophobicContact CD2-CD2 4.16Å; L526-F560 HydrophobicContact CD2-CE1 4.39Å; L526-F560 HydrophobicContact CD2-CG 3.79Å; L526-F560 HydrophobicContact CG-CD2 4.33Å; L526-F560 HydrophobicContact CG-CG 4.4Å
527	L	86.2	Confident	85.9	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-72.1	-35.2	174	-60.3	176.8	0	0	0	111.8	M496 D497 L500 K524 Q525 L529 A530 I705 L707	M496-L527 HydrophobicContact CB-CD2 4.37Å; M496-L527 HydrophobicContact CE-CD2 4.49Å; M496-L527 HydrophobicContact CG-CD2 3.83Å; M496-L527 HydrophobicContact SD-CD2 4.11Å; D497-L527 VanDerWaalsContact OD1-CD1 3.23Å; D497-L527 WeakPolarHBondContact OD1-CD1 3.37Å; D497-L527 WeakPolarHBondContact OD1-CD2 3.46Å; L500-L527 HydrophobicContact CB-CD2 4.38Å; L500-L527 HydrophobicContact CD2-CD1 3.79Å; L500-L527 HydrophobicContact CD2-CD2 3.8Å; L500-L527 HydrophobicContact CD2-CG 3.54Å; K524-L527 PolarHBondContact O-N 2.88Å; K524-L527 VanDerWaalsContact O-N 3.1Å; Q525-L527 VanDerWaalsContact C-N 3.32Å; Q525-L527 PolarHBondContact O-N 3.26Å; L527-L529 PolarHBondContact O-N 3.31Å; L527-A530 WeakPolarHBondContact O-CB 3.5Å; L527-A530 PolarHBondContact O-N 3.01Å; L527-A530 VanDerWaalsContact O-N 3.13Å; L527-I705 HydrophobicContact CD1-CG2 3.99Å; L527-L707 HydrophobicContact CD1-CD1 3.95Å; L527-L707 HydrophobicContact CD1-CG 4.35Å
528	A	83.9	Confident	86.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-28.1	178	0	0	0	0	0	113.1	K524 Q525 A530 F531 V694 F697 V698	K524-A528 PolarHBondContact O-N 2.98Å; K524-A528 VanDerWaalsContact O-N 3.08Å; Q525-A528 WeakPolarHBondContact O-CB 3.48Å; Q525-A528 PolarHBondContact O-N 3.26Å; A528-A530 PolarHBondContact O-N 3.2Å; A528-A530 VanDerWaalsContact O-N 3.11Å; A528-F531 PolarHBondContact O-N 2.92Å; A528-V694 HydrophobicContact CB-CG1 3.96Å; A528-F697 HydrophobicContact CB-CD1 3.57Å; A528-F697 HydrophobicContact CB-CE1 3.88Å; A528-V698 HydrophobicContact CB-CG2 3.47Å; A528-V698 VanDerWaalsContact CB-CG2 3.47Å
529	L	87.9	Confident	86	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.3	175.6	-71.1	168.2	0	0	0	113	Q525 L526 L527 F531 V532 V540 F541 L544 F560 W595	Q525-L529 PolarHBondContact O-N 3.44Å; L526-L529 HydrophobicContact CD2-CD1 4.29Å; L526-L529 WeakPolarHBondContact O-CB 3.29Å; L527-L529 PolarHBondContact O-N 3.31Å; L529-F531 PolarHBondContact O-N 2.99Å; L529-V532 HydrophobicContact CD2-CG2 4.47Å; L529-V532 PolarHBondContact O-N 2.86Å; L529-V540 HydrophobicContact CD2-CB 4.29Å; L529-V540 HydrophobicContact CD2-CG1 3.8Å; L529-F541 HydrophobicContact CD1-CB 4.19Å; L529-F541 HydrophobicContact CD1-CD2 3.71Å; L529-F541 HydrophobicContact CD1-CG 4.43Å; L529-F541 HydrophobicContact CD2-CB 4.32Å; L529-L544 HydrophobicContact CD2-CD1 4Å; L529-L544 HydrophobicContact CG-CD1 4.36Å; L529-F560 HydrophobicContact CD1-CD1 4.44Å; L529-F560 HydrophobicContact CD1-CE1 3.65Å; L529-F560 HydrophobicContact CD1-CZ 4.03Å; L529-W595 HydrophobicContact CB-CH2 4.07Å; L529-W595 HydrophobicContact CB-CZ3 3.99Å
530	A	85.2	Confident	86.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-67.5	-19.3	177.7	0	0	0	0	0	113.1	L493 M496 L527 A528 W595 N596 C597 H598	L493-A530 HydrophobicContact CD1-CB 4.18Å; L493-A530 HydrophobicContact CD2-CB 3.42Å; L493-A530 VanDerWaalsContact CD2-CB 3.42Å; L493-A530 HydrophobicContact CG-CB 4.44Å; M496-A530 HydrophobicContact SD-CB 4.16Å; L527-A530 WeakPolarHBondContact O-CB 3.5Å; L527-A530 PolarHBondContact O-N 3.01Å; L527-A530 VanDerWaalsContact O-N 3.13Å; A528-A530 PolarHBondContact O-N 3.2Å; A528-A530 VanDerWaalsContact O-N 3.11Å; A530-W595 HydrophobicContact CB-CE3 3.95Å; A530-W595 HydrophobicContact CB-CZ3 4.15Å; A530-N596 PolarHBondContact O-ND2 3.33Å; A530-C597 WeakPolarHBondContact O-CA 3.47Å; A530-C597 PolarHBondContact O-N 3.35Å; A530-H598 PolarHBondContact O-N 2.86Å
531	F	81.1	Confident	86.3	Confident	3 Å²	3	26.3 Å²	26.3	1%	0.013	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-99.1	-6.6	-179.7	-57.8	-85.3	0	0	0	113.2	L493 A528 L529 C597 H598 V601 L606 L673 F697 I705	L493-F531 HydrophobicContact CD1-CE1 4.19Å; L493-F531 HydrophobicContact CD1-CE2 3.54Å; L493-F531 HydrophobicContact CD1-CZ 3.31Å; A528-F531 PolarHBondContact O-N 2.92Å; L529-F531 PolarHBondContact O-N 2.99Å; F531-C597 HydrophobicContact CD1-CB 4.45Å; F531-C597 HydrophobicContact CE1-CB 4.37Å; F531-H598 PolarHBondContact O-ND1 3.05Å; F531-V601 HydrophobicContact CD1-CG2 3.92Å; F531-V601 HydrophobicContact CE1-CG2 3.79Å; F531-L606 HydrophobicContact CE1-CD1 4.39Å; F531-L673 HydrophobicContact CD1-CD1 4.06Å; F531-L673 HydrophobicContact CD1-CD2 4.18Å; F531-L673 HydrophobicContact CE1-CD1 4.43Å; F531-L673 HydrophobicContact CE1-CD2 3.9Å; F531-F697 HydrophobicContact CB-CE1 4.31Å; F531-F697 HydrophobicContact CB-CE2 3.8Å; F531-F697 HydrophobicContact CB-CZ 3.6Å; F531-F697 HydrophobicContact CD1-CZ 4.04Å; F531-F697 AromaticContact CD2-CE1 3.6Å; F531-F697 HydrophobicContact CD2-CE1 3.6Å; F531-F697 HydrophobicContact CD2-CE2 4.36Å; F531-F697 AromaticContact CD2-CZ 3.33Å; F531-F697 HydrophobicContact CD2-CZ 3.33Å; F531-F697 HydrophobicContact CE2-CE1 4.14Å; F531-F697 AromaticContact CE2-CZ 3.93Å; F531-F697 HydrophobicContact CE2-CZ 3.93Å; F531-F697 HydrophobicContact CG-CE1 4.1Å; F531-F697 HydrophobicContact CG-CE2 4.02Å; F531-F697 AromaticContact CG-CZ 3.37Å; F531-F697 HydrophobicContact CG-CZ 3.37Å; F531-F697 HydrophobicContact CZ-CZ 4.49Å; F531-I705 HydrophobicContact CE2-CD1 3.88Å; F531-I705 HydrophobicContact CZ-CD1 4.31Å
532	V	83.1	Confident	86.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-73.2	140.3	174.3	177.4	0	0	0	0	108.6	L529 Q534 E536 V537 V540 N596 F680 V694	L529-V532 HydrophobicContact CD2-CG2 4.47Å; L529-V532 PolarHBondContact O-N 2.86Å; V532-Q534 PolarHBondContact O-N 3.07Å; V532-E536 HydrophobicContact CG1-CB 3.93Å; V532-V537 HydrophobicContact CB-CG2 4Å; V532-V537 HydrophobicContact CG1-CG2 4.12Å; V532-V537 WeakPolarHBondContact O-CG2 3.35Å; V532-V540 HydrophobicContact CG1-CB 4.44Å; V532-V540 HydrophobicContact CG1-CG2 4.04Å; V532-V540 HydrophobicContact CG2-CG1 4.41Å; V532-N596 PolarHBondContact O-ND2 3.36Å; V532-F680 HydrophobicContact CB-CE1 4.4Å; V532-F680 HydrophobicContact CG2-CE1 3.93Å; V532-F680 HydrophobicContact CG2-CZ 4.47Å; V532-V694 HydrophobicContact CG2-CG2 3.68Å
533	P	83.6	Confident	86.5	Confident	22 Å²	22	28.1 Å²	28.1	14%	0.143	14%	0.137	C	C	.	.			trans	-50.2	132.9	174.3	-27.1	33.1	0	0	0	111	K535 E536 V537 F680	P533-K535 PolarHBondContact O-N 3.17Å; P533-E536 HydrophobicContact CB-CG 4.42Å; P533-E536 PolarHBondContact O-N 2.95Å; P533-V537 PolarHBondContact O-N 2.89Å; P533-F680 VanDerWaalsContact CD-CD1 3.42Å; P533-F680 HydrophobicContact CG-CB 3.64Å; P533-F680 HydrophobicContact CG-CD1 4.29Å; P533-F680 HydrophobicContact CG-CG 4.3Å
534	Q	85.3	Confident	86.5	Confident	68 Å²	68	28 Å²	28	32%	0.318	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-40.8	-171.4	-175.3	173.9	-13.4	0	0	113.3	V532 E536 V537 L592	V532-Q534 PolarHBondContact O-N 3.07Å; Q534-E536 PolarHBondContact O-N 3.4Å; Q534-V537 PolarHBondContact O-N 2.74Å; Q534-L592 HydrophobicContact CG-CD2 3.49Å; Q534-L592 VanDerWaalsContact CG-CD2 3.49Å; Q534-L592 HydrophobicContact CG-CG 3.75Å; Q534-L592 WeakPolarHBondContact O-CD2 3.32Å
535	K	84.7	Confident	86.7	Confident	209 Å²	209	29.8 Å²	29.8	91%	0.909	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.1	-179.6	-60.3	-179.8	-176.5	175.4	0	113.4	P533	P533-K535 PolarHBondContact O-N 3.17Å
536	E	84.6	Confident	86.7	Confident	22 Å²	22	34.2 Å²	34.2	10%	0.103	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-18.3	-174.7	-58.8	-165.2	151.8	0	0	113.5	V532 P533 Q534 I538 S539 V540 R690	V532-E536 HydrophobicContact CG1-CB 3.93Å; P533-E536 HydrophobicContact CB-CG 4.42Å; P533-E536 PolarHBondContact O-N 2.95Å; Q534-E536 PolarHBondContact O-N 3.4Å; E536-I538 VanDerWaalsContact C-N 3.28Å; E536-I538 PolarHBondContact O-N 2.91Å; E536-I538 VanDerWaalsContact O-N 3.13Å; E536-S539 PolarHBondContact O-N 2.62Å; E536-S539 PolarHBondContact O-OG 3.04Å; E536-V540 HydrophobicContact CB-CG2 4.37Å; E536-V540 WeakPolarHBondContact O-CG2 3.33Å; E536-V540 PolarHBondContact O-N 2.87Å; E536-R690 VanDerWaalsContact CD-NE 3.27Å; E536-R690 IonicContact OE1-CZ 2.81Å; E536-R690 VanDerWaalsContact OE1-CZ 3.31Å; E536-R690 IonicContact OE1-NE 2.64Å; E536-R690 PolarHBondContact OE1-NE 3.35Å; E536-R690 IonicContact OE1-NH2 2.87Å; E536-R690 PolarHBondContact OE1-NH2 2.87Å; E536-R690 IonicContact OE2-NE 2.9Å
537	V	87.6	Confident	86.6	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-48.9	-46.3	-173.2	172.7	0	0	0	0	112.9	V532 P533 Q534 V540 F541 I565 L592 W595	V532-V537 HydrophobicContact CB-CG2 4Å; V532-V537 HydrophobicContact CG1-CG2 4.12Å; V532-V537 WeakPolarHBondContact O-CG2 3.35Å; P533-V537 PolarHBondContact O-N 2.89Å; Q534-V537 PolarHBondContact O-N 2.74Å; V537-V540 PolarHBondContact O-N 3.21Å; V537-F541 WeakPolarHBondContact O-CB 3.4Å; V537-F541 PolarHBondContact O-N 3.29Å; V537-I565 HydrophobicContact CG1-CD1 3.9Å; V537-L592 HydrophobicContact CB-CD1 4.05Å; V537-L592 HydrophobicContact CB-CD2 4.26Å; V537-L592 HydrophobicContact CG1-CD1 3.72Å; V537-L592 HydrophobicContact CG2-CD1 4.11Å; V537-W595 HydrophobicContact CG1-CH2 3.46Å; V537-W595 VanDerWaalsContact CG1-CH2 3.46Å; V537-W595 HydrophobicContact CG1-CZ2 4.02Å; V537-W595 HydrophobicContact CG1-CZ3 4.37Å
538	I	88.6	Confident	86.8	Confident	82 Å²	82	36.3 Å²	36.3	42%	0.421	19%	0.19	S	C	.	.	H	α-helix	trans	-64.6	-46.1	-177.5	-61	176	0	0	0	110.5	E536 V540 F541 H542 I565	E536-I538 VanDerWaalsContact C-N 3.28Å; E536-I538 PolarHBondContact O-N 2.91Å; E536-I538 VanDerWaalsContact O-N 3.13Å; I538-V540 PolarHBondContact O-N 3.29Å; I538-F541 PolarHBondContact O-N 3.12Å; I538-H542 PolarHBondContact O-CD2 2.95Å; I538-H542 PolarHBondContact O-N 3.03Å; I538-H542 VanDerWaalsContact O-N 3.08Å; I538-I565 HydrophobicContact CG1-CG2 4.38Å; I538-I565 HydrophobicContact CG2-CG2 4.48Å
539	S	86.2	Confident	87	Confident	43 Å²	43	44.3 Å²	44.3	30%	0.301	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-44.4	180	72.8	0	0	0	0	111.8	E536 H542 Q543	E536-S539 PolarHBondContact O-N 2.62Å; E536-S539 PolarHBondContact O-OG 3.04Å; S539-H542 PolarHBondContact O-N 2.82Å; S539-Q543 WeakPolarHBondContact O-CG 3.44Å; S539-Q543 PolarHBondContact O-N 2.72Å
540	V	86.6	Confident	87	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-67.2	-41	178.8	173.6	0	0	0	0	110.7	L529 V532 E536 V537 I538 H542 Q543 L544 R690 V694	L529-V540 HydrophobicContact CD2-CB 4.29Å; L529-V540 HydrophobicContact CD2-CG1 3.8Å; V532-V540 HydrophobicContact CG1-CB 4.44Å; V532-V540 HydrophobicContact CG1-CG2 4.04Å; V532-V540 HydrophobicContact CG2-CG1 4.41Å; E536-V540 HydrophobicContact CB-CG2 4.37Å; E536-V540 WeakPolarHBondContact O-CG2 3.33Å; E536-V540 PolarHBondContact O-N 2.87Å; V537-V540 PolarHBondContact O-N 3.21Å; I538-V540 PolarHBondContact O-N 3.29Å; V540-H542 PolarHBondContact O-N 3.24Å; V540-Q543 PolarHBondContact O-N 2.84Å; V540-L544 HydrophobicContact CG1-CD1 4.19Å; V540-L544 HydrophobicContact CG1-CG 4.47Å; V540-L544 WeakPolarHBondContact O-CG 3.47Å; V540-L544 PolarHBondContact O-N 3.28Å; V540-R690 HydrophobicContact CG2-CB 4.18Å; V540-V694 HydrophobicContact CG1-CB 4.47Å; V540-V694 HydrophobicContact CG1-CG2 3.65Å
541	F	91	Very high	87.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-46.3	175.2	172.7	-97.7	0	0	0	111.7	L526 L529 V537 I538 Q543 L544 N545 Y557 F560 Q561 I565	L526-F541 HydrophobicContact CD2-CE2 4.17Å; L529-F541 HydrophobicContact CD1-CB 4.19Å; L529-F541 HydrophobicContact CD1-CD2 3.71Å; L529-F541 HydrophobicContact CD1-CG 4.43Å; L529-F541 HydrophobicContact CD2-CB 4.32Å; V537-F541 WeakPolarHBondContact O-CB 3.4Å; V537-F541 PolarHBondContact O-N 3.29Å; I538-F541 PolarHBondContact O-N 3.12Å; F541-Q543 VanDerWaalsContact C-N 3.32Å; F541-Q543 PolarHBondContact O-N 3.02Å; F541-L544 PolarHBondContact O-N 2.61Å; F541-N545 HydrophobicContact CE1-CB 4.26Å; F541-N545 HydrophobicContact CZ-CB 4.22Å; F541-N545 WeakPolarHBondContact O-CB 3.27Å; F541-N545 PolarHBondContact O-N 3.04Å; F541-Y557 AromaticContact CE2-CD1 3.86Å; F541-Y557 HydrophobicContact CE2-CD1 3.86Å; F541-Y557 HydrophobicContact CZ-CD1 4.36Å; F541-F560 AromaticContact CD2-CD1 3.91Å; F541-F560 HydrophobicContact CD2-CD1 3.91Å; F541-F560 HydrophobicContact CD2-CE1 4.16Å; F541-F560 AromaticContact CE2-CD1 3.62Å; F541-F560 HydrophobicContact CE2-CD1 3.62Å; F541-F560 HydrophobicContact CE2-CE1 4.33Å; F541-F560 HydrophobicContact CE2-CG 4.48Å; F541-F560 HydrophobicContact CZ-CD1 4.46Å; F541-Q561 HydrophobicContact CE1-CB 3.74Å; F541-Q561 HydrophobicContact CE1-CG 3.69Å; F541-Q561 HydrophobicContact CZ-CB 3.63Å; F541-Q561 HydrophobicContact CZ-CG 4.13Å; F541-I565 HydrophobicContact CB-CD1 4.04Å; F541-I565 HydrophobicContact CB-CG1 4.39Å; F541-I565 HydrophobicContact CD1-CG1 3.97Å; F541-I565 HydrophobicContact CD1-CG2 4.23Å; F541-I565 HydrophobicContact CD2-CD1 4.49Å; F541-I565 HydrophobicContact CD2-CG1 4.15Å; F541-I565 HydrophobicContact CE1-CG1 4.38Å; F541-I565 HydrophobicContact CG-CD1 4.07Å; F541-I565 HydrophobicContact CG-CG1 3.87Å
542	H	90.3	Very high	87.6	Confident	90 Å²	90	56 Å²	56	42%	0.417	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-38	179.8	-74.9	-58.7	0	0	0	112.8	I538 S539 V540 N545 S546	I538-H542 PolarHBondContact O-CD2 2.95Å; I538-H542 PolarHBondContact O-N 3.03Å; I538-H542 VanDerWaalsContact O-N 3.08Å; S539-H542 PolarHBondContact O-N 2.82Å; V540-H542 PolarHBondContact O-N 3.24Å; H542-N545 PolarHBondContact O-N 3.18Å; H542-S546 PolarHBondContact O-N 3.38Å
543	Q	86.8	Confident	87.9	Confident	37 Å²	37	56 Å²	56	17%	0.173	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-41.7	174	-67.5	163.6	8.2	0	0	112.3	S539 V540 F541 S546 T547 P687	S539-Q543 WeakPolarHBondContact O-CG 3.44Å; S539-Q543 PolarHBondContact O-N 2.72Å; V540-Q543 PolarHBondContact O-N 2.84Å; F541-Q543 VanDerWaalsContact C-N 3.32Å; F541-Q543 PolarHBondContact O-N 3.02Å; Q543-S546 PolarHBondContact O-OG 3.26Å; Q543-T547 VanDerWaalsContact O-CG2 3.29Å; Q543-T547 WeakPolarHBondContact O-CG2 3.46Å; Q543-P687 VanDerWaalsContact NE2-CA 3.34Å; Q543-P687 PolarHBondContact NE2-O 2.81Å; Q543-P687 PolarHBondContact OE1-O 3.12Å
544	L	89.3	Confident	88.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.5	-44	175.8	-66.1	172.6	0	0	0	110.3	Q525 L529 V540 F541 S546 T547 I548 Y557 R691 V694	Q525-L544 HydrophobicContact CB-CD1 4.21Å; L529-L544 HydrophobicContact CD2-CD1 4Å; L529-L544 HydrophobicContact CG-CD1 4.36Å; V540-L544 HydrophobicContact CG1-CD1 4.19Å; V540-L544 HydrophobicContact CG1-CG 4.47Å; V540-L544 WeakPolarHBondContact O-CG 3.47Å; V540-L544 PolarHBondContact O-N 3.28Å; F541-L544 PolarHBondContact O-N 2.61Å; L544-S546 VanDerWaalsContact C-N 3.31Å; L544-S546 PolarHBondContact O-N 3.48Å; L544-T547 PolarHBondContact O-N 2.94Å; L544-T547 VanDerWaalsContact O-N 3.14Å; L544-T547 PolarHBondContact O-OG1 3.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.41Å; L544-Y557 HydrophobicContact CB-CE1 3.9Å; L544-R691 HydrophobicContact CD2-CG 4.22Å; L544-V694 HydrophobicContact CD1-CG1 4.22Å
545	N	90.5	Very high	88.7	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.219	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-35.1	-179.1	-167.4	43.5	0	0	0	112.8	F541 H542 T547 I548 Y557	F541-N545 HydrophobicContact CE1-CB 4.26Å; F541-N545 HydrophobicContact CZ-CB 4.22Å; F541-N545 WeakPolarHBondContact O-CB 3.27Å; F541-N545 PolarHBondContact O-N 3.04Å; H542-N545 PolarHBondContact O-N 3.18Å; N545-T547 PolarHBondContact O-N 2.91Å; N545-I548 PolarHBondContact O-N 2.93Å; N545-Y557 HydrophobicContact CB-CD1 4.05Å; N545-Y557 VanDerWaalsContact OD1-CB 3.27Å; N545-Y557 WeakPolarHBondContact OD1-CB 3.31Å
546	S	88.9	Confident	89.1	Confident	98 Å²	98	53.4 Å²	53.4	69%	0.685	27%	0.274	S	S	*	.	H	α-helix	trans	-67.3	-17.9	178.2	68.7	0	0	0	0	113.8	H542 Q543 L544	H542-S546 PolarHBondContact O-N 3.38Å; Q543-S546 PolarHBondContact O-OG 3.26Å; L544-S546 VanDerWaalsContact C-N 3.31Å; L544-S546 PolarHBondContact O-N 3.48Å
547	T	87.5	Confident	89.5	Confident	37 Å²	37	52.4 Å²	52.4	23%	0.227	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.4	-178.7	70	0	0	0	0	113.1	Q543 L544 N545 Q549	Q543-T547 VanDerWaalsContact O-CG2 3.29Å; Q543-T547 WeakPolarHBondContact O-CG2 3.46Å; L544-T547 PolarHBondContact O-N 2.94Å; L544-T547 VanDerWaalsContact O-N 3.14Å; L544-T547 PolarHBondContact O-OG1 3.46Å; N545-T547 PolarHBondContact O-N 2.91Å; T547-Q549 PolarHBondContact O-N 3.22Å
548	I	90.6	Very high	89.7	Confident	9 Å²	9	54.1 Å²	54.1	5%	0.046	28%	0.281	C	S	.	.			trans	-77.8	114	-174.3	-55.6	-57.1	0	0	0	110.2	L522 L544 N545 M553 K554 Y557	L522-I548 HydrophobicContact CD1-CD1 4.21Å; L522-I548 HydrophobicContact CD2-CD1 3.95Å; L522-I548 HydrophobicContact CG-CD1 4.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.41Å; N545-I548 PolarHBondContact O-N 2.93Å; I548-M553 HydrophobicContact CG2-CB 3.29Å; I548-K554 HydrophobicContact CB-CG 4.39Å; I548-K554 HydrophobicContact CG2-CG 3.85Å; I548-K554 WeakPolarHBondContact O-CE 3.23Å; I548-Y557 HydrophobicContact CD1-CD1 4.49Å; I548-Y557 HydrophobicContact CD1-CD2 4.15Å; I548-Y557 HydrophobicContact CD1-CE1 4.02Å; I548-Y557 HydrophobicContact CD1-CE2 3.66Å; I548-Y557 HydrophobicContact CG1-CD1 3.97Å; I548-Y557 HydrophobicContact CG1-CD2 4.02Å; I548-Y557 HydrophobicContact CG1-CE1 3.95Å; I548-Y557 HydrophobicContact CG1-CE2 4.02Å; I548-Y557 HydrophobicContact CG1-CG 3.99Å
549	Q	88.1	Confident	89.8	Confident	169 Å²	169	50.5 Å²	50.5	79%	0.79	26%	0.263	S	S	*	.			trans	-93.2	-41.6	-178	-64.5	-179.6	-5.1	0	0	112.7	T547 K554	T547-Q549 PolarHBondContact O-N 3.22Å; Q549-K554 VanDerWaalsContact O-CE 3.29Å; Q549-K554 WeakPolarHBondContact O-CE 3.28Å; Q549-K554 PolarHBondContact O-NZ 3.33Å; Q549-K554 VanDerWaalsContact O-NZ 3.1Å
550	T	88.3	Confident	90.1	Very high	74 Å²	74	48.5 Å²	48.5	45%	0.454	25%	0.249	S	C	.	.	S	Bend	trans	-76.7	139.9	-173.2	62.7	0	0	0	0	112.3	D552 M553 K554	T550-D552 VanDerWaalsContact C-N 3.33Å; T550-D552 PolarHBondContact O-N 3.49Å; T550-M553 PolarHBondContact O-N 3.05Å; T550-M553 VanDerWaalsContact OG1-CB 3.28Å; T550-M553 WeakPolarHBondContact OG1-CB 3.32Å; T550-M553 WeakPolarHBondContact OG1-CG 3.37Å; T550-K554 WeakPolarHBondContact O-CG 3.29Å; T550-K554 PolarHBondContact O-N 3.42Å
551	D	88.9	Confident	90.3	Very high	111 Å²	111	49.9 Å²	49.9	59%	0.594	26%	0.256	S	S	*	.	H	α-helix	trans	-64.2	-36.3	-175.6	-69	-25.5	0	0	0	112.9	M553 K554 R555	D551-M553 PolarHBondContact O-N 3.19Å; D551-K554 PolarHBondContact O-N 3.43Å; D551-K554 IonicContact OD1-NZ 2.92Å; D551-R555 WeakPolarHBondContact O-CG 3.33Å; D551-R555 PolarHBondContact O-N 3.2Å
552	D	88.4	Confident	90	Very high	63 Å²	63	56.2 Å²	56.2	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-64.2	-40.7	177	-60.3	-35.9	0	0	0	111.8	M509 T550 R555 L556	M509-D552 HydrophobicContact CG-CB 3.91Å; M509-D552 HydrophobicContact SD-CB 3.51Å; M509-D552 VanDerWaalsContact SD-CB 3.51Å; T550-D552 VanDerWaalsContact C-N 3.33Å; T550-D552 PolarHBondContact O-N 3.49Å; D552-R555 WeakPolarHBondContact O-CB 3.38Å; D552-R555 PolarHBondContact O-N 3.13Å; D552-L556 PolarHBondContact O-N 3.06Å; D552-L556 VanDerWaalsContact O-N 3.1Å
553	M	90.6	Very high	89.9	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-71.9	-36.6	176	-69.6	-59.5	-49.5	0	0	111.7	M509 T519 L522 I548 T550 D551 R555 L556 Y557	M509-M553 HydrophobicContact SD-SD 4.13Å; T519-M553 HydrophobicContact CG2-SD 4Å; L522-M553 HydrophobicContact CB-CE 3.53Å; L522-M553 HydrophobicContact CB-SD 4.46Å; L522-M553 HydrophobicContact CD1-CG 4.32Å; I548-M553 HydrophobicContact CG2-CB 3.29Å; T550-M553 PolarHBondContact O-N 3.05Å; T550-M553 VanDerWaalsContact OG1-CB 3.28Å; T550-M553 WeakPolarHBondContact OG1-CB 3.32Å; T550-M553 WeakPolarHBondContact OG1-CG 3.37Å; D551-M553 PolarHBondContact O-N 3.19Å; M553-R555 VanDerWaalsContact C-N 3.28Å; M553-R555 PolarHBondContact O-N 3.33Å; M553-L556 HydrophobicContact CE-CD2 3.86Å; M553-L556 WeakPolarHBondContact O-CB 3.44Å; M553-L556 PolarHBondContact O-N 2.79Å; M553-L556 VanDerWaalsContact O-N 3.14Å; M553-L556 HydrophobicContact SD-CD2 4.27Å; M553-Y557 HydrophobicContact CE-CD2 3.93Å; M553-Y557 HydrophobicContact CE-CE2 3.53Å; M553-Y557 WeakPolarHBondContact O-CD2 3.38Å; M553-Y557 PolarHBondContact O-N 3.38Å
554	K	92.5	Very high	89.9	Confident	88 Å²	88	51.1 Å²	51.1	38%	0.383	26%	0.257	S	S	.	.	H	α-helix	trans	-59.5	-40.5	172.6	-73.4	175.8	-174.7	157.8	0	111	I548 Q549 T550 D551 L556 S558	I548-K554 HydrophobicContact CB-CG 4.39Å; I548-K554 HydrophobicContact CG2-CG 3.85Å; I548-K554 WeakPolarHBondContact O-CE 3.23Å; Q549-K554 VanDerWaalsContact O-CE 3.29Å; Q549-K554 WeakPolarHBondContact O-CE 3.28Å; Q549-K554 PolarHBondContact O-NZ 3.33Å; Q549-K554 VanDerWaalsContact O-NZ 3.1Å; T550-K554 WeakPolarHBondContact O-CG 3.29Å; T550-K554 PolarHBondContact O-N 3.42Å; D551-K554 PolarHBondContact O-N 3.43Å; D551-K554 IonicContact OD1-NZ 2.92Å; K554-L556 VanDerWaalsContact C-N 3.35Å; K554-S558 WeakPolarHBondContact O-CB 3.29Å; K554-S558 PolarHBondContact O-N 3.41Å; K554-S558 PolarHBondContact O-OG 3.01Å
555	R	92.5	Very high	89.8	Confident	156 Å²	156	51.8 Å²	51.8	59%	0.589	26%	0.261	S	S	*	.	H	α-helix	trans	-61.6	-42.9	174.2	-72.5	172.1	-176.1	-99.6	0.1	111.5	F507 D551 D552 M553 A559	F507-R555 HydrophobicContact CE1-CB 4.42Å; F507-R555 HydrophobicContact CE2-CB 4.5Å; F507-R555 HydrophobicContact CZ-CB 4.4Å; D551-R555 WeakPolarHBondContact O-CG 3.33Å; D551-R555 PolarHBondContact O-N 3.2Å; D552-R555 WeakPolarHBondContact O-CB 3.38Å; D552-R555 PolarHBondContact O-N 3.13Å; M553-R555 VanDerWaalsContact C-N 3.28Å; M553-R555 PolarHBondContact O-N 3.33Å; R555-A559 WeakPolarHBondContact O-CB 3.22Å; R555-A559 PolarHBondContact O-N 3.3Å
556	L	93	Very high	89.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-51.2	177.4	-174.1	65.2	0	0	0	112.9	L500 K503 I504 F507 M509 A523 L526 D552 M553 K554 S558 A559 F560	L500-L556 HydrophobicContact CD1-CD1 4.01Å; L500-L556 HydrophobicContact CD1-CD2 4Å; L500-L556 HydrophobicContact CD1-CG 4.36Å; K503-L556 HydrophobicContact CB-CD1 3.7Å; I504-L556 HydrophobicContact CG1-CD2 4.36Å; F507-L556 HydrophobicContact CD2-CB 4.3Å; F507-L556 HydrophobicContact CD2-CD1 4.07Å; F507-L556 HydrophobicContact CE2-CB 4.35Å; F507-L556 HydrophobicContact CE2-CD1 4.03Å; M509-L556 HydrophobicContact CE-CB 3.87Å; M509-L556 HydrophobicContact CE-CD1 4.34Å; M509-L556 HydrophobicContact CE-CD2 3.99Å; M509-L556 HydrophobicContact CE-CG 4.28Å; A523-L556 HydrophobicContact CB-CD2 4.12Å; L526-L556 HydrophobicContact CD1-CD2 3.98Å; L526-L556 HydrophobicContact CD1-CG 3.88Å; D552-L556 PolarHBondContact O-N 3.06Å; D552-L556 VanDerWaalsContact O-N 3.1Å; M553-L556 HydrophobicContact CE-CD2 3.86Å; M553-L556 WeakPolarHBondContact O-CB 3.44Å; M553-L556 PolarHBondContact O-N 2.79Å; M553-L556 VanDerWaalsContact O-N 3.14Å; M553-L556 HydrophobicContact SD-CD2 4.27Å; K554-L556 VanDerWaalsContact C-N 3.35Å; L556-S558 VanDerWaalsContact C-N 3.32Å; L556-S558 PolarHBondContact O-N 3.23Å; L556-A559 WeakPolarHBondContact O-CB 3.27Å; L556-A559 PolarHBondContact O-N 3.39Å; L556-A559 VanDerWaalsContact O-N 3.16Å; L556-F560 PolarHBondContact O-N 3.37Å
557	Y	93.8	Very high	87.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-39	178.1	-87.2	-116.3	0	0	0	111.6	L522 Q525 L526 F541 L544 N545 I548 M553 A559 F560 Q561	L522-Y557 PolarHBondContact O-OH 3.11Å; Q525-Y557 PolarHBondContact OE1-OH 3.44Å; L526-Y557 HydrophobicContact CD1-CD2 4.13Å; L526-Y557 HydrophobicContact CD1-CE2 4.09Å; L526-Y557 HydrophobicContact CD2-CD1 3.81Å; L526-Y557 HydrophobicContact CD2-CD2 4.08Å; L526-Y557 HydrophobicContact CD2-CE1 3.65Å; L526-Y557 HydrophobicContact CD2-CE2 3.91Å; L526-Y557 HydrophobicContact CD2-CG 4.04Å; L526-Y557 HydrophobicContact CG-CD2 4.35Å; L526-Y557 HydrophobicContact CG-CE1 4.5Å; L526-Y557 HydrophobicContact CG-CE2 3.96Å; F541-Y557 AromaticContact CE2-CD1 3.86Å; F541-Y557 HydrophobicContact CE2-CD1 3.86Å; F541-Y557 HydrophobicContact CZ-CD1 4.36Å; L544-Y557 HydrophobicContact CB-CE1 3.9Å; N545-Y557 HydrophobicContact CB-CD1 4.05Å; N545-Y557 VanDerWaalsContact OD1-CB 3.27Å; N545-Y557 WeakPolarHBondContact OD1-CB 3.31Å; I548-Y557 HydrophobicContact CD1-CD1 4.49Å; I548-Y557 HydrophobicContact CD1-CD2 4.15Å; I548-Y557 HydrophobicContact CD1-CE1 4.02Å; I548-Y557 HydrophobicContact CD1-CE2 3.66Å; I548-Y557 HydrophobicContact CG1-CD1 3.97Å; I548-Y557 HydrophobicContact CG1-CD2 4.02Å; I548-Y557 HydrophobicContact CG1-CE1 3.95Å; I548-Y557 HydrophobicContact CG1-CE2 4.02Å; I548-Y557 HydrophobicContact CG1-CG 3.99Å; M553-Y557 HydrophobicContact CE-CD2 3.93Å; M553-Y557 HydrophobicContact CE-CE2 3.53Å; M553-Y557 WeakPolarHBondContact O-CD2 3.38Å; M553-Y557 PolarHBondContact O-N 3.38Å; Y557-A559 VanDerWaalsContact C-N 3.33Å; Y557-A559 PolarHBondContact O-N 2.86Å; Y557-F560 WeakPolarHBondContact O-CB 3.22Å; Y557-F560 PolarHBondContact O-N 2.79Å; Y557-Q561 PolarHBondContact O-N 2.95Å
558	S	91	Very high	86.3	Confident	36 Å²	36	50.1 Å²	50.1	25%	0.252	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-39.6	173.8	-62.4	0	0	0	0	112.1	K554 L556 F560 R562	K554-S558 WeakPolarHBondContact O-CB 3.29Å; K554-S558 PolarHBondContact O-N 3.41Å; K554-S558 PolarHBondContact O-OG 3.01Å; L556-S558 VanDerWaalsContact C-N 3.32Å; L556-S558 PolarHBondContact O-N 3.23Å; S558-F560 VanDerWaalsContact C-N 3.33Å; S558-R562 VanDerWaalsContact O-CG 3.3Å; S558-R562 WeakPolarHBondContact O-CG 3.45Å; S558-R562 PolarHBondContact O-N 2.82Å
559	A	91.3	Very high	84.5	Confident	6 Å²	6	52.4 Å²	52.4	5%	0.05	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-38.5	174.4	0	0	0	0	0	111.6	W499 K503 F507 R555 L556 Y557 T563	W499-A559 HydrophobicContact CH2-CB 4.24Å; W499-A559 HydrophobicContact CZ2-CB 4.17Å; K503-A559 HydrophobicContact CD-CB 4.45Å; F507-A559 HydrophobicContact CE2-CB 4.06Å; F507-A559 HydrophobicContact CZ-CB 3.94Å; R555-A559 WeakPolarHBondContact O-CB 3.22Å; R555-A559 PolarHBondContact O-N 3.3Å; L556-A559 WeakPolarHBondContact O-CB 3.27Å; L556-A559 PolarHBondContact O-N 3.39Å; L556-A559 VanDerWaalsContact O-N 3.16Å; Y557-A559 VanDerWaalsContact C-N 3.33Å; Y557-A559 PolarHBondContact O-N 2.86Å; A559-T563 WeakPolarHBondContact O-CB 3.46Å; A559-T563 PolarHBondContact O-N 3.25Å; A559-T563 PolarHBondContact O-OG1 3.33Å
560	F	91.9	Very high	83.5	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-48.5	175.7	-172.7	-89.6	0	0	0	111.4	M496 W499 L526 L529 F541 L556 Y557 S558 R562 T563 F564 I565 W595	M496-F560 HydrophobicContact CE-CE2 3.32Å; M496-F560 HydrophobicContact CE-CZ 3.4Å; W499-F560 VanDerWaalsContact CH2-CA 3.48Å; W499-F560 HydrophobicContact CH2-CB 3.86Å; W499-F560 HydrophobicContact CH2-CD2 4.05Å; W499-F560 HydrophobicContact CH2-CG 4.45Å; W499-F560 HydrophobicContact CZ3-CB 4.3Å; W499-F560 AromaticContact CZ3-CD2 3.72Å; W499-F560 HydrophobicContact CZ3-CD2 3.72Å; L526-F560 HydrophobicContact CB-CD2 3.97Å; L526-F560 HydrophobicContact CB-CE2 3.99Å; L526-F560 HydrophobicContact CB-CG 4.47Å; L526-F560 HydrophobicContact CB-CZ 4.49Å; L526-F560 HydrophobicContact CD1-CB 4.14Å; L526-F560 HydrophobicContact CD1-CD2 4.15Å; L526-F560 HydrophobicContact CD1-CG 4.25Å; L526-F560 HydrophobicContact CD2-CB 4.12Å; L526-F560 HydrophobicContact CD2-CD1 3.92Å; L526-F560 HydrophobicContact CD2-CD2 4.16Å; L526-F560 HydrophobicContact CD2-CE1 4.39Å; L526-F560 HydrophobicContact CD2-CG 3.79Å; L526-F560 HydrophobicContact CG-CD2 4.33Å; L526-F560 HydrophobicContact CG-CG 4.4Å; L529-F560 HydrophobicContact CD1-CD1 4.44Å; L529-F560 HydrophobicContact CD1-CE1 3.65Å; L529-F560 HydrophobicContact CD1-CZ 4.03Å; F541-F560 AromaticContact CD2-CD1 3.91Å; F541-F560 HydrophobicContact CD2-CD1 3.91Å; F541-F560 HydrophobicContact CD2-CE1 4.16Å; F541-F560 AromaticContact CE2-CD1 3.62Å; F541-F560 HydrophobicContact CE2-CD1 3.62Å; F541-F560 HydrophobicContact CE2-CE1 4.33Å; F541-F560 HydrophobicContact CE2-CG 4.48Å; F541-F560 HydrophobicContact CZ-CD1 4.46Å; L556-F560 PolarHBondContact O-N 3.37Å; Y557-F560 WeakPolarHBondContact O-CB 3.22Å; Y557-F560 PolarHBondContact O-N 2.79Å; S558-F560 VanDerWaalsContact C-N 3.33Å; F560-R562 VanDerWaalsContact C-N 3.3Å; F560-R562 PolarHBondContact O-N 2.67Å; F560-T563 PolarHBondContact O-N 2.97Å; F560-F564 HydrophobicContact CD1-CB 4.4Å; F560-F564 AromaticContact CD2-CD2 3.53Å; F560-F564 HydrophobicContact CD2-CD2 3.53Å; F560-F564 HydrophobicContact CD2-CE2 4.07Å; F560-F564 HydrophobicContact CD2-CG 4.4Å; F560-F564 HydrophobicContact CE1-CB 3.98Å; F560-F564 HydrophobicContact CE2-CB 4.24Å; F560-F564 AromaticContact CE2-CD2 3.47Å; F560-F564 HydrophobicContact CE2-CD2 3.47Å; F560-F564 VanDerWaalsContact CE2-CD2 3.47Å; F560-F564 HydrophobicContact CE2-CE2 4.03Å; F560-F564 AromaticContact CE2-CG 3.99Å; F560-F564 HydrophobicContact CE2-CG 3.99Å; F560-F564 HydrophobicContact CG-CD2 4.12Å; F560-F564 HydrophobicContact CZ-CB 3.89Å; F560-F564 HydrophobicContact CZ-CD2 4.02Å; F560-F564 HydrophobicContact CZ-CG 4.11Å; F560-F564 PolarHBondContact O-N 3.18Å; F560-I565 HydrophobicContact CD1-CG1 4.1Å; F560-I565 HydrophobicContact CE1-CD1 4.14Å; F560-I565 HydrophobicContact CE1-CG1 3.93Å; F560-W595 HydrophobicContact CE1-CH2 4.45Å; F560-W595 HydrophobicContact CZ-CH2 4.19Å; F560-W595 HydrophobicContact CZ-CZ3 4.49Å
561	Q	91	Very high	82	Confident	31 Å²	31	46.7 Å²	46.7	15%	0.145	26%	0.255	C	S	.	.	I	π-helix	trans	-54.5	-46.9	178	-170	177.3	-8.6	0	0	111.7	F541 Y557 T563 I565 S566	F541-Q561 HydrophobicContact CE1-CB 3.74Å; F541-Q561 HydrophobicContact CE1-CG 3.69Å; F541-Q561 HydrophobicContact CZ-CB 3.63Å; F541-Q561 HydrophobicContact CZ-CG 4.13Å; Y557-Q561 PolarHBondContact O-N 2.95Å; Q561-T563 VanDerWaalsContact C-N 3.26Å; Q561-T563 PolarHBondContact O-N 3.38Å; Q561-I565 HydrophobicContact CG-CB 4.24Å; Q561-I565 HydrophobicContact CG-CG2 4.48Å; Q561-I565 PolarHBondContact O-N 2.98Å; Q561-S566 PolarHBondContact O-N 3.47Å
562	R	85.7	Confident	80.7	Confident	132 Å²	132	46.6 Å²	46.6	50%	0.498	25%	0.247	S	C	.	.	I	π-helix	trans	-63.9	-31.3	178.6	-68.8	176.7	-152.8	118.3	-0.5	113.1	S558 F560	S558-R562 VanDerWaalsContact O-CG 3.3Å; S558-R562 WeakPolarHBondContact O-CG 3.45Å; S558-R562 PolarHBondContact O-N 2.82Å; F560-R562 VanDerWaalsContact C-N 3.3Å; F560-R562 PolarHBondContact O-N 2.67Å
563	T	87.3	Confident	79.3	Confident	18 Å²	18	53.3 Å²	53.3	11%	0.11	27%	0.267	C	S	.	.	I	π-helix	trans	-89.8	-43	-172.5	-52.7	0	0	0	0	111.9	W499 A559 F560 Q561 M589 F590	W499-T563 HydrophobicContact CZ2-CG2 4.36Å; W499-T563 WeakPolarHBondContact CZ2-OG1 3.38Å; A559-T563 WeakPolarHBondContact O-CB 3.46Å; A559-T563 PolarHBondContact O-N 3.25Å; A559-T563 PolarHBondContact O-OG1 3.33Å; F560-T563 PolarHBondContact O-N 2.97Å; Q561-T563 VanDerWaalsContact C-N 3.26Å; Q561-T563 PolarHBondContact O-N 3.38Å; T563-M589 HydrophobicContact CG2-CB 4.27Å; T563-M589 HydrophobicContact CG2-SD 4.42Å; T563-M589 PolarHBondContact O-N 2.97Å; T563-M589 VanDerWaalsContact O-N 3.07Å; T563-F590 HydrophobicContact CG2-CD2 3.78Å; T563-F590 HydrophobicContact CG2-CE2 3.88Å; T563-F590 PolarHBondContact O-N 3.44Å; T563-F590 VanDerWaalsContact O-N 3.14Å
564	F	87.9	Confident	77.9	Confident	3 Å²	3	54.9 Å²	54.9	1%	0.013	28%	0.278	C	S	.	.	I	π-helix	trans	-119.3	-24.1	-166.1	-66.2	-76.2	0	0	0	115.5	M496 W499 F560 F590 W595	M496-F564 HydrophobicContact CG-CE1 4.39Å; M496-F564 HydrophobicContact CG-CZ 4.17Å; W499-F564 HydrophobicContact CB-CZ 4.49Å; W499-F564 AromaticContact CD2-CE2 3.59Å; W499-F564 HydrophobicContact CD2-CE2 3.59Å; W499-F564 HydrophobicContact CD2-CZ 4.15Å; W499-F564 AromaticContact CE2-CE2 3.84Å; W499-F564 AromaticContact CE3-CE2 3.64Å; W499-F564 HydrophobicContact CE3-CE2 3.64Å; W499-F564 HydrophobicContact CE3-CZ 4.39Å; W499-F564 HydrophobicContact CG-CE2 4.08Å; W499-F564 HydrophobicContact CG-CZ 4.17Å; W499-F564 HydrophobicContact CH2-CE2 4.3Å; W499-F564 HydrophobicContact CZ2-CE2 4.17Å; W499-F564 HydrophobicContact CZ3-CE2 4.04Å; F560-F564 HydrophobicContact CD1-CB 4.4Å; F560-F564 AromaticContact CD2-CD2 3.53Å; F560-F564 HydrophobicContact CD2-CD2 3.53Å; F560-F564 HydrophobicContact CD2-CE2 4.07Å; F560-F564 HydrophobicContact CD2-CG 4.4Å; F560-F564 HydrophobicContact CE1-CB 3.98Å; F560-F564 HydrophobicContact CE2-CB 4.24Å; F560-F564 AromaticContact CE2-CD2 3.47Å; F560-F564 HydrophobicContact CE2-CD2 3.47Å; F560-F564 VanDerWaalsContact CE2-CD2 3.47Å; F560-F564 HydrophobicContact CE2-CE2 4.03Å; F560-F564 AromaticContact CE2-CG 3.99Å; F560-F564 HydrophobicContact CE2-CG 3.99Å; F560-F564 HydrophobicContact CG-CD2 4.12Å; F560-F564 HydrophobicContact CZ-CB 3.89Å; F560-F564 HydrophobicContact CZ-CD2 4.02Å; F560-F564 HydrophobicContact CZ-CG 4.11Å; F560-F564 PolarHBondContact O-N 3.18Å; F564-F590 HydrophobicContact CD1-CB 4.07Å; F564-F590 AromaticContact CD1-CD2 4Å; F564-F590 HydrophobicContact CD1-CD2 4Å; F564-F590 HydrophobicContact CD1-CG 4.44Å; F564-F590 HydrophobicContact CE1-CB 4.22Å; F564-F590 AromaticContact CE1-CD2 3.52Å; F564-F590 HydrophobicContact CE1-CD2 3.52Å; F564-F590 HydrophobicContact CE1-CE2 4.24Å; F564-F590 HydrophobicContact CE1-CG 4.13Å; F564-F590 HydrophobicContact CZ-CD2 4.03Å; F564-F590 HydrophobicContact CZ-CE2 4.36Å; F564-W595 HydrophobicContact CB-CZ2 3.92Å; F564-W595 HydrophobicContact CD1-CB 4.49Å; F564-W595 AromaticContact CD1-CD1 3.67Å; F564-W595 HydrophobicContact CD1-CD2 4.29Å; F564-W595 AromaticContact CD1-CG 3.94Å; F564-W595 HydrophobicContact CD1-CG 3.94Å; F564-W595 AromaticContact CD1-NE1 3.82Å; F564-W595 PolarHBondContact O-NE1 2.83Å
565	I	86.2	Confident	76.4	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.072	30%	0.301	C	S	.	.	I	π-helix	trans	-101.5	-44.6	-174.5	-59.4	-68.3	0	0	0	112	V537 I538 F541 F560 Q561 W595	V537-I565 HydrophobicContact CG1-CD1 3.9Å; I538-I565 HydrophobicContact CG1-CG2 4.38Å; I538-I565 HydrophobicContact CG2-CG2 4.48Å; F541-I565 HydrophobicContact CB-CD1 4.04Å; F541-I565 HydrophobicContact CB-CG1 4.39Å; F541-I565 HydrophobicContact CD1-CG1 3.97Å; F541-I565 HydrophobicContact CD1-CG2 4.23Å; F541-I565 HydrophobicContact CD2-CD1 4.49Å; F541-I565 HydrophobicContact CD2-CG1 4.15Å; F541-I565 HydrophobicContact CE1-CG1 4.38Å; F541-I565 HydrophobicContact CG-CD1 4.07Å; F541-I565 HydrophobicContact CG-CG1 3.87Å; F560-I565 HydrophobicContact CD1-CG1 4.1Å; F560-I565 HydrophobicContact CE1-CD1 4.14Å; F560-I565 HydrophobicContact CE1-CG1 3.93Å; Q561-I565 HydrophobicContact CG-CB 4.24Å; Q561-I565 HydrophobicContact CG-CG2 4.48Å; Q561-I565 PolarHBondContact O-N 2.98Å; I565-W595 HydrophobicContact CD1-CH2 4.19Å; I565-W595 HydrophobicContact CD1-CZ2 3.92Å
566	S	75.2	Confident	75.5	Confident	32 Å²	32	55.2 Å²	55.2	22%	0.224	31%	0.306	C	S	.	.			trans	110.2	139.7	-168.7	-55.9	0	0	0	0	111.3	Q561 A586 P588	Q561-S566 PolarHBondContact O-N 3.47Å; S566-A586 VanDerWaalsContact CB-O 3.31Å; S566-A586 WeakPolarHBondContact CB-O 3.45Å; S566-A586 PolarHBondContact OG-O 2.63Å; S566-P588 WeakPolarHBondContact OG-CD 3.23Å; S566-P588 VanDerWaalsContact OG-CG 3.31Å; S566-P588 WeakPolarHBondContact OG-CG 3.37Å
567	A	60.9	Low	74.3	Confident	19 Å²	19	57.4 Å²	57.4	16%	0.157	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-82.5	134.4	167.9	0	0	0	0	0	108.7	A585 A586	A567-A585 CarbonylContact O-C 3.45Å; A567-A585 VanDerWaalsContact O-CA 3.31Å; A567-A585 WeakPolarHBondContact O-CA 3.28Å; A567-A585 WeakPolarHBondContact O-CB 3.27Å; A567-A586 HydrophobicContact CB-CB 4.38Å; A567-A586 PolarHBondContact O-N 3.47Å; A567-A586 VanDerWaalsContact O-N 3.09Å
568	P	57.4	Low	73.2	Confident	89 Å²	89	63.7 Å²	63.7	58%	0.578	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-56.5	154	172.6	21.7	-30.3	0	0	0	111	G570	P568-G570 PolarHBondContact O-N 3Å
569	A	53.5	Low	71.6	Confident	58 Å²	58	68.6 Å²	68.6	48%	0.479	38%	0.378	S	S	.	.	S	Bend	trans	-53.5	135	169.1	0	0	0	0	0	109.1
570	G	65.2	Low	70.4	Confident	31 Å²	31	72.1 Å²	72.1	32%	0.32	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-178.2	-171.8	0	0	0	0	0	114	P568 L582	P568-G570 PolarHBondContact O-N 3Å; G570-L582 PolarHBondContact N-O 3.47Å; G570-L582 WeakPolarHBondContact O-CA 3.49Å; G570-L582 VanDerWaalsContact O-CB 3.24Å; G570-L582 WeakPolarHBondContact O-CB 3.48Å; G570-L582 PolarHBondContact O-N 3.22Å
571	V	57.9	Low	68.8	Low	91 Å²	91	75.9 Å²	75.9	55%	0.552	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.6	-173.8	-170.8	0	0	0	0	111.5	M579 I580	V571-M579 HydrophobicContact CB-CE 4.37Å; V571-M579 HydrophobicContact CG1-CB 3.57Å; V571-M579 HydrophobicContact CG1-CE 3.55Å; V571-M579 HydrophobicContact CG1-CG 3.8Å; V571-I580 CarbonylContact C-O 3.54Å; V571-I580 WeakPolarHBondContact CA-O 3.25Å
572	R	62.3	Low	67.3	Low	110 Å²	110	76.3 Å²	76.3	42%	0.415	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	147.5	176.2	-119.9	-171.6	-176.5	174.3	-1.1	110.5	M579 I580 L582	R572-M579 CarbonylContact O-C 3.5Å; R572-M579 VanDerWaalsContact O-CA 3.25Å; R572-M579 WeakPolarHBondContact O-CA 3.21Å; R572-I580 HydrophobicContact CB-CB 4.39Å; R572-I580 PolarHBondContact N-O 3.23Å; R572-I580 PolarHBondContact O-N 3.42Å; R572-L582 HydrophobicContact CB-CD1 4.36Å; R572-L582 HydrophobicContact CG-CD1 4.15Å
573	R	58.8	Low	65.9	Low	204 Å²	204	76.7 Å²	76.7	77%	0.77	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	128	162.1	-102.6	176.9	171.9	152.7	-2.6	109.7	H578 M579	R573-H578 CarbonylContact C-O 3.48Å; R573-H578 WeakPolarHBondContact CA-O 3Å; R573-M579 HydrophobicContact CG-CG 4.37Å
574	S	60.2	Low	64.5	Low	33 Å²	33	78.9 Å²	78.9	23%	0.231	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-66.1	161.2	167.5	-170.7	0	0	0	0	110.4	D576 G577 H578	S574-D576 PolarHBondContact O-N 3.36Å; S574-G577 PolarHBondContact O-N 3.23Å; S574-H578 WeakPolarHBondContact CB-O 3.13Å; S574-H578 PolarHBondContact N-O 3.35Å
575	S	62	Low	63.4	Low	124 Å²	124	81.6 Å²	81.6	87%	0.867	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-35.7	167.4	-35.5	0	0	0	0	111.9	G577	S575-G577 VanDerWaalsContact C-N 3.27Å; S575-G577 PolarHBondContact O-N 3.1Å
576	D	73.1	Confident	62.4	Low	128 Å²	128	82 Å²	82	68%	0.684	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	8.9	-177.7	-42.9	-49.7	0	0	0	113	S574 H578	S574-D576 PolarHBondContact O-N 3.36Å; D576-H578 VanDerWaalsContact C-N 3.34Å; D576-H578 PolarHBondContact O-N 3.49Å
577	G	68	Low	62.2	Low	45 Å²	45	89.4 Å²	89.4	46%	0.464	52%	0.518	S	S	.	.	S	Bend	trans	86.3	-9.5	178.1	0	0	0	0	0	115.8	S574 S575	S574-G577 PolarHBondContact O-N 3.23Å; S575-G577 VanDerWaalsContact C-N 3.27Å; S575-G577 PolarHBondContact O-N 3.1Å
578	H	69.4	Low	63	Low	132 Å²	132	89.6 Å²	89.6	61%	0.611	52%	0.517	S	S	*	.			trans	-69.6	141.8	178.8	-69.2	-59.9	0	0	0	113.8	R573 S574 D576 I580	R573-H578 CarbonylContact C-O 3.48Å; R573-H578 WeakPolarHBondContact CA-O 3Å; S574-H578 WeakPolarHBondContact CB-O 3.13Å; S574-H578 PolarHBondContact N-O 3.35Å; D576-H578 VanDerWaalsContact C-N 3.34Å; D576-H578 PolarHBondContact O-N 3.49Å; H578-I580 PolarHBondContact O-N 2.73Å
579	M	59.2	Low	63.7	Low	139 Å²	139	92 Å²	92	69%	0.685	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	111.3	172.8	-83.6	167.9	63.5	0	0	110.9	V571 R572 R573	V571-M579 HydrophobicContact CB-CE 4.37Å; V571-M579 HydrophobicContact CG1-CB 3.57Å; V571-M579 HydrophobicContact CG1-CE 3.55Å; V571-M579 HydrophobicContact CG1-CG 3.8Å; R572-M579 CarbonylContact O-C 3.5Å; R572-M579 VanDerWaalsContact O-CA 3.25Å; R572-M579 WeakPolarHBondContact O-CA 3.21Å; R573-M579 HydrophobicContact CG-CG 4.37Å
580	I	65.8	Low	64.9	Low	80 Å²	80	90.9 Å²	90.9	41%	0.41	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.5	174.3	-54.5	173.5	0	0	0	108.7	V571 R572 H578 L582	V571-I580 CarbonylContact C-O 3.54Å; V571-I580 WeakPolarHBondContact CA-O 3.25Å; R572-I580 HydrophobicContact CB-CB 4.39Å; R572-I580 PolarHBondContact N-O 3.23Å; R572-I580 PolarHBondContact O-N 3.42Å; H578-I580 PolarHBondContact O-N 2.73Å; I580-L582 PolarHBondContact O-N 2.85Å
581	S	58.3	Low	65.6	Low	81 Å²	81	91.7 Å²	91.7	57%	0.566	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.5	168	-173.4	0	0	0	0	110	T583	S581-T583 PolarHBondContact O-N 2.93Å
582	L	58.9	Low	66.8	Low	40 Å²	40	88.7 Å²	88.7	21%	0.209	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	101.6	168.2	-64.1	166	0	0	0	107.8	G570 R572 I580 A584 A586	G570-L582 PolarHBondContact N-O 3.47Å; G570-L582 WeakPolarHBondContact O-CA 3.49Å; G570-L582 VanDerWaalsContact O-CB 3.24Å; G570-L582 WeakPolarHBondContact O-CB 3.48Å; G570-L582 PolarHBondContact O-N 3.22Å; R572-L582 HydrophobicContact CB-CD1 4.36Å; R572-L582 HydrophobicContact CG-CD1 4.15Å; I580-L582 PolarHBondContact O-N 2.85Å; L582-A584 PolarHBondContact O-N 2.88Å; L582-A586 HydrophobicContact CD1-CB 4.21Å
583	T	56.2	Low	67.5	Low	140 Å²	140	87.5 Å²	87.5	86%	0.859	49%	0.494	S	S	*	.	S	Bend	trans	-65.3	-18.7	177.5	50.1	0	0	0	0	113.2	S581	S581-T583 PolarHBondContact O-N 2.93Å
584	A	58.8	Low	68.3	Low	64 Å²	64	79.1 Å²	79.1	53%	0.529	46%	0.463	S	S	.	.	S	Bend	trans	-132	155.8	174.9	0	0	0	0	0	110.4	L582 A586	L582-A584 PolarHBondContact O-N 2.88Å; A584-A586 PolarHBondContact O-N 3.42Å
585	A	63	Low	69.3	Low	60 Å²	60	77.5 Å²	77.5	50%	0.496	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-53.8	127.9	171.2	0	0	0	0	0	109.2	A567 K587	A567-A585 CarbonylContact O-C 3.45Å; A567-A585 VanDerWaalsContact O-CA 3.31Å; A567-A585 WeakPolarHBondContact O-CA 3.28Å; A567-A585 WeakPolarHBondContact O-CB 3.27Å; A585-K587 PolarHBondContact O-N 2.97Å
586	A	66.2	Low	70.5	Confident	21 Å²	21	72.2 Å²	72.2	17%	0.174	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-64.8	121.8	179.6	0	0	0	0	0	108.5	S566 A567 L582 A584	S566-A586 VanDerWaalsContact CB-O 3.31Å; S566-A586 WeakPolarHBondContact CB-O 3.45Å; S566-A586 PolarHBondContact OG-O 2.63Å; A567-A586 HydrophobicContact CB-CB 4.38Å; A567-A586 PolarHBondContact O-N 3.47Å; A567-A586 VanDerWaalsContact O-N 3.09Å; L582-A586 HydrophobicContact CD1-CB 4.21Å; A584-A586 PolarHBondContact O-N 3.42Å
587	K	71.4	Confident	70.9	Confident	189 Å²	189	66.1 Å²	66.1	82%	0.822	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-51.9	130.7	174.8	-171.5	176	-179.3	178.7	0	108.6	A585	A585-K587 PolarHBondContact O-N 2.97Å
588	P	77.8	Confident	71.6	Confident	22 Å²	22	64.6 Å²	64.6	14%	0.143	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-68	153	-178.3	29	-25.3	0	0	0	108.7	S566 F590	S566-P588 WeakPolarHBondContact OG-CD 3.23Å; S566-P588 VanDerWaalsContact OG-CG 3.31Å; S566-P588 WeakPolarHBondContact OG-CG 3.37Å; P588-F590 WeakPolarHBondContact CB-O 3.28Å; P588-F590 WeakPolarHBondContact CG-O 3.29Å; P588-F590 PolarHBondContact O-N 2.71Å
589	M	72.5	Confident	72.2	Confident	140 Å²	140	62.1 Å²	62.1	69%	0.69	35%	0.354	S	S	*	.	S	Bend	trans	-59.1	-37.2	177.3	-176.6	176.3	178.6	0	0	111	T563	T563-M589 HydrophobicContact CG2-CB 4.27Å; T563-M589 HydrophobicContact CG2-SD 4.42Å; T563-M589 PolarHBondContact O-N 2.97Å; T563-M589 VanDerWaalsContact O-N 3.07Å
590	F	77.3	Confident	73.2	Confident	34 Å²	34	55.7 Å²	55.7	15%	0.149	32%	0.322	C	S	.	.	S	Bend	trans	-120.1	126	171.9	-55.1	-74.6	0	0	0	109.6	F472 T563 F564 P588 M594	F472-F590 HydrophobicContact CB-CE1 4.3Å; F472-F590 AromaticContact CD1-CD1 3.88Å; F472-F590 HydrophobicContact CD1-CD1 3.88Å; F472-F590 HydrophobicContact CD1-CE1 4.28Å; F472-F590 HydrophobicContact CD1-CG 4.35Å; T563-F590 HydrophobicContact CG2-CD2 3.78Å; T563-F590 HydrophobicContact CG2-CE2 3.88Å; T563-F590 PolarHBondContact O-N 3.44Å; T563-F590 VanDerWaalsContact O-N 3.14Å; F564-F590 HydrophobicContact CD1-CB 4.07Å; F564-F590 AromaticContact CD1-CD2 4Å; F564-F590 HydrophobicContact CD1-CD2 4Å; F564-F590 HydrophobicContact CD1-CG 4.44Å; F564-F590 HydrophobicContact CE1-CB 4.22Å; F564-F590 AromaticContact CE1-CD2 3.52Å; F564-F590 HydrophobicContact CE1-CD2 3.52Å; F564-F590 HydrophobicContact CE1-CE2 4.24Å; F564-F590 HydrophobicContact CE1-CG 4.13Å; F564-F590 HydrophobicContact CZ-CD2 4.03Å; F564-F590 HydrophobicContact CZ-CE2 4.36Å; P588-F590 WeakPolarHBondContact CB-O 3.28Å; P588-F590 WeakPolarHBondContact CG-O 3.29Å; P588-F590 PolarHBondContact O-N 2.71Å; F590-M594 HydrophobicContact CB-SD 4.21Å; F590-M594 HydrophobicContact CD1-SD 3.69Å; F590-M594 HydrophobicContact CG-SD 4.44Å
591	S	80.2	Confident	73.7	Confident	48 Å²	48	52 Å²	52	34%	0.336	30%	0.303	S	S	.	.			trans	-60.3	148.6	174.8	179.7	0	0	0	0	110.6	T593 M594	S591-T593 PolarHBondContact O-N 2.94Å; S591-T593 PolarHBondContact OG-N 3.1Å; S591-T593 PolarHBondContact OG-OG1 3.48Å; S591-M594 WeakPolarHBondContact O-CA 3.05Å; S591-M594 WeakPolarHBondContact O-CB 3.2Å; S591-M594 PolarHBondContact O-N 2.86Å
592	L	82.9	Confident	74.6	Confident	28 Å²	28	50.6 Å²	50.6	15%	0.147	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-57.7	-37.7	175.7	-177.5	60.8	0	0	0	112.8	Q534 V537 M594 W595 N596	Q534-L592 HydrophobicContact CG-CD2 3.49Å; Q534-L592 VanDerWaalsContact CG-CD2 3.49Å; Q534-L592 HydrophobicContact CG-CG 3.75Å; Q534-L592 WeakPolarHBondContact O-CD2 3.32Å; V537-L592 HydrophobicContact CB-CD1 4.05Å; V537-L592 HydrophobicContact CB-CD2 4.26Å; V537-L592 HydrophobicContact CG1-CD1 3.72Å; V537-L592 HydrophobicContact CG2-CD1 4.11Å; L592-M594 PolarHBondContact O-N 3.06Å; L592-M594 VanDerWaalsContact O-N 3.15Å; L592-W595 HydrophobicContact CD1-CD2 4.2Å; L592-W595 VanDerWaalsContact CD1-CE2 3.48Å; L592-W595 HydrophobicContact CD1-CH2 3.71Å; L592-W595 HydrophobicContact CD1-CZ2 3.21Å; L592-W595 HydrophobicContact CD1-CZ3 4.35Å; L592-W595 PolarHBondContact O-N 3.11Å; L592-N596 WeakPolarHBondContact O-CB 3.28Å; L592-N596 PolarHBondContact O-N 3.28Å; L592-N596 VanDerWaalsContact O-N 3.13Å
593	T	77.7	Confident	75.5	Confident	86 Å²	86	51.2 Å²	51.2	53%	0.528	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-61.6	-17.5	173	51.8	0	0	0	0	113.7	S591	S591-T593 PolarHBondContact O-N 2.94Å; S591-T593 PolarHBondContact OG-N 3.1Å; S591-T593 PolarHBondContact OG-OG1 3.48Å
594	M	75	Confident	76.4	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.133	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-95	-10.5	-176.5	-167	-171.6	-85.1	0	0	112.9	F472 V474 T491 F590 S591 L592	F472-M594 HydrophobicContact CD1-CG 3.85Å; F472-M594 HydrophobicContact CD1-SD 3.99Å; F472-M594 HydrophobicContact CE1-CG 4.08Å; F472-M594 WeakPolarHBondContact CE1-O 3.41Å; F472-M594 WeakPolarHBondContact CZ-O 3.19Å; V474-M594 HydrophobicContact CG2-CE 4.05Å; T491-M594 WeakPolarHBondContact CB-O 3.4Å; T491-M594 HydrophobicContact CG2-CG 4.1Å; T491-M594 WeakPolarHBondContact CG2-O 3.4Å; T491-M594 VanDerWaalsContact OG1-C 3.22Å; T491-M594 PolarHBondContact OG1-O 3.46Å; F590-M594 HydrophobicContact CB-SD 4.21Å; F590-M594 HydrophobicContact CD1-SD 3.69Å; F590-M594 HydrophobicContact CG-SD 4.44Å; S591-M594 WeakPolarHBondContact O-CA 3.05Å; S591-M594 WeakPolarHBondContact O-CB 3.2Å; S591-M594 PolarHBondContact O-N 2.86Å; L592-M594 PolarHBondContact O-N 3.06Å; L592-M594 VanDerWaalsContact O-N 3.15Å
595	W	82.7	Confident	77.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-10.5	179.3	57.6	-93.8	0	0	0	114.1	F472 M496 L529 A530 V537 F560 F564 I565 L592	F472-W595 HydrophobicContact CE1-CB 3.52Å; F472-W595 HydrophobicContact CZ-CB 3.42Å; F472-W595 VanDerWaalsContact CZ-CB 3.42Å; M496-W595 HydrophobicContact CE-CE3 3.9Å; M496-W595 HydrophobicContact CE-CZ3 3.93Å; M496-W595 HydrophobicContact SD-CE3 4.22Å; L529-W595 HydrophobicContact CB-CH2 4.07Å; L529-W595 HydrophobicContact CB-CZ3 3.99Å; A530-W595 HydrophobicContact CB-CE3 3.95Å; A530-W595 HydrophobicContact CB-CZ3 4.15Å; V537-W595 HydrophobicContact CG1-CH2 3.46Å; V537-W595 VanDerWaalsContact CG1-CH2 3.46Å; V537-W595 HydrophobicContact CG1-CZ2 4.02Å; V537-W595 HydrophobicContact CG1-CZ3 4.37Å; F560-W595 HydrophobicContact CE1-CH2 4.45Å; F560-W595 HydrophobicContact CZ-CH2 4.19Å; F560-W595 HydrophobicContact CZ-CZ3 4.49Å; F564-W595 HydrophobicContact CB-CZ2 3.92Å; F564-W595 HydrophobicContact CD1-CB 4.49Å; F564-W595 AromaticContact CD1-CD1 3.67Å; F564-W595 HydrophobicContact CD1-CD2 4.29Å; F564-W595 AromaticContact CD1-CG 3.94Å; F564-W595 HydrophobicContact CD1-CG 3.94Å; F564-W595 AromaticContact CD1-NE1 3.82Å; F564-W595 PolarHBondContact O-NE1 2.83Å; I565-W595 HydrophobicContact CD1-CH2 4.19Å; I565-W595 HydrophobicContact CD1-CZ2 3.92Å; L592-W595 HydrophobicContact CD1-CD2 4.2Å; L592-W595 VanDerWaalsContact CD1-CE2 3.48Å; L592-W595 HydrophobicContact CD1-CH2 3.71Å; L592-W595 HydrophobicContact CD1-CZ2 3.21Å; L592-W595 HydrophobicContact CD1-CZ3 4.35Å; L592-W595 PolarHBondContact O-N 3.11Å
596	N	86	Confident	77.9	Confident	13 Å²	13	43.1 Å²	43.1	7%	0.07	25%	0.246	C	C	.	.			trans	-71.9	132	175.8	-166.5	-86.4	0	0	0	110.2	A530 V532 L592 H598	A530-N596 PolarHBondContact O-ND2 3.33Å; V532-N596 PolarHBondContact O-ND2 3.36Å; L592-N596 WeakPolarHBondContact O-CB 3.28Å; L592-N596 PolarHBondContact O-N 3.28Å; L592-N596 VanDerWaalsContact O-N 3.13Å; N596-H598 WeakPolarHBondContact OD1-CB 3.23Å; N596-H598 PolarHBondContact OD1-N 2.94Å
597	C	82.1	Confident	78.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.246	C	C	.	.			trans	-112.4	4	-179.4	-69.2	0	0	0	0	112.4	T491 L493 A530 F531 D599 M600 V601	T491-C597 PolarHBondContact O-SG 3.25Å; L493-C597 WeakPolarHBondContact CD2-SG 3.46Å; L493-C597 VanDerWaalsContact CG-SG 3.5Å; A530-C597 WeakPolarHBondContact O-CA 3.47Å; A530-C597 PolarHBondContact O-N 3.35Å; F531-C597 HydrophobicContact CD1-CB 4.45Å; F531-C597 HydrophobicContact CE1-CB 4.37Å; C597-D599 VanDerWaalsContact C-N 3.32Å; C597-D599 PolarHBondContact O-N 3.22Å; C597-M600 HydrophobicContact CB-CE 3.83Å; C597-M600 PolarHBondContact O-N 3.38Å; C597-V601 HydrophobicContact CB-CG2 4.28Å; C597-V601 WeakPolarHBondContact O-CB 3.38Å; C597-V601 WeakPolarHBondContact O-CG2 3.26Å; C597-V601 PolarHBondContact O-N 3.42Å
598	H	81.4	Confident	78.4	Confident	12 Å²	12	36 Å²	36	6%	0.056	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-48	-177	-176.8	79	0	0	0	111.7	A530 F531 N596 S602	A530-H598 PolarHBondContact O-N 2.86Å; F531-H598 PolarHBondContact O-ND1 3.05Å; N596-H598 WeakPolarHBondContact OD1-CB 3.23Å; N596-H598 PolarHBondContact OD1-N 2.94Å; H598-S602 VanDerWaalsContact O-CB 3.3Å; H598-S602 WeakPolarHBondContact O-CB 3.05Å; H598-S602 PolarHBondContact O-N 3.16Å; H598-S602 PolarHBondContact O-OG 3.35Å
599	D	82.1	Confident	78.4	Confident	81 Å²	81	35.3 Å²	35.3	43%	0.433	21%	0.208	S	C	.	.	H	α-helix	trans	-71.4	-42.6	-178.6	-61.5	-25.8	0	0	0	111.3	Y490 C597 V601 S602 A603	Y490-D599 HydrophobicContact CE1-CB 4.19Å; C597-D599 VanDerWaalsContact C-N 3.32Å; C597-D599 PolarHBondContact O-N 3.22Å; D599-V601 VanDerWaalsContact C-N 3.29Å; D599-V601 PolarHBondContact O-N 3.5Å; D599-S602 CarbonylContact O-C 3.55Å; D599-S602 PolarHBondContact O-N 3.01Å; D599-A603 WeakPolarHBondContact O-CB 3.33Å; D599-A603 PolarHBondContact O-N 3.22Å
600	M	81.1	Confident	78.5	Confident	4 Å²	4	29.1 Å²	29.1	2%	0.02	18%	0.177	C	C	.	.	H	α-helix	trans	-55.4	-43.9	175.4	-177.4	-175.6	75.4	0	0	112.2	I469 Y490 C597 G604 Y605 V609	I469-M600 HydrophobicContact CG2-SD 4.28Å; Y490-M600 HydrophobicContact CD1-CB 3.63Å; Y490-M600 HydrophobicContact CD1-CG 4.26Å; Y490-M600 HydrophobicContact CE1-CB 4.28Å; Y490-M600 HydrophobicContact CG-CB 4.19Å; Y490-M600 HydrophobicContact CG-CG 4.32Å; C597-M600 HydrophobicContact CB-CE 3.83Å; C597-M600 PolarHBondContact O-N 3.38Å; M600-G604 PolarHBondContact O-N 3.31Å; M600-Y605 HydrophobicContact CG-CD2 4.16Å; M600-Y605 HydrophobicContact CG-CG 4.43Å; M600-Y605 WeakPolarHBondContact O-CB 3.39Å; M600-Y605 WeakPolarHBondContact O-CD2 3.48Å; M600-Y605 PolarHBondContact O-N 2.9Å; M600-V609 HydrophobicContact CE-CG2 3.91Å; M600-V609 HydrophobicContact SD-CG2 3.69Å
601	V	76.7	Confident	78.3	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-76.9	-38.2	-179.7	-176.5	0	0	0	0	110.5	F531 C597 D599 A603 G604 L606 L673 L677	F531-V601 HydrophobicContact CD1-CG2 3.92Å; F531-V601 HydrophobicContact CE1-CG2 3.79Å; C597-V601 HydrophobicContact CB-CG2 4.28Å; C597-V601 WeakPolarHBondContact O-CB 3.38Å; C597-V601 WeakPolarHBondContact O-CG2 3.26Å; C597-V601 PolarHBondContact O-N 3.42Å; D599-V601 VanDerWaalsContact C-N 3.29Å; D599-V601 PolarHBondContact O-N 3.5Å; V601-A603 PolarHBondContact O-N 3.02Å; V601-G604 WeakPolarHBondContact O-CA 3.44Å; V601-G604 PolarHBondContact O-N 2.8Å; V601-L606 HydrophobicContact CG1-CB 4.16Å; V601-L606 HydrophobicContact CG2-CB 4.24Å; V601-L606 HydrophobicContact CG2-CD1 4.06Å; V601-L673 HydrophobicContact CB-CD2 4.35Å; V601-L673 HydrophobicContact CG1-CD2 3.29Å; V601-L673 HydrophobicContact CG1-CG 3.72Å; V601-L673 HydrophobicContact CG2-CD2 4.11Å; V601-L677 HydrophobicContact CB-CD1 3.71Å; V601-L677 HydrophobicContact CG1-CD1 3.17Å; V601-L677 HydrophobicContact CG1-CG 4.15Å
602	S	76.3	Confident	78.3	Confident	52 Å²	52	25.4 Å²	25.4	36%	0.364	16%	0.155	S	C	.	.	H	α-helix	trans	-60.1	-31.4	172.8	-65.1	0	0	0	0	112.5	H598 D599 G604	H598-S602 VanDerWaalsContact O-CB 3.3Å; H598-S602 WeakPolarHBondContact O-CB 3.05Å; H598-S602 PolarHBondContact O-N 3.16Å; H598-S602 PolarHBondContact O-OG 3.35Å; D599-S602 CarbonylContact O-C 3.55Å; D599-S602 PolarHBondContact O-N 3.01Å; S602-G604 PolarHBondContact O-N 3.16Å
603	A	78.8	Confident	77.9	Confident	53 Å²	53	24.9 Å²	24.9	44%	0.438	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.4	172.2	0	0	0	0	0	113.7	D599 V601 Y605	D599-A603 WeakPolarHBondContact O-CB 3.33Å; D599-A603 PolarHBondContact O-N 3.22Å; V601-A603 PolarHBondContact O-N 3.02Å; A603-Y605 HydrophobicContact CB-CD2 3.61Å; A603-Y605 HydrophobicContact CB-CE2 3.48Å; A603-Y605 VanDerWaalsContact CB-CE2 3.48Å
604	G	75.6	Confident	77.6	Confident	45 Å²	45	23.4 Å²	23.4	46%	0.464	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	13.8	176	0	0	0	0	0	115.2	M600 V601 S602 L606	M600-G604 PolarHBondContact O-N 3.31Å; V601-G604 WeakPolarHBondContact O-CA 3.44Å; V601-G604 PolarHBondContact O-N 2.8Å; S602-G604 PolarHBondContact O-N 3.16Å; G604-L606 PolarHBondContact O-N 3.05Å
605	Y	79.6	Confident	77.9	Confident	39 Å²	39	24 Å²	24	15%	0.153	15%	0.145	C	C	.	.			trans	-82.3	-6.2	-175.7	-62	-55.6	0	0	0	115	T405 N467 I469 Y490 M600 A603 R607 V608 V609	T405-Y605 HydrophobicContact CG2-CD1 4.15Å; T405-Y605 HydrophobicContact CG2-CE1 3.58Å; T405-Y605 PolarHBondContact OG1-OH 2.95Å; T405-Y605 VanDerWaalsContact OG1-OH 3.1Å; N467-Y605 PolarHBondContact ND2-OH 3.49Å; I469-Y605 HydrophobicContact CD1-CD1 4.1Å; I469-Y605 HydrophobicContact CD1-CD2 4.34Å; I469-Y605 HydrophobicContact CD1-CG 3.85Å; Y490-Y605 HydrophobicContact CE2-CE2 4.27Å; M600-Y605 HydrophobicContact CG-CD2 4.16Å; M600-Y605 HydrophobicContact CG-CG 4.43Å; M600-Y605 WeakPolarHBondContact O-CB 3.39Å; M600-Y605 WeakPolarHBondContact O-CD2 3.48Å; M600-Y605 PolarHBondContact O-N 2.9Å; A603-Y605 HydrophobicContact CB-CD2 3.61Å; A603-Y605 HydrophobicContact CB-CE2 3.48Å; A603-Y605 VanDerWaalsContact CB-CE2 3.48Å; Y605-R607 VanDerWaalsContact C-N 3.31Å; Y605-R607 PolarHBondContact O-N 3.09Å; Y605-V608 WeakPolarHBondContact O-CB 3.47Å; Y605-V608 PolarHBondContact O-N 3.49Å; Y605-V608 VanDerWaalsContact O-N 3.08Å; Y605-V609 WeakPolarHBondContact O-CG2 3.32Å; Y605-V609 PolarHBondContact O-N 3.11Å
606	L	73.6	Confident	77.7	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.052	15%	0.152	C	C	.	.	H	α-helix	trans	-55.4	-46.3	-178.1	-175.6	79.4	0	0	0	112.3	F531 V601 G604 V608 V609 N610 F669 D670 L673	F531-L606 HydrophobicContact CE1-CD1 4.39Å; V601-L606 HydrophobicContact CG1-CB 4.16Å; V601-L606 HydrophobicContact CG2-CB 4.24Å; V601-L606 HydrophobicContact CG2-CD1 4.06Å; G604-L606 PolarHBondContact O-N 3.05Å; L606-V608 VanDerWaalsContact C-N 3.26Å; L606-V608 PolarHBondContact O-N 3.32Å; L606-V609 PolarHBondContact O-N 2.9Å; L606-N610 PolarHBondContact O-N 3.2Å; L606-F669 HydrophobicContact CD1-CE1 4.33Å; L606-F669 HydrophobicContact CD2-CD1 3.98Å; L606-F669 HydrophobicContact CD2-CE1 3.6Å; L606-F669 HydrophobicContact CG-CE1 4.42Å; L606-D670 HydrophobicContact CD2-CB 4.28Å; L606-D670 VanDerWaalsContact CD2-OD1 3.27Å; L606-D670 WeakPolarHBondContact CD2-OD1 3.4Å; L606-L673 HydrophobicContact CD1-CD2 3.91Å; L606-L673 HydrophobicContact CD2-CB 4.43Å; L606-L673 HydrophobicContact CD2-CD2 3.29Å; L606-L673 HydrophobicContact CD2-CG 4.41Å; L606-L673 HydrophobicContact CG-CD2 4.05Å
607	R	71.9	Confident	77.1	Confident	42 Å²	42	27.6 Å²	27.6	16%	0.158	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-40.6	179.9	-58.7	-163.6	-177.3	-166.2	-5	111.8	Q431 Y605 N610 S611 W662 D670 D671	Q431-R607 HydrophobicContact CG-CB 4.18Å; Y605-R607 VanDerWaalsContact C-N 3.31Å; Y605-R607 PolarHBondContact O-N 3.09Å; R607-N610 PolarHBondContact O-N 2.89Å; R607-S611 WeakPolarHBondContact O-CB 3.48Å; R607-S611 PolarHBondContact O-N 2.76Å; R607-S611 PolarHBondContact O-OG 2.83Å; R607-W662 HydrophobicContact CB-CH2 3.51Å; R607-W662 HydrophobicContact CB-CZ2 3.82Å; R607-W662 HydrophobicContact CG-CH2 3.55Å; R607-W662 HydrophobicContact CG-CZ2 4.33Å; R607-W662 HydrophobicContact CG-CZ3 4.16Å; R607-W662 WeakPolarHBondContact O-CZ2 3.29Å; R607-D670 HydrophobicContact CG-CB 4.27Å; R607-D670 VanDerWaalsContact CG-CG 3.47Å; R607-D670 WeakPolarHBondContact CG-OD1 3.15Å; R607-D670 IonicContact CZ-OD2 2.79Å; R607-D670 IonicContact NE-OD1 2.67Å; R607-D670 IonicContact NE-OD2 3.61Å; R607-D670 PolarHBondContact NE-OD2 3.09Å; R607-D670 IonicContact NH2-OD2 3.44Å; R607-D670 PolarHBondContact NH2-OD2 3.33Å; R607-D671 IonicContact NH2-OD1 3.6Å; R607-D671 PolarHBondContact NH2-OD1 3.33Å
608	V	76.1	Confident	76.8	Confident	18 Å²	18	31.2 Å²	31.2	11%	0.109	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-46.2	178.2	-179.4	0	0	0	0	110.5	L407 A428 I433 Y605 L606 N610 S611 F612	L407-V608 HydrophobicContact CD1-CG1 3.61Å; L407-V608 HydrophobicContact CD2-CG1 3.67Å; L407-V608 HydrophobicContact CG-CG1 4.23Å; A428-V608 HydrophobicContact CB-CB 4.32Å; A428-V608 HydrophobicContact CB-CG1 3.36Å; A428-V608 HydrophobicContact CB-CG2 4Å; I433-V608 HydrophobicContact CD1-CG1 4Å; Y605-V608 WeakPolarHBondContact O-CB 3.47Å; Y605-V608 PolarHBondContact O-N 3.49Å; Y605-V608 VanDerWaalsContact O-N 3.08Å; L606-V608 VanDerWaalsContact C-N 3.26Å; L606-V608 PolarHBondContact O-N 3.32Å; V608-N610 PolarHBondContact O-N 3.15Å; V608-S611 PolarHBondContact O-N 2.89Å; V608-F612 VanDerWaalsContact O-CB 3.31Å; V608-F612 WeakPolarHBondContact O-CB 3.34Å; V608-F612 PolarHBondContact O-N 2.87Å
609	V	78	Confident	76.7	Confident	9 Å²	9	31 Å²	31	6%	0.055	19%	0.19	C	C	.	.	H	α-helix	trans	-59.9	-45.2	176.4	175.4	0	0	0	0	111.4	I469 C492 M600 Y605 L606 S611 F612 E613	I469-V609 HydrophobicContact CD1-CG2 4.39Å; I469-V609 HydrophobicContact CG2-CG2 3.91Å; C492-V609 HydrophobicContact CB-CG1 4.1Å; M600-V609 HydrophobicContact CE-CG2 3.91Å; M600-V609 HydrophobicContact SD-CG2 3.69Å; Y605-V609 WeakPolarHBondContact O-CG2 3.32Å; Y605-V609 PolarHBondContact O-N 3.11Å; L606-V609 PolarHBondContact O-N 2.9Å; V609-S611 VanDerWaalsContact C-N 3.33Å; V609-S611 PolarHBondContact O-N 2.85Å; V609-F612 WeakPolarHBondContact O-CB 3.26Å; V609-F612 PolarHBondContact O-N 3.34Å; V609-E613 VanDerWaalsContact O-CG 3.29Å; V609-E613 WeakPolarHBondContact O-CG 3.47Å; V609-E613 PolarHBondContact O-N 3.29Å
610	N	73.4	Confident	76.4	Confident	10 Å²	10	29.7 Å²	29.7	5%	0.053	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-40	178.3	-74.7	-24.5	0	0	0	112.2	L606 R607 V608 F612 S614 W662 V666 F706	L606-N610 PolarHBondContact O-N 3.2Å; R607-N610 PolarHBondContact O-N 2.89Å; V608-N610 PolarHBondContact O-N 3.15Å; N610-F612 VanDerWaalsContact C-N 3.29Å; N610-S614 PolarHBondContact O-N 2.87Å; N610-S614 VanDerWaalsContact O-N 3.13Å; N610-S614 PolarHBondContact O-OG 3Å; N610-W662 HydrophobicContact CB-CH2 4.47Å; N610-W662 HydrophobicContact CB-CZ2 4.33Å; N610-V666 HydrophobicContact CB-CG1 4.47Å; N610-F706 WeakPolarHBondContact OD1-CE2 3.39Å
611	S	74	Confident	76	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-37.8	174.5	-72.1	0	0	0	0	111.8	Q431 R607 V608 V609 S614 W615 W662	Q431-S611 WeakPolarHBondContact O-CB 3.22Å; Q431-S611 PolarHBondContact O-OG 3.39Å; R607-S611 WeakPolarHBondContact O-CB 3.48Å; R607-S611 PolarHBondContact O-N 2.76Å; R607-S611 PolarHBondContact O-OG 2.83Å; V608-S611 PolarHBondContact O-N 2.89Å; V609-S611 VanDerWaalsContact C-N 3.33Å; V609-S611 PolarHBondContact O-N 2.85Å; S611-S614 PolarHBondContact O-N 3.43Å; S611-W615 WeakPolarHBondContact O-CB 3.14Å; S611-W615 PolarHBondContact O-N 2.8Å; S611-W662 PolarHBondContact OG-NE1 3.45Å
612	F	78.8	Confident	76	Confident	3 Å²	3	33.3 Å²	33.3	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-46	177.3	-175.7	-134.2	0	0	0	112.8	L407 C409 H426 I433 V608 V609 N610 S614 W615 H616	L407-F612 HydrophobicContact CB-CD1 4.02Å; L407-F612 HydrophobicContact CB-CD2 4.23Å; L407-F612 HydrophobicContact CB-CE1 3.88Å; L407-F612 HydrophobicContact CB-CE2 4.16Å; L407-F612 HydrophobicContact CB-CG 4.16Å; L407-F612 HydrophobicContact CB-CZ 3.93Å; L407-F612 HydrophobicContact CD2-CB 3.89Å; L407-F612 HydrophobicContact CD2-CD1 3.78Å; L407-F612 HydrophobicContact CD2-CE1 4.42Å; L407-F612 HydrophobicContact CD2-CG 3.86Å; C409-F612 HydrophobicContact CB-CE1 3.48Å; C409-F612 VanDerWaalsContact CB-CE1 3.48Å; C409-F612 HydrophobicContact CB-CE2 4.24Å; C409-F612 HydrophobicContact CB-CZ 3.19Å; H426-F612 HydrophobicContact CB-CE2 4.37Å; H426-F612 AromaticContact CE1-CE2 3.52Å; H426-F612 AromaticContact CG-CE2 3.75Å; H426-F612 AromaticContact ND1-CE2 3.3Å; H426-F612 VanDerWaalsContact ND1-CE2 3.3Å; H426-F612 WeakPolarHBondContact ND1-CE2 3.28Å; H426-F612 AromaticContact ND1-CZ 3.9Å; I433-F612 HydrophobicContact CD1-CB 3.75Å; I433-F612 HydrophobicContact CD1-CD2 4.37Å; I433-F612 HydrophobicContact CD1-CG 4.46Å; I433-F612 HydrophobicContact CG1-CB 4.15Å; I433-F612 HydrophobicContact CG2-CD2 4.06Å; V608-F612 VanDerWaalsContact O-CB 3.31Å; V608-F612 WeakPolarHBondContact O-CB 3.34Å; V608-F612 PolarHBondContact O-N 2.87Å; V609-F612 WeakPolarHBondContact O-CB 3.26Å; V609-F612 PolarHBondContact O-N 3.34Å; N610-F612 VanDerWaalsContact C-N 3.29Å; F612-S614 VanDerWaalsContact C-N 3.3Å; F612-S614 PolarHBondContact O-N 3Å; F612-W615 HydrophobicContact CE2-CE3 4.5Å; F612-W615 WeakPolarHBondContact O-CB 3.26Å; F612-W615 PolarHBondContact O-N 3.38Å; F612-H616 WeakPolarHBondContact O-CB 3.49Å; F612-H616 PolarHBondContact O-N 3.06Å
613	E	75.2	Confident	76.2	Confident	18 Å²	18	30.9 Å²	30.9	8%	0.084	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-38.7	175.1	-70.8	-73.6	171.5	0	0	112.6	S494 V609 H616 T617	S494-E613 WeakPolarHBondContact CB-OE1 3.35Å; V609-E613 VanDerWaalsContact O-CG 3.29Å; V609-E613 WeakPolarHBondContact O-CG 3.47Å; V609-E613 PolarHBondContact O-N 3.29Å; E613-H616 PolarHBondContact O-N 2.95Å; E613-T617 WeakPolarHBondContact O-CB 3.32Å; E613-T617 PolarHBondContact O-N 2.96Å; E613-T617 PolarHBondContact O-OG1 2.78Å
614	S	71	Confident	76	Confident	54 Å²	54	31 Å²	31	38%	0.378	18%	0.18	S	C	.	.	H	α-helix	trans	-67.4	-44.4	177	-57.7	0	0	0	0	111.1	N610 S611 F612 T617 S618	N610-S614 PolarHBondContact O-N 2.87Å; N610-S614 VanDerWaalsContact O-N 3.13Å; N610-S614 PolarHBondContact O-OG 3Å; S611-S614 PolarHBondContact O-N 3.43Å; F612-S614 VanDerWaalsContact C-N 3.3Å; F612-S614 PolarHBondContact O-N 3Å; S614-T617 PolarHBondContact O-N 3.47Å; S614-S618 PolarHBondContact O-N 2.92Å
615	W	81.9	Confident	75.8	Confident	39 Å²	39	34.2 Å²	34.2	15%	0.148	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-46.9	173.8	179.8	94.5	0	0	0	111.2	H426 I433 P435 Y438 S611 F612 T617 S618 L619	H426-W615 AromaticContact CE1-CE3 3.98Å; H426-W615 AromaticContact CE1-CH2 3.65Å; H426-W615 AromaticContact CE1-CZ3 3.41Å; H426-W615 VanDerWaalsContact CE1-CZ3 3.41Å; H426-W615 WeakPolarHBondContact CE1-CZ3 3.48Å; H426-W615 AromaticContact NE2-CD2 3.79Å; H426-W615 AromaticContact NE2-CE2 3.75Å; H426-W615 AromaticContact NE2-CE3 3.4Å; H426-W615 AromaticContact NE2-CH2 2.95Å; H426-W615 WeakPolarHBondContact NE2-CH2 3.49Å; H426-W615 AromaticContact NE2-CZ2 3.39Å; H426-W615 WeakPolarHBondContact NE2-CZ2 3.45Å; H426-W615 AromaticContact NE2-CZ3 2.99Å; H426-W615 WeakPolarHBondContact NE2-CZ3 3.48Å; I433-W615 HydrophobicContact CB-CB 4.14Å; I433-W615 HydrophobicContact CB-CG 4.21Å; I433-W615 HydrophobicContact CG1-CB 4.45Å; I433-W615 HydrophobicContact CG2-CB 4.09Å; I433-W615 HydrophobicContact CG2-CD2 4.17Å; I433-W615 HydrophobicContact CG2-CG 3.84Å; P435-W615 HydrophobicContact CB-CH2 4.16Å; P435-W615 HydrophobicContact CB-CZ2 3.64Å; P435-W615 HydrophobicContact CG-CZ2 3.82Å; Y438-W615 AromaticContact CE1-CH2 3.98Å; Y438-W615 HydrophobicContact CE1-CH2 3.98Å; Y438-W615 AromaticContact CZ-CH2 3.95Å; Y438-W615 WeakPolarHBondContact OH-CH2 3.36Å; Y438-W615 WeakPolarHBondContact OH-CZ2 3.43Å; S611-W615 WeakPolarHBondContact O-CB 3.14Å; S611-W615 PolarHBondContact O-N 2.8Å; F612-W615 HydrophobicContact CE2-CE3 4.5Å; F612-W615 WeakPolarHBondContact O-CB 3.26Å; F612-W615 PolarHBondContact O-N 3.38Å; W615-T617 VanDerWaalsContact C-N 3.33Å; W615-T617 PolarHBondContact O-N 2.91Å; W615-S618 CarbonylContact O-C 3.59Å; W615-S618 WeakPolarHBondContact O-CA 3.5Å; W615-S618 VanDerWaalsContact O-CB 3.3Å; W615-S618 WeakPolarHBondContact O-CB 3.31Å; W615-S618 PolarHBondContact O-N 2.79Å; W615-L619 HydrophobicContact CE3-CB 4.46Å; W615-L619 HydrophobicContact CH2-CB 4.08Å; W615-L619 HydrophobicContact CH2-CD1 4.36Å; W615-L619 HydrophobicContact CH2-CD2 3.55Å; W615-L619 HydrophobicContact CH2-CG 4.18Å; W615-L619 HydrophobicContact CZ2-CB 4.39Å; W615-L619 HydrophobicContact CZ2-CD2 4.46Å; W615-L619 HydrophobicContact CZ3-CB 4.08Å; W615-L619 HydrophobicContact CZ3-CD2 3.74Å; W615-L619 HydrophobicContact CZ3-CG 4.46Å; W615-L619 PolarHBondContact O-N 3.48Å
616	H	77.3	Confident	75.4	Confident	31 Å²	31	33 Å²	33	14%	0.144	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-40.9	-179.4	-172.9	-118.7	0	0	0	111.8	E410 F612 E613 S618 L619 Y620	E410-H616 PolarHBondContact O-NE2 2.81Å; F612-H616 WeakPolarHBondContact O-CB 3.49Å; F612-H616 PolarHBondContact O-N 3.06Å; E613-H616 PolarHBondContact O-N 2.95Å; H616-S618 VanDerWaalsContact C-N 3.33Å; H616-S618 PolarHBondContact O-N 2.76Å; H616-L619 PolarHBondContact O-N 3.32Å; H616-Y620 WeakPolarHBondContact O-CB 3.34Å; H616-Y620 PolarHBondContact O-N 3.44Å
617	T	73.3	Confident	75.3	Confident	59 Å²	59	33.9 Å²	33.9	36%	0.362	20%	0.199	S	C	.	.	H	α-helix	trans	-61.6	-40.7	172.9	-58.4	0	0	0	0	111.7	E613 S614 W615 Y620 L621	E613-T617 WeakPolarHBondContact O-CB 3.32Å; E613-T617 PolarHBondContact O-N 2.96Å; E613-T617 PolarHBondContact O-OG1 2.78Å; S614-T617 PolarHBondContact O-N 3.47Å; W615-T617 VanDerWaalsContact C-N 3.33Å; W615-T617 PolarHBondContact O-N 2.91Å; T617-Y620 WeakPolarHBondContact O-CB 3.27Å; T617-Y620 PolarHBondContact O-N 2.9Å; T617-L621 HydrophobicContact CG2-CD1 4.27Å; T617-L621 VanDerWaalsContact O-CG 3.26Å; T617-L621 WeakPolarHBondContact O-CG 3.39Å; T617-L621 PolarHBondContact O-N 3.28Å
618	S	76	Confident	75.4	Confident	75 Å²	75	42.1 Å²	42.1	52%	0.524	23%	0.23	S	C	.	.	H	α-helix	trans	-64.8	-46.2	176.3	-173.4	0	0	0	0	112.1	S614 W615 H616 Y620 L621 S622	S614-S618 PolarHBondContact O-N 2.92Å; W615-S618 CarbonylContact O-C 3.59Å; W615-S618 WeakPolarHBondContact O-CA 3.5Å; W615-S618 VanDerWaalsContact O-CB 3.3Å; W615-S618 WeakPolarHBondContact O-CB 3.31Å; W615-S618 PolarHBondContact O-N 2.79Å; H616-S618 VanDerWaalsContact C-N 3.33Å; H616-S618 PolarHBondContact O-N 2.76Å; S618-Y620 VanDerWaalsContact C-N 3.34Å; S618-Y620 PolarHBondContact O-N 2.78Å; S618-L621 PolarHBondContact O-N 3.06Å; S618-S622 WeakPolarHBondContact O-CB 3.49Å; S618-S622 PolarHBondContact O-N 3.13Å
619	L	79.9	Confident	75.8	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-56.5	-50.8	174.8	177.3	71.6	0	0	0	110.1	L422 Y438 W615 H616 L621 S622 L623	L422-L619 HydrophobicContact CD2-CD2 3.98Å; Y438-L619 HydrophobicContact CE1-CD1 4.18Å; Y438-L619 HydrophobicContact CE1-CD2 4Å; W615-L619 HydrophobicContact CE3-CB 4.46Å; W615-L619 HydrophobicContact CH2-CB 4.08Å; W615-L619 HydrophobicContact CH2-CD1 4.36Å; W615-L619 HydrophobicContact CH2-CD2 3.55Å; W615-L619 HydrophobicContact CH2-CG 4.18Å; W615-L619 HydrophobicContact CZ2-CB 4.39Å; W615-L619 HydrophobicContact CZ2-CD2 4.46Å; W615-L619 HydrophobicContact CZ3-CB 4.08Å; W615-L619 HydrophobicContact CZ3-CD2 3.74Å; W615-L619 HydrophobicContact CZ3-CG 4.46Å; W615-L619 PolarHBondContact O-N 3.48Å; H616-L619 PolarHBondContact O-N 3.32Å; L619-L621 PolarHBondContact O-N 3.46Å; L619-S622 WeakPolarHBondContact O-CA 3.23Å; L619-S622 WeakPolarHBondContact O-CB 3.48Å; L619-S622 PolarHBondContact O-N 2.82Å; L619-S622 PolarHBondContact O-OG 3.38Å; L619-L623 HydrophobicContact CD1-CD1 3.91Å; L619-L623 HydrophobicContact CD1-CG 4.13Å; L619-L623 HydrophobicContact CD2-CD1 4.3Å; L619-L623 HydrophobicContact CG-CD1 3.86Å; L619-L623 HydrophobicContact CG-CG 4.35Å; L619-L623 WeakPolarHBondContact O-CG 3.46Å; L619-L623 PolarHBondContact O-N 2.85Å
620	Y	75.4	Confident	76.2	Confident	54 Å²	54	42.1 Å²	42.1	21%	0.212	23%	0.229	C	C	.	.	H	α-helix	trans	-52.2	-53.4	178	174.7	-97.7	0	0	0	111.4	K413 V414 H616 T617 S618 S622 L623 V624 V717	K413-Y620 HydrophobicContact CB-CD2 4.45Å; K413-Y620 HydrophobicContact CB-CE2 3.57Å; V414-Y620 HydrophobicContact CG2-CD2 3.04Å; V414-Y620 HydrophobicContact CG2-CE2 3.31Å; V414-Y620 HydrophobicContact CG2-CG 4.04Å; H616-Y620 WeakPolarHBondContact O-CB 3.34Å; H616-Y620 PolarHBondContact O-N 3.44Å; T617-Y620 WeakPolarHBondContact O-CB 3.27Å; T617-Y620 PolarHBondContact O-N 2.9Å; S618-Y620 VanDerWaalsContact C-N 3.34Å; S618-Y620 PolarHBondContact O-N 2.78Å; Y620-S622 PolarHBondContact O-N 3.22Å; Y620-L623 PolarHBondContact O-N 3.47Å; Y620-L623 VanDerWaalsContact O-N 3.15Å; Y620-V624 HydrophobicContact CD1-CG2 4.27Å; Y620-V624 HydrophobicContact CE1-CG2 3.91Å; Y620-V624 HydrophobicContact CE2-CG2 4.2Å; Y620-V624 VanDerWaalsContact O-CG2 3.32Å; Y620-V624 WeakPolarHBondContact O-CG2 3.31Å; Y620-V624 PolarHBondContact O-N 3.06Å; Y620-V624 VanDerWaalsContact O-N 3.08Å; Y620-V717 HydrophobicContact CD1-CG1 4.4Å; Y620-V717 HydrophobicContact CE1-CB 4.09Å; Y620-V717 HydrophobicContact CE1-CG1 3.43Å; Y620-V717 VanDerWaalsContact CE1-CG1 3.43Å; Y620-V717 HydrophobicContact CE1-CG2 4.36Å
621	L	73.4	Confident	76.8	Confident	45 Å²	45	42.1 Å²	42.1	24%	0.236	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-35.2	177.8	-72.2	172.7	0	0	0	112.9	T617 S618 L619 P625 V717 I723 F728	T617-L621 HydrophobicContact CG2-CD1 4.27Å; T617-L621 VanDerWaalsContact O-CG 3.26Å; T617-L621 WeakPolarHBondContact O-CG 3.39Å; T617-L621 PolarHBondContact O-N 3.28Å; S618-L621 PolarHBondContact O-N 3.06Å; L619-L621 PolarHBondContact O-N 3.46Å; L621-P625 WeakPolarHBondContact O-CD 3.25Å; L621-V717 HydrophobicContact CD2-CG1 4.36Å; L621-V717 HydrophobicContact CD2-CG2 3.34Å; L621-I723 HydrophobicContact CD1-CD1 3.93Å; L621-I723 HydrophobicContact CD2-CD1 3.83Å; L621-I723 HydrophobicContact CG-CD1 4.49Å; L621-F728 HydrophobicContact CD1-CE1 3.88Å; L621-F728 HydrophobicContact CD1-CZ 4.02Å
622	S	76.1	Confident	77.3	Confident	36 Å²	36	44.3 Å²	44.3	25%	0.252	24%	0.239	S	C	.	.	H	α-helix	trans	-72.8	-29.7	-179.9	84.7	0	0	0	0	113.1	S618 L619 Y620 K636	S618-S622 WeakPolarHBondContact O-CB 3.49Å; S618-S622 PolarHBondContact O-N 3.13Å; L619-S622 WeakPolarHBondContact O-CA 3.23Å; L619-S622 WeakPolarHBondContact O-CB 3.48Å; L619-S622 PolarHBondContact O-N 2.82Å; L619-S622 PolarHBondContact O-OG 3.38Å; Y620-S622 PolarHBondContact O-N 3.22Å; S622-K636 VanDerWaalsContact OG-CE 3.3Å; S622-K636 WeakPolarHBondContact OG-CE 3.39Å
623	L	81	Confident	77.7	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-89.5	-26.5	-177.5	-68	178.4	0	0	0	112.9	V414 L422 L619 Y620 P625 G626 S627 I633 K636	V414-L623 HydrophobicContact CB-CB 4.18Å; V414-L623 VanDerWaalsContact CG1-C 3.44Å; V414-L623 HydrophobicContact CG1-CB 3.37Å; L422-L623 HydrophobicContact CD2-CD1 4.01Å; L619-L623 HydrophobicContact CD1-CD1 3.91Å; L619-L623 HydrophobicContact CD1-CG 4.13Å; L619-L623 HydrophobicContact CD2-CD1 4.3Å; L619-L623 HydrophobicContact CG-CD1 3.86Å; L619-L623 HydrophobicContact CG-CG 4.35Å; L619-L623 WeakPolarHBondContact O-CG 3.46Å; L619-L623 PolarHBondContact O-N 2.85Å; Y620-L623 PolarHBondContact O-N 3.47Å; Y620-L623 VanDerWaalsContact O-N 3.15Å; L623-P625 VanDerWaalsContact C-CD 3.45Å; L623-G626 CarbonylContact O-C 3.59Å; L623-G626 PolarHBondContact O-N 2.84Å; L623-G626 VanDerWaalsContact O-N 3.11Å; L623-S627 WeakPolarHBondContact O-CA 3.47Å; L623-S627 PolarHBondContact O-N 3.12Å; L623-I633 HydrophobicContact CD2-CB 4.43Å; L623-I633 HydrophobicContact CD2-CG1 4.23Å; L623-I633 HydrophobicContact CD2-CG2 4.21Å; L623-K636 HydrophobicContact CD2-CB 3.84Å; L623-K636 HydrophobicContact CD2-CG 3.67Å
624	V	75.2	Confident	78.4	Confident	54 Å²	54	43.3 Å²	43.3	33%	0.327	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-49.4	-45.7	-178.4	163.9	0	0	0	0	114.2	V414 Y620 G626 S627 V717	V414-V624 HydrophobicContact CG1-CG2 4.24Å; Y620-V624 HydrophobicContact CD1-CG2 4.27Å; Y620-V624 HydrophobicContact CE1-CG2 3.91Å; Y620-V624 HydrophobicContact CE2-CG2 4.2Å; Y620-V624 VanDerWaalsContact O-CG2 3.32Å; Y620-V624 WeakPolarHBondContact O-CG2 3.31Å; Y620-V624 PolarHBondContact O-N 3.06Å; Y620-V624 VanDerWaalsContact O-N 3.08Å; V624-G626 PolarHBondContact O-N 3.42Å; V624-G626 VanDerWaalsContact O-N 3.13Å; V624-S627 PolarHBondContact O-N 3.41Å; V624-S627 PolarHBondContact O-OG 3.29Å; V624-V717 HydrophobicContact CG2-CG1 4.17Å
625	P	71.3	Confident	79.1	Confident	113 Å²	113	42.1 Å²	42.1	73%	0.734	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-61.7	-22.3	-177.6	-24.7	35.4	0	0	0	114.9	L621 L623	L621-P625 WeakPolarHBondContact O-CD 3.25Å; L623-P625 VanDerWaalsContact C-CD 3.45Å
626	G	70.6	Confident	79.3	Confident	15 Å²	15	43.2 Å²	43.2	16%	0.155	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-132.3	18.4	-177.4	0	0	0	0	0	114.1	L623 V624 R628 N629 H632	L623-G626 CarbonylContact O-C 3.59Å; L623-G626 PolarHBondContact O-N 2.84Å; L623-G626 VanDerWaalsContact O-N 3.11Å; V624-G626 PolarHBondContact O-N 3.42Å; V624-G626 VanDerWaalsContact O-N 3.13Å; G626-R628 PolarHBondContact O-N 3.21Å; G626-R628 VanDerWaalsContact O-N 3.11Å; G626-N629 PolarHBondContact O-N 3.03Å; G626-H632 VanDerWaalsContact CA-CD2 3.47Å; G626-H632 WeakPolarHBondContact CA-CD2 3.37Å
627	S	72.5	Confident	79.9	Confident	27 Å²	27	41.7 Å²	41.7	19%	0.189	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.9	-175.1	59.3	0	0	0	0	114.2	V414 P416 L623 V624 N629	V414-S627 VanDerWaalsContact O-CB 3.27Å; V414-S627 WeakPolarHBondContact O-CB 3.29Å; P416-S627 WeakPolarHBondContact CA-O 3.16Å; P416-S627 WeakPolarHBondContact CG-O 3.32Å; L623-S627 WeakPolarHBondContact O-CA 3.47Å; L623-S627 PolarHBondContact O-N 3.12Å; V624-S627 PolarHBondContact O-N 3.41Å; V624-S627 PolarHBondContact O-OG 3.29Å; S627-N629 PolarHBondContact O-N 3.06Å
628	R	73.9	Confident	80.7	Confident	215 Å²	215	38.9 Å²	38.9	81%	0.811	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.2	177.8	-62.6	-175.3	-175.6	175.3	1.5	113.5	H353 G626	H353-R628 PolarHBondContact CD2-O 3.46Å; H353-R628 PolarHBondContact NE2-O 2.98Å; H353-R628 VanDerWaalsContact NE2-O 3.13Å; G626-R628 PolarHBondContact O-N 3.21Å; G626-R628 VanDerWaalsContact O-N 3.11Å
629	N	83.3	Confident	81.3	Confident	27 Å²	27	35.6 Å²	35.6	14%	0.144	18%	0.183	C	C	.	.			trans	-119.2	111.4	-175.5	-170.9	-34.5	0	0	0	111.2	I349 G626 S627 Y631 H632 I633	I349-N629 PolarHBondContact O-ND2 3.32Å; G626-N629 PolarHBondContact O-N 3.03Å; S627-N629 PolarHBondContact O-N 3.06Å; N629-Y631 PolarHBondContact O-N 3.08Å; N629-Y631 WeakPolarHBondContact OD1-CB 2.79Å; N629-Y631 PolarHBondContact OD1-N 3.08Å; N629-H632 HydrophobicContact CB-CB 4Å; N629-H632 WeakPolarHBondContact O-CB 3.41Å; N629-H632 PolarHBondContact O-N 3.06Å; N629-H632 PolarHBondContact OD1-N 2.59Å; N629-I633 PolarHBondContact O-N 2.77Å
630	V	86.4	Confident	81.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-54.6	-38.8	178.9	68.6	0	0	0	0	112.7	P354 P416 F419 L440 H632 I633 I634	P354-V630 HydrophobicContact CG-CG1 3.82Å; P416-V630 HydrophobicContact CG-CB 4.07Å; F419-V630 HydrophobicContact CD2-CG2 4.41Å; F419-V630 HydrophobicContact CE2-CB 4.49Å; F419-V630 HydrophobicContact CE2-CG2 3.59Å; F419-V630 HydrophobicContact CZ-CG2 4.36Å; L440-V630 HydrophobicContact CD1-CG2 4.27Å; V630-H632 VanDerWaalsContact C-N 3.34Å; V630-H632 PolarHBondContact O-N 3.34Å; V630-I633 PolarHBondContact O-N 3.45Å; V630-I634 HydrophobicContact CG2-CD1 3.77Å; V630-I634 HydrophobicContact CG2-CG1 4.3Å; V630-I634 VanDerWaalsContact O-CG1 3.28Å; V630-I634 WeakPolarHBondContact O-CG1 3.38Å; V630-I634 PolarHBondContact O-N 3.09Å
631	Y	86.9	Confident	82.5	Confident	9 Å²	9	35.3 Å²	35.3	4%	0.035	18%	0.183	C	C	.	.	H	α-helix	trans	-70.6	-30.9	-178.9	-56.1	-59.3	0	0	0	112.7	R351 S361 P363 I366 N629 I634 N635	R351-Y631 HydrophobicContact CB-CE2 4.29Å; S361-Y631 VanDerWaalsContact O-CE1 3.29Å; S361-Y631 WeakPolarHBondContact O-CE1 3.36Å; S361-Y631 PolarHBondContact O-OH 2.75Å; P363-Y631 HydrophobicContact CG-CD1 4.12Å; P363-Y631 HydrophobicContact CG-CE1 3.97Å; I366-Y631 HydrophobicContact CD1-CD1 3.78Å; I366-Y631 HydrophobicContact CD1-CG 4.32Å; N629-Y631 PolarHBondContact O-N 3.08Å; N629-Y631 WeakPolarHBondContact OD1-CB 2.79Å; N629-Y631 PolarHBondContact OD1-N 3.08Å; Y631-I634 HydrophobicContact CD1-CD1 4.36Å; Y631-N635 VanDerWaalsContact O-CB 3.22Å; Y631-N635 WeakPolarHBondContact O-CB 3.31Å; Y631-N635 PolarHBondContact O-N 3.35Å
632	H	84.4	Confident	83.3	Confident	46 Å²	46	34 Å²	34	21%	0.213	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-44.6	173	-179.9	82.1	0	0	0	110.8	I349 G626 N629 V630 N635 K636	I349-H632 HydrophobicContact CD1-CB 4.21Å; I349-H632 HydrophobicContact CG1-CB 4.35Å; I349-H632 HydrophobicContact CG2-CB 4.41Å; G626-H632 VanDerWaalsContact CA-CD2 3.47Å; G626-H632 WeakPolarHBondContact CA-CD2 3.37Å; N629-H632 HydrophobicContact CB-CB 4Å; N629-H632 WeakPolarHBondContact O-CB 3.41Å; N629-H632 PolarHBondContact O-N 3.06Å; N629-H632 PolarHBondContact OD1-N 2.59Å; V630-H632 VanDerWaalsContact C-N 3.34Å; V630-H632 PolarHBondContact O-N 3.34Å; H632-N635 PolarHBondContact O-N 3.4Å; H632-K636 WeakPolarHBondContact O-CB 3.33Å; H632-K636 PolarHBondContact O-N 3.14Å
633	I	87.1	Confident	83.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-50.5	177.8	-59.6	177.9	0	0	0	110.3	M415 P416 L440 L623 N629 V630 N635 K636 I637	M415-I633 HydrophobicContact CE-CD1 4.11Å; P416-I633 VanDerWaalsContact CD-CD1 3.42Å; P416-I633 HydrophobicContact CG-CD1 3.58Å; L440-I633 HydrophobicContact CD2-CG2 4.26Å; L623-I633 HydrophobicContact CD2-CB 4.43Å; L623-I633 HydrophobicContact CD2-CG1 4.23Å; L623-I633 HydrophobicContact CD2-CG2 4.21Å; N629-I633 PolarHBondContact O-N 2.77Å; V630-I633 PolarHBondContact O-N 3.45Å; I633-N635 VanDerWaalsContact C-N 3.29Å; I633-N635 PolarHBondContact O-N 3.32Å; I633-K636 PolarHBondContact O-N 3.01Å; I633-I637 HydrophobicContact CG2-CG2 4.19Å; I633-I637 WeakPolarHBondContact O-CG1 3.42Å; I633-I637 PolarHBondContact O-N 3.13Å
634	I	88.7	Confident	84.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-53.4	-47.9	177	-69.5	163.6	0	0	0	110.6	F362 I366 F367 F391 L440 V630 Y631 K636 I637 S638	F362-I634 HydrophobicContact CD1-CD1 4.2Å; F362-I634 HydrophobicContact CD1-CG2 4.29Å; F362-I634 HydrophobicContact CE1-CD1 3.66Å; F362-I634 HydrophobicContact CE1-CG1 4.29Å; F362-I634 HydrophobicContact CE1-CG2 4Å; F362-I634 HydrophobicContact CZ-CD1 4.5Å; I366-I634 HydrophobicContact CD1-CB 3.99Å; I366-I634 HydrophobicContact CD1-CG2 3.67Å; I366-I634 HydrophobicContact CG1-CG2 4.3Å; F367-I634 HydrophobicContact CE1-CG2 3.8Å; F367-I634 HydrophobicContact CZ-CG2 4.07Å; F391-I634 HydrophobicContact CE1-CG1 4.42Å; F391-I634 HydrophobicContact CE1-CG2 3.92Å; F391-I634 HydrophobicContact CZ-CG1 3.89Å; F391-I634 HydrophobicContact CZ-CG2 4.25Å; L440-I634 HydrophobicContact CD1-CG1 4.16Å; V630-I634 HydrophobicContact CG2-CD1 3.77Å; V630-I634 HydrophobicContact CG2-CG1 4.3Å; V630-I634 VanDerWaalsContact O-CG1 3.28Å; V630-I634 WeakPolarHBondContact O-CG1 3.38Å; V630-I634 PolarHBondContact O-N 3.09Å; Y631-I634 HydrophobicContact CD1-CD1 4.36Å; I634-K636 VanDerWaalsContact C-N 3.34Å; I634-K636 PolarHBondContact O-N 3.04Å; I634-I637 VanDerWaalsContact O-CG1 3.27Å; I634-I637 WeakPolarHBondContact O-CG1 3.44Å; I634-S638 VanDerWaalsContact O-CB 3.22Å; I634-S638 WeakPolarHBondContact O-CB 3.41Å; I634-S638 PolarHBondContact O-N 3.35Å; I634-S638 PolarHBondContact O-OG 3.16Å
635	N	86.4	Confident	84.7	Confident	29 Å²	29	37 Å²	37	16%	0.155	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-41.6	178	179.6	86	0	0	0	111.7	V345 W370 Y631 H632 I633 G639	V345-N635 HydrophobicContact CG1-CB 4.41Å; V345-N635 WeakPolarHBondContact CG1-OD1 3.47Å; V345-N635 VanDerWaalsContact CG2-OD1 3.23Å; V345-N635 WeakPolarHBondContact CG2-OD1 3.27Å; W370-N635 WeakPolarHBondContact CH2-O 3.29Å; W370-N635 VanDerWaalsContact CH2-OD1 3.28Å; W370-N635 WeakPolarHBondContact CH2-OD1 3.23Å; Y631-N635 VanDerWaalsContact O-CB 3.22Å; Y631-N635 WeakPolarHBondContact O-CB 3.31Å; Y631-N635 PolarHBondContact O-N 3.35Å; H632-N635 PolarHBondContact O-N 3.4Å; I633-N635 VanDerWaalsContact C-N 3.29Å; I633-N635 PolarHBondContact O-N 3.32Å; N635-G639 PolarHBondContact O-N 3.12Å
636	K	86.2	Confident	85.4	Confident	62 Å²	62	36.6 Å²	36.6	27%	0.27	18%	0.182	S	C	.	.	H	α-helix	trans	-66.8	-47.7	-179.8	-176.2	55	172.2	148.5	0	112	S622 L623 H632 I633 I634 G639 E640	S622-K636 VanDerWaalsContact OG-CE 3.3Å; S622-K636 WeakPolarHBondContact OG-CE 3.39Å; L623-K636 HydrophobicContact CD2-CB 3.84Å; L623-K636 HydrophobicContact CD2-CG 3.67Å; H632-K636 WeakPolarHBondContact O-CB 3.33Å; H632-K636 PolarHBondContact O-N 3.14Å; I633-K636 PolarHBondContact O-N 3.01Å; I634-K636 VanDerWaalsContact C-N 3.34Å; I634-K636 PolarHBondContact O-N 3.04Å; K636-G639 PolarHBondContact O-N 3.27Å; K636-E640 IonicContact NZ-OE1 2.65Å; K636-E640 PolarHBondContact NZ-OE1 3.37Å; K636-E640 PolarHBondContact O-N 2.91Å; K636-E640 VanDerWaalsContact O-N 3.16Å
637	I	89.7	Confident	86	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-39.2	179.4	67	-176.3	0	0	0	111.7	F391 Y438 I633 I634 G639 E640 L641	F391-I637 HydrophobicContact CB-CD1 4.45Å; F391-I637 HydrophobicContact CD1-CD1 4.26Å; F391-I637 HydrophobicContact CD2-CD1 3.46Å; F391-I637 VanDerWaalsContact CD2-CD1 3.46Å; F391-I637 HydrophobicContact CE1-CD1 4.44Å; F391-I637 HydrophobicContact CE2-CD1 3.66Å; F391-I637 HydrophobicContact CG-CD1 3.8Å; F391-I637 HydrophobicContact CG-CG1 4.46Å; F391-I637 HydrophobicContact CZ-CD1 4.17Å; Y438-I637 HydrophobicContact CD1-CB 3.94Å; Y438-I637 HydrophobicContact CD1-CG2 3.55Å; Y438-I637 HydrophobicContact CD2-CB 4.06Å; Y438-I637 HydrophobicContact CE1-CB 4.21Å; Y438-I637 HydrophobicContact CE1-CG2 3.75Å; Y438-I637 HydrophobicContact CE2-CB 4.31Å; Y438-I637 HydrophobicContact CG-CB 3.84Å; Y438-I637 HydrophobicContact CG-CG2 3.98Å; I633-I637 HydrophobicContact CG2-CG2 4.19Å; I633-I637 WeakPolarHBondContact O-CG1 3.42Å; I633-I637 PolarHBondContact O-N 3.13Å; I634-I637 VanDerWaalsContact O-CG1 3.27Å; I634-I637 WeakPolarHBondContact O-CG1 3.44Å; I637-G639 VanDerWaalsContact C-N 3.26Å; I637-G639 PolarHBondContact O-N 2.88Å; I637-E640 PolarHBondContact O-N 2.99Å; I637-L641 WeakPolarHBondContact O-CG 3.49Å; I637-L641 PolarHBondContact O-N 3.38Å
638	S	90.1	Very high	86.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-39.7	174.9	-57.3	0	0	0	0	111	F367 W370 I634 E640 L641 C642	F367-S638 VanDerWaalsContact CE1-OG 3.29Å; F367-S638 WeakPolarHBondContact CE1-OG 3.49Å; W370-S638 VanDerWaalsContact CZ3-CB 3.46Å; I634-S638 VanDerWaalsContact O-CB 3.22Å; I634-S638 WeakPolarHBondContact O-CB 3.41Å; I634-S638 PolarHBondContact O-N 3.35Å; I634-S638 PolarHBondContact O-OG 3.16Å; S638-E640 PolarHBondContact O-N 2.91Å; S638-L641 PolarHBondContact O-N 3.3Å; S638-C642 VanDerWaalsContact O-CB 3.29Å; S638-C642 WeakPolarHBondContact O-CB 3.34Å; S638-C642 PolarHBondContact O-N 3.48Å; S638-C642 PolarHBondContact O-SG 3.02Å
639	G	88.3	Confident	87	Confident	6 Å²	6	31 Å²	31	6%	0.062	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-41.1	175.7	0	0	0	0	0	114.1	W370 N635 K636 I637 Q643	W370-G639 VanDerWaalsContact CE2-CA 3.44Å; W370-G639 VanDerWaalsContact CZ2-N 3.34Å; N635-G639 PolarHBondContact O-N 3.12Å; K636-G639 PolarHBondContact O-N 3.27Å; I637-G639 VanDerWaalsContact C-N 3.26Å; I637-G639 PolarHBondContact O-N 2.88Å; G639-Q643 WeakPolarHBondContact O-CB 2.88Å; G639-Q643 VanDerWaalsContact O-CG 3.23Å; G639-Q643 WeakPolarHBondContact O-CG 3.35Å; G639-Q643 PolarHBondContact O-NE2 3.11Å
640	E	88.1	Confident	86.8	Confident	54 Å²	54	38.8 Å²	38.8	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-66.9	-47.7	176.2	-62.6	-67.8	144.2	0	0	110.7	Y438 K636 I637 S638 Q643	Y438-E640 HydrophobicContact CE2-CB 4.48Å; K636-E640 IonicContact NZ-OE1 2.65Å; K636-E640 PolarHBondContact NZ-OE1 3.37Å; K636-E640 PolarHBondContact O-N 2.91Å; K636-E640 VanDerWaalsContact O-N 3.16Å; I637-E640 PolarHBondContact O-N 2.99Å; S638-E640 PolarHBondContact O-N 2.91Å; E640-Q643 PolarHBondContact O-N 3.16Å
641	L	92.3	Very high	86.4	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-49.8	-179.7	-72.8	175.7	0	0	0	113.2	P375 F391 T393 C436 Y438 I637 S638 Q643 I644	P375-L641 HydrophobicContact CB-CD1 4.46Å; F391-L641 HydrophobicContact CB-CD1 3.58Å; F391-L641 WeakPolarHBondContact O-CD1 3.25Å; T393-L641 HydrophobicContact CG2-CB 4.14Å; C436-L641 WeakPolarHBondContact O-CD2 3.49Å; Y438-L641 HydrophobicContact CD2-CD1 3.87Å; Y438-L641 HydrophobicContact CD2-CD2 3.82Å; Y438-L641 HydrophobicContact CD2-CG 3.73Å; Y438-L641 HydrophobicContact CE2-CD1 4.49Å; Y438-L641 HydrophobicContact CE2-CD2 3.91Å; Y438-L641 HydrophobicContact CE2-CG 3.86Å; I637-L641 WeakPolarHBondContact O-CG 3.49Å; I637-L641 PolarHBondContact O-N 3.38Å; S638-L641 PolarHBondContact O-N 3.3Å; L641-Q643 PolarHBondContact O-N 3.28Å; L641-Q643 VanDerWaalsContact O-N 3.12Å; L641-I644 HydrophobicContact CD2-CD1 4.16Å; L641-I644 VanDerWaalsContact O-CD1 3.28Å; L641-I644 WeakPolarHBondContact O-CD1 3.08Å; L641-I644 WeakPolarHBondContact O-CG1 3.34Å; L641-I644 PolarHBondContact O-N 3.43Å
642	C	90.8	Very high	85.9	Confident	19 Å²	19	45.1 Å²	45.1	13%	0.128	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-5.3	-176.9	-66.5	0	0	0	0	113.6	W370 Q373 P375 S638	W370-C642 HydrophobicContact CB-CB 3.87Å; W370-C642 HydrophobicContact CD2-CB 4.28Å; W370-C642 HydrophobicContact CG-CB 3.52Å; Q373-C642 PolarHBondContact O-SG 3.12Å; P375-C642 WeakPolarHBondContact CD-SG 3.28Å; S638-C642 VanDerWaalsContact O-CB 3.29Å; S638-C642 WeakPolarHBondContact O-CB 3.34Å; S638-C642 PolarHBondContact O-N 3.48Å; S638-C642 PolarHBondContact O-SG 3.02Å
643	Q	87.8	Confident	85.3	Confident	95 Å²	95	50.4 Å²	50.4	44%	0.444	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-4.6	177.3	-76.9	176	69	0	0	113.5	G639 E640 L641 D645 T646 Y647	G639-Q643 WeakPolarHBondContact O-CB 2.88Å; G639-Q643 VanDerWaalsContact O-CG 3.23Å; G639-Q643 WeakPolarHBondContact O-CG 3.35Å; G639-Q643 PolarHBondContact O-NE2 3.11Å; E640-Q643 PolarHBondContact O-N 3.16Å; L641-Q643 PolarHBondContact O-N 3.28Å; L641-Q643 VanDerWaalsContact O-N 3.12Å; Q643-D645 VanDerWaalsContact C-N 3.32Å; Q643-D645 PolarHBondContact O-N 2.89Å; Q643-T646 VanDerWaalsContact O-CB 3.29Å; Q643-T646 WeakPolarHBondContact O-CB 3.49Å; Q643-T646 PolarHBondContact O-N 3.12Å; Q643-Y647 VanDerWaalsContact C-CE1 3.48Å; Q643-Y647 HydrophobicContact CB-CD1 4.45Å; Q643-Y647 HydrophobicContact CB-CE1 4.21Å; Q643-Y647 WeakPolarHBondContact O-CD1 3.47Å; Q643-Y647 VanDerWaalsContact O-CE1 3.26Å; Q643-Y647 WeakPolarHBondContact O-CE1 3.47Å
644	I	88.8	Confident	84.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-48.8	-52.6	-178.4	-65.4	164.8	0	0	0	111.4	I395 L399 V434 P435 L641 T646 Y647 L648	I395-I644 HydrophobicContact CG2-CG2 3.84Å; L399-I644 HydrophobicContact CD1-CG2 3.82Å; V434-I644 HydrophobicContact CG1-CG1 4.27Å; V434-I644 HydrophobicContact CG1-CG2 3.94Å; P435-I644 WeakPolarHBondContact O-CD1 3.24Å; L641-I644 HydrophobicContact CD2-CD1 4.16Å; L641-I644 VanDerWaalsContact O-CD1 3.28Å; L641-I644 WeakPolarHBondContact O-CD1 3.08Å; L641-I644 WeakPolarHBondContact O-CG1 3.34Å; L641-I644 PolarHBondContact O-N 3.43Å; I644-T646 PolarHBondContact O-N 2.6Å; I644-T646 VanDerWaalsContact O-N 3.11Å; I644-Y647 VanDerWaalsContact CA-CZ 3.5Å; I644-Y647 WeakPolarHBondContact CG1-OH 3.3Å; I644-Y647 PolarHBondContact O-N 2.9Å; I644-Y647 VanDerWaalsContact O-N 3.12Å; I644-L648 WeakPolarHBondContact O-CB 3.48Å; I644-L648 PolarHBondContact O-N 3.27Å
645	D	85.7	Confident	82.7	Confident	58 Å²	58	61.5 Å²	61.5	31%	0.31	30%	0.298	S	S	.	.	H	α-helix	trans	-56.4	-30.6	178.4	-81.8	-4.2	0	0	0	114.3	I395 Q643 Y647 P649	I395-D645 WeakPolarHBondContact CD1-OD1 3.33Å; I395-D645 WeakPolarHBondContact CD1-OD2 3.27Å; I395-D645 WeakPolarHBondContact CG1-OD1 3.41Å; I395-D645 WeakPolarHBondContact CG2-OD1 3.31Å; Q643-D645 VanDerWaalsContact C-N 3.32Å; Q643-D645 PolarHBondContact O-N 2.89Å; D645-Y647 VanDerWaalsContact C-N 3.3Å; D645-Y647 PolarHBondContact O-N 3.36Å; D645-P649 VanDerWaalsContact O-CD 3.27Å; D645-P649 WeakPolarHBondContact O-CD 3.45Å
646	T	85.5	Confident	81	Confident	104 Å²	104	71.6 Å²	71.6	64%	0.638	33%	0.334	S	S	*	.	H	α-helix	trans	-71.8	-29.4	-176.1	-54.8	0	0	0	0	111.6	Q643 I644	Q643-T646 VanDerWaalsContact O-CB 3.29Å; Q643-T646 WeakPolarHBondContact O-CB 3.49Å; Q643-T646 PolarHBondContact O-N 3.12Å; I644-T646 PolarHBondContact O-N 2.6Å; I644-T646 VanDerWaalsContact O-N 3.11Å
647	Y	82.7	Confident	79.2	Confident	56 Å²	56	70.4 Å²	70.4	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-111.1	-13.3	-178.8	60.7	-104.4	0	0	0	114.1	V434 Q643 I644 D645 R650 L651	V434-Y647 HydrophobicContact CG1-CE2 4.32Å; V434-Y647 HydrophobicContact CG2-CE2 4.45Å; Q643-Y647 VanDerWaalsContact C-CE1 3.48Å; Q643-Y647 HydrophobicContact CB-CD1 4.45Å; Q643-Y647 HydrophobicContact CB-CE1 4.21Å; Q643-Y647 WeakPolarHBondContact O-CD1 3.47Å; Q643-Y647 VanDerWaalsContact O-CE1 3.26Å; Q643-Y647 WeakPolarHBondContact O-CE1 3.47Å; I644-Y647 VanDerWaalsContact CA-CZ 3.5Å; I644-Y647 WeakPolarHBondContact CG1-OH 3.3Å; I644-Y647 PolarHBondContact O-N 2.9Å; I644-Y647 VanDerWaalsContact O-N 3.12Å; D645-Y647 VanDerWaalsContact C-N 3.3Å; D645-Y647 PolarHBondContact O-N 3.36Å; Y647-R650 WeakPolarHBondContact O-CB 3.18Å; Y647-R650 PolarHBondContact O-N 3.04Å; Y647-L651 HydrophobicContact CD2-CD1 3.66Å; Y647-L651 HydrophobicContact CD2-CG 4.14Å; Y647-L651 HydrophobicContact CE2-CD1 3.89Å; Y647-L651 PolarHBondContact O-N 3.02Å; Y647-L651 VanDerWaalsContact O-N 3.16Å
648	L	85.2	Confident	77.4	Confident	21 Å²	21	72.1 Å²	72.1	11%	0.11	35%	0.351	C	S	.	.	H	α-helix	trans	-53.8	-47.6	179.4	-173.9	65.7	0	0	0	113.5	I395 L399 I429 I644 R650 L651 E652	I395-L648 HydrophobicContact CG2-CD2 4.42Å; L399-L648 HydrophobicContact CD2-CD1 4.17Å; L399-L648 HydrophobicContact CD2-CD2 4.42Å; I429-L648 HydrophobicContact CD1-CD1 3.34Å; I644-L648 WeakPolarHBondContact O-CB 3.48Å; I644-L648 PolarHBondContact O-N 3.27Å; L648-R650 PolarHBondContact O-N 3.13Å; L648-R650 VanDerWaalsContact O-N 3.13Å; L648-L651 WeakPolarHBondContact O-CB 3.49Å; L648-L651 PolarHBondContact O-N 2.82Å; L648-E652 PolarHBondContact O-N 2.68Å; L648-E652 VanDerWaalsContact O-N 3.09Å
649	P	82.8	Confident	75.4	Confident	63 Å²	63	72.4 Å²	72.4	41%	0.409	35%	0.353	S	S	.	.	H	α-helix	trans	-61.1	-29.4	178.4	-23.7	34.2	0	0	0	113.4	D645 Q653	D645-P649 VanDerWaalsContact O-CD 3.27Å; D645-P649 WeakPolarHBondContact O-CD 3.45Å; P649-Q653 VanDerWaalsContact O-CG 3.23Å; P649-Q653 WeakPolarHBondContact O-CG 3.5Å; P649-Q653 PolarHBondContact O-N 3.45Å
650	R	78.2	Confident	73.3	Confident	190 Å²	190	80.2 Å²	80.2	72%	0.717	39%	0.392	S	S	*	.	H	α-helix	trans	-73.5	-34	176.2	-65.9	-179.1	176.3	177	-0.8	111.7	Y647 L648 L654	Y647-R650 WeakPolarHBondContact O-CB 3.18Å; Y647-R650 PolarHBondContact O-N 3.04Å; L648-R650 PolarHBondContact O-N 3.13Å; L648-R650 VanDerWaalsContact O-N 3.13Å; R650-L654 WeakPolarHBondContact O-CG 3.16Å; R650-L654 PolarHBondContact O-N 3.26Å
651	L	78.7	Confident	71.5	Confident	18 Å²	18	83.5 Å²	83.5	9%	0.094	40%	0.403	C	S	.	.	H	α-helix	trans	-69.5	-39.6	177.5	-64	-177.8	0	0	0	111.3	I429 N430 T432 V434 Y647 L648 Q653 L654	I429-L651 HydrophobicContact CB-CB 4.47Å; I429-L651 HydrophobicContact CG2-CB 4.06Å; N430-L651 PolarHBondContact ND2-O 3.39Å; T432-L651 HydrophobicContact CG2-CD1 4.44Å; T432-L651 HydrophobicContact CG2-CD2 3.63Å; V434-L651 HydrophobicContact CG2-CD1 3.51Å; Y647-L651 HydrophobicContact CD2-CD1 3.66Å; Y647-L651 HydrophobicContact CD2-CG 4.14Å; Y647-L651 HydrophobicContact CE2-CD1 3.89Å; Y647-L651 PolarHBondContact O-N 3.02Å; Y647-L651 VanDerWaalsContact O-N 3.16Å; L648-L651 WeakPolarHBondContact O-CB 3.49Å; L648-L651 PolarHBondContact O-N 2.82Å; L651-Q653 VanDerWaalsContact C-N 3.32Å; L651-Q653 PolarHBondContact O-N 3.11Å; L651-L654 HydrophobicContact CD2-CD1 4.07Å; L651-L654 WeakPolarHBondContact O-CB 2.93Å; L651-L654 PolarHBondContact O-N 2.83Å
652	E	76.5	Confident	69.2	Low	124 Å²	124	84.7 Å²	84.7	58%	0.579	41%	0.407	S	S	*	.	H	α-helix	trans	-65.6	-34.1	176.6	-68.1	171.2	174.6	0	0	112.4	L648 L654	L648-E652 PolarHBondContact O-N 2.68Å; L648-E652 VanDerWaalsContact O-N 3.09Å; E652-L654 VanDerWaalsContact C-N 3.33Å
653	Q	72	Confident	67.2	Low	158 Å²	158	85.7 Å²	85.7	74%	0.738	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.3	177.4	-73.6	174.9	9.1	0	0	114.6	P649 L651 E655	P649-Q653 VanDerWaalsContact O-CG 3.23Å; P649-Q653 WeakPolarHBondContact O-CG 3.5Å; P649-Q653 PolarHBondContact O-N 3.45Å; L651-Q653 VanDerWaalsContact C-N 3.32Å; L651-Q653 PolarHBondContact O-N 3.11Å; Q653-E655 PolarHBondContact O-N 3.47Å
654	L	65	Low	65.6	Low	57 Å²	57	85.5 Å²	85.5	30%	0.298	42%	0.418	S	S	.	.	S	Bend	trans	-63.9	114.4	171.7	-68.3	169.9	0	0	0	107.3	N430 R650 L651 E652	N430-L654 HydrophobicContact CB-CB 4.33Å; N430-L654 PolarHBondContact ND2-O 3.4Å; N430-L654 VanDerWaalsContact ND2-O 3.11Å; R650-L654 WeakPolarHBondContact O-CG 3.16Å; R650-L654 PolarHBondContact O-N 3.26Å; L651-L654 HydrophobicContact CD2-CD1 4.07Å; L651-L654 WeakPolarHBondContact O-CB 2.93Å; L651-L654 PolarHBondContact O-N 2.83Å; E652-L654 VanDerWaalsContact C-N 3.33Å
655	E	56.3	Low	64	Low	176 Å²	176	89.2 Å²	89.2	82%	0.822	44%	0.441	S	S	*	.			trans	-47.8	146.1	160.6	-70.7	-177.8	170.3	0	0	108	Q653 G657	Q653-E655 PolarHBondContact O-N 3.47Å; E655-G657 WeakPolarHBondContact O-CA 3.48Å; E655-G657 PolarHBondContact O-N 2.7Å
656	R	50.7	Low	62.6	Low	241 Å²	241	88 Å²	88	91%	0.909	44%	0.435	S	S	*	.	S	Bend	trans	-55.4	89	173.2	-75.5	-175.1	-174.8	-175.4	2	108.9
657	G	48.5	Very low	61.5	Low	36 Å²	36	85.3 Å²	85.3	37%	0.371	42%	0.417	S	S	.	.			trans	-161.4	130.7	-165.1	0	0	0	0	0	107.3	E655	E655-G657 WeakPolarHBondContact O-CA 3.48Å; E655-G657 PolarHBondContact O-N 2.7Å
658	S	51.5	Low	60.5	Low	37 Å²	37	90.4 Å²	90.4	26%	0.259	44%	0.435	S	S	.	.			trans	-45.5	138.1	-169.4	-51.5	0	0	0	0	112.2	L660	S658-L660 PolarHBondContact O-N 3.27Å
659	P	47.8	Very low	59.4	Low	6 Å²	6	89.7 Å²	89.7	4%	0.039	43%	0.432	C	S	.	.			trans	-52	141.1	-179.7	-23.4	30.2	0	0	0	111.5	Q431 W661 W662	Q431-P659 HydrophobicContact CB-CG 4.13Å; P659-W661 HydrophobicContact CB-CD2 4.28Å; P659-W661 HydrophobicContact CB-CZ2 3.98Å; P659-W661 HydrophobicContact CG-CZ2 4.36Å; P659-W661 PolarHBondContact O-N 2.86Å; P659-W662 HydrophobicContact CG-CG 4.49Å; P659-W662 PolarHBondContact O-N 3.06Å
660	L	45	Very low	58.5	Low	170 Å²	170	87 Å²	87	89%	0.89	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-15.3	-174.1	-71.5	168.6	0	0	0	115.5	S658	S658-L660 PolarHBondContact O-N 3.27Å
661	W	50.5	Low	58.1	Low	123 Å²	123	81.2 Å²	81.2	47%	0.466	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	3	-177.8	49.6	-95.7	0	0	0	114.1	P659 T663	P659-W661 HydrophobicContact CB-CD2 4.28Å; P659-W661 HydrophobicContact CB-CZ2 3.98Å; P659-W661 HydrophobicContact CG-CZ2 4.36Å; P659-W661 PolarHBondContact O-N 2.86Å; W661-T663 PolarHBondContact O-N 3.49Å
662	W	42.5	Very low	57.6	Low	25 Å²	25	83.8 Å²	83.8	10%	0.095	41%	0.408	C	S	.	.			trans	-67.4	133.1	172.1	-84.6	43.9	0	0	0	110.9	R607 N610 S611 P659 V666 I667 D670	R607-W662 HydrophobicContact CB-CH2 3.51Å; R607-W662 HydrophobicContact CB-CZ2 3.82Å; R607-W662 HydrophobicContact CG-CH2 3.55Å; R607-W662 HydrophobicContact CG-CZ2 4.33Å; R607-W662 HydrophobicContact CG-CZ3 4.16Å; R607-W662 WeakPolarHBondContact O-CZ2 3.29Å; N610-W662 HydrophobicContact CB-CH2 4.47Å; N610-W662 HydrophobicContact CB-CZ2 4.33Å; S611-W662 PolarHBondContact OG-NE1 3.45Å; P659-W662 HydrophobicContact CG-CG 4.49Å; P659-W662 PolarHBondContact O-N 3.06Å; W662-V666 HydrophobicContact CD2-CB 4.14Å; W662-V666 HydrophobicContact CD2-CG1 3.98Å; W662-V666 HydrophobicContact CE3-CB 3.57Å; W662-V666 HydrophobicContact CE3-CG1 3.43Å; W662-V666 VanDerWaalsContact CE3-CG1 3.43Å; W662-V666 HydrophobicContact CH2-CG1 3.52Å; W662-V666 HydrophobicContact CZ2-CG1 4.08Å; W662-V666 HydrophobicContact CZ3-CB 3.84Å; W662-V666 HydrophobicContact CZ3-CG1 3.21Å; W662-I667 HydrophobicContact CB-CD1 4.33Å; W662-I667 HydrophobicContact CB-CG1 4.13Å; W662-I667 HydrophobicContact CD2-CG1 4.48Å; W662-I667 HydrophobicContact CE3-CB 4.49Å; W662-I667 HydrophobicContact CE3-CG1 3.65Å; W662-I667 HydrophobicContact CZ3-CG1 4.48Å; W662-D670 HydrophobicContact CZ3-CB 4.5Å
663	T	50.1	Low	57.2	Low	40 Å²	40	77.9 Å²	77.9	25%	0.245	38%	0.381	C	S	.	.			trans	-69.5	152.8	165.8	64.3	0	0	0	0	110.2	W661 T665 V666 I667 R729	W661-T663 PolarHBondContact O-N 3.49Å; T663-T665 PolarHBondContact O-N 3.5Å; T663-T665 WeakPolarHBondContact OG1-CB 3.18Å; T663-T665 PolarHBondContact OG1-N 3.12Å; T663-V666 PolarHBondContact O-N 3.33Å; T663-V666 PolarHBondContact OG1-N 3.44Å; T663-I667 PolarHBondContact O-N 3.28Å; T663-R729 WeakPolarHBondContact CG2-O 3.28Å
664	T	54	Low	56.9	Low	91 Å²	91	73.6 Å²	73.6	56%	0.558	36%	0.363	S	S	*	.	H	α-helix	trans	-50.7	-28.2	166.8	-44.7	0	0	0	0	111.7	R668	T664-R668 HydrophobicContact CG2-CG 4.39Å; T664-R668 VanDerWaalsContact O-CB 3.26Å; T664-R668 WeakPolarHBondContact O-CB 3.49Å; T664-R668 WeakPolarHBondContact O-CD 3.01Å; T664-R668 WeakPolarHBondContact O-CG 3.42Å; T664-R668 PolarHBondContact O-N 3.28Å
665	T	54.5	Low	57.2	Low	79 Å²	79	76.7 Å²	76.7	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-69	-42.2	177.7	-49.1	0	0	0	0	113.2	T663 F669	T663-T665 PolarHBondContact O-N 3.5Å; T663-T665 WeakPolarHBondContact OG1-CB 3.18Å; T663-T665 PolarHBondContact OG1-N 3.12Å; T665-F669 VanDerWaalsContact O-CB 3.29Å; T665-F669 WeakPolarHBondContact O-CB 3.12Å; T665-F669 PolarHBondContact O-N 3.33Å
666	V	56.5	Low	57.7	Low	32 Å²	32	69.2 Å²	69.2	19%	0.194	35%	0.346	C	S	.	.	H	α-helix	trans	-70.5	-39.3	179.5	-168	0	0	0	0	110.8	N610 W662 T663 F669 D670	N610-V666 HydrophobicContact CB-CG1 4.47Å; W662-V666 HydrophobicContact CD2-CB 4.14Å; W662-V666 HydrophobicContact CD2-CG1 3.98Å; W662-V666 HydrophobicContact CE3-CB 3.57Å; W662-V666 HydrophobicContact CE3-CG1 3.43Å; W662-V666 VanDerWaalsContact CE3-CG1 3.43Å; W662-V666 HydrophobicContact CH2-CG1 3.52Å; W662-V666 HydrophobicContact CZ2-CG1 4.08Å; W662-V666 HydrophobicContact CZ3-CB 3.84Å; W662-V666 HydrophobicContact CZ3-CG1 3.21Å; T663-V666 PolarHBondContact O-N 3.33Å; T663-V666 PolarHBondContact OG1-N 3.44Å; V666-F669 PolarHBondContact O-N 3.15Å; V666-D670 PolarHBondContact O-N 2.86Å
667	I	61.7	Low	58.5	Low	49 Å²	49	58.1 Å²	58.1	25%	0.251	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-50.9	174.5	-58.8	176	0	0	0	109.9	W662 T663 F669 D670 D671	W662-I667 HydrophobicContact CB-CD1 4.33Å; W662-I667 HydrophobicContact CB-CG1 4.13Å; W662-I667 HydrophobicContact CD2-CG1 4.48Å; W662-I667 HydrophobicContact CE3-CB 4.49Å; W662-I667 HydrophobicContact CE3-CG1 3.65Å; W662-I667 HydrophobicContact CZ3-CG1 4.48Å; T663-I667 PolarHBondContact O-N 3.28Å; I667-F669 VanDerWaalsContact C-N 3.27Å; I667-F669 PolarHBondContact O-N 2.89Å; I667-D670 PolarHBondContact O-N 3Å; I667-D670 VanDerWaalsContact O-N 3.17Å; I667-D671 PolarHBondContact O-N 3.44Å
668	R	62.9	Low	59.4	Low	162 Å²	162	60.1 Å²	60.1	61%	0.611	31%	0.312	S	S	*	.	H	α-helix	trans	-57.3	-40.7	177.1	-77.9	174.1	-179.1	-176.5	1.8	112.5	T664 D671 Q672	T664-R668 HydrophobicContact CG2-CG 4.39Å; T664-R668 VanDerWaalsContact O-CB 3.26Å; T664-R668 WeakPolarHBondContact O-CB 3.49Å; T664-R668 WeakPolarHBondContact O-CD 3.01Å; T664-R668 WeakPolarHBondContact O-CG 3.42Å; T664-R668 PolarHBondContact O-N 3.28Å; R668-D671 PolarHBondContact O-N 3.02Å; R668-Q672 VanDerWaalsContact O-CB 3.29Å; R668-Q672 WeakPolarHBondContact O-CB 3.11Å; R668-Q672 WeakPolarHBondContact O-CG 3.48Å; R668-Q672 PolarHBondContact O-N 3.47Å
669	F	62.4	Low	60.1	Low	7 Å²	7	60.7 Å²	60.7	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-45.4	177.9	171	-104.2	0	0	0	111.9	L606 T665 V666 I667 Q672 L673 V701 C704 I705	L606-F669 HydrophobicContact CD1-CE1 4.33Å; L606-F669 HydrophobicContact CD2-CD1 3.98Å; L606-F669 HydrophobicContact CD2-CE1 3.6Å; L606-F669 HydrophobicContact CG-CE1 4.42Å; T665-F669 VanDerWaalsContact O-CB 3.29Å; T665-F669 WeakPolarHBondContact O-CB 3.12Å; T665-F669 PolarHBondContact O-N 3.33Å; V666-F669 PolarHBondContact O-N 3.15Å; I667-F669 VanDerWaalsContact C-N 3.27Å; I667-F669 PolarHBondContact O-N 2.89Å; F669-Q672 PolarHBondContact O-N 3.44Å; F669-L673 WeakPolarHBondContact O-CB 3.41Å; F669-L673 PolarHBondContact O-N 2.64Å; F669-V701 HydrophobicContact CD2-CG1 3.74Å; F669-V701 WeakPolarHBondContact CD2-O 3.47Å; F669-V701 HydrophobicContact CE2-CB 4.34Å; F669-V701 HydrophobicContact CE2-CG1 3.21Å; F669-V701 VanDerWaalsContact CE2-O 3.22Å; F669-V701 WeakPolarHBondContact CE2-O 3.32Å; F669-V701 HydrophobicContact CZ-CG1 3.93Å; F669-C704 HydrophobicContact CB-CB 4.04Å; F669-C704 HydrophobicContact CD2-CB 3.44Å; F669-C704 VanDerWaalsContact CD2-CB 3.44Å; F669-C704 HydrophobicContact CE2-CB 4.14Å; F669-C704 HydrophobicContact CG-CB 4Å; F669-I705 HydrophobicContact CE2-CD1 4.17Å; F669-I705 HydrophobicContact CE2-CG1 3.53Å; F669-I705 HydrophobicContact CZ-CD1 4.16Å; F669-I705 HydrophobicContact CZ-CG1 3.65Å
670	D	64.4	Low	60.9	Low	6 Å²	6	60.8 Å²	60.8	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-44	177.7	-173.5	89.3	0	0	0	111.9	L606 R607 W662 V666 I667 Q672 L673 N674	L606-D670 HydrophobicContact CD2-CB 4.28Å; L606-D670 VanDerWaalsContact CD2-OD1 3.27Å; L606-D670 WeakPolarHBondContact CD2-OD1 3.4Å; R607-D670 HydrophobicContact CG-CB 4.27Å; R607-D670 VanDerWaalsContact CG-CG 3.47Å; R607-D670 WeakPolarHBondContact CG-OD1 3.15Å; R607-D670 IonicContact CZ-OD2 2.79Å; R607-D670 IonicContact NE-OD1 2.67Å; R607-D670 IonicContact NE-OD2 3.61Å; R607-D670 PolarHBondContact NE-OD2 3.09Å; R607-D670 IonicContact NH2-OD2 3.44Å; R607-D670 PolarHBondContact NH2-OD2 3.33Å; W662-D670 HydrophobicContact CZ3-CB 4.5Å; V666-D670 PolarHBondContact O-N 2.86Å; I667-D670 PolarHBondContact O-N 3Å; I667-D670 VanDerWaalsContact O-N 3.17Å; D670-Q672 VanDerWaalsContact C-N 3.34Å; D670-Q672 PolarHBondContact O-N 2.89Å; D670-L673 PolarHBondContact O-N 3.45Å; D670-L673 VanDerWaalsContact O-N 3.15Å; D670-N674 PolarHBondContact O-N 2.97Å; D670-N674 PolarHBondContact O-ND2 2.87Å; D670-N674 PolarHBondContact OD2-ND2 3.11Å
671	D	68.4	Low	61.7	Low	69 Å²	69	59.6 Å²	59.6	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-61.3	-43.2	175.4	-65.6	-18.5	0	0	0	111.2	R607 I667 R668 L673 N674 N675	R607-D671 IonicContact NH2-OD1 3.6Å; R607-D671 PolarHBondContact NH2-OD1 3.33Å; I667-D671 PolarHBondContact O-N 3.44Å; R668-D671 PolarHBondContact O-N 3.02Å; D671-L673 VanDerWaalsContact C-N 3.33Å; D671-L673 PolarHBondContact O-N 2.77Å; D671-N674 PolarHBondContact O-N 3.18Å; D671-N675 WeakPolarHBondContact O-CB 3.41Å; D671-N675 PolarHBondContact O-N 3.39Å; D671-N675 PolarHBondContact O-ND2 2.9Å; D671-N675 VanDerWaalsContact O-ND2 3.11Å
672	Q	69.4	Low	62	Low	71 Å²	71	59 Å²	59	33%	0.332	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-41	174.2	-76.8	172.9	-25.8	0	0	111.8	R668 F669 D670 N675 V676 N700 V701	R668-Q672 VanDerWaalsContact O-CB 3.29Å; R668-Q672 WeakPolarHBondContact O-CB 3.11Å; R668-Q672 WeakPolarHBondContact O-CG 3.48Å; R668-Q672 PolarHBondContact O-N 3.47Å; F669-Q672 PolarHBondContact O-N 3.44Å; D670-Q672 VanDerWaalsContact C-N 3.34Å; D670-Q672 PolarHBondContact O-N 2.89Å; Q672-N675 PolarHBondContact O-N 2.88Å; Q672-V676 VanDerWaalsContact O-CG2 3.28Å; Q672-V676 WeakPolarHBondContact O-CG2 3.44Å; Q672-V676 PolarHBondContact O-N 2.91Å; Q672-N700 PolarHBondContact OE1-O 3.22Å; Q672-V701 HydrophobicContact CB-CG2 4.22Å
673	L	66.2	Low	62.6	Low	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-45.4	178.9	-176	59.8	0	0	0	111.3	F531 V601 L606 F669 D670 D671 N675 V676 L677 F697 V701	F531-L673 HydrophobicContact CD1-CD1 4.06Å; F531-L673 HydrophobicContact CD1-CD2 4.18Å; F531-L673 HydrophobicContact CE1-CD1 4.43Å; F531-L673 HydrophobicContact CE1-CD2 3.9Å; V601-L673 HydrophobicContact CB-CD2 4.35Å; V601-L673 HydrophobicContact CG1-CD2 3.29Å; V601-L673 HydrophobicContact CG1-CG 3.72Å; V601-L673 HydrophobicContact CG2-CD2 4.11Å; L606-L673 HydrophobicContact CD1-CD2 3.91Å; L606-L673 HydrophobicContact CD2-CB 4.43Å; L606-L673 HydrophobicContact CD2-CD2 3.29Å; L606-L673 HydrophobicContact CD2-CG 4.41Å; L606-L673 HydrophobicContact CG-CD2 4.05Å; F669-L673 WeakPolarHBondContact O-CB 3.41Å; F669-L673 PolarHBondContact O-N 2.64Å; D670-L673 PolarHBondContact O-N 3.45Å; D670-L673 VanDerWaalsContact O-N 3.15Å; D671-L673 VanDerWaalsContact C-N 3.33Å; D671-L673 PolarHBondContact O-N 2.77Å; L673-N675 PolarHBondContact O-N 2.88Å; L673-V676 PolarHBondContact O-N 2.89Å; L673-V676 VanDerWaalsContact O-N 3.09Å; L673-L677 HydrophobicContact CD1-CD2 4.36Å; L673-L677 HydrophobicContact CD1-CG 4.15Å; L673-L677 HydrophobicContact CG-CG 4.26Å; L673-L677 WeakPolarHBondContact O-CB 3.49Å; L673-L677 WeakPolarHBondContact O-CG 3.36Å; L673-L677 PolarHBondContact O-N 3.33Å; L673-F697 HydrophobicContact CD1-CD2 4.35Å; L673-F697 HydrophobicContact CD1-CE2 3.2Å; L673-F697 HydrophobicContact CD1-CZ 3.58Å; L673-V701 HydrophobicContact CB-CG1 4.31Å; L673-V701 HydrophobicContact CD1-CG1 4.1Å
674	N	67.1	Low	62.7	Low	68 Å²	68	68.9 Å²	68.9	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-29.6	175	-72.5	-37.2	0	0	0	112.7	D670 D671 P678	D670-N674 PolarHBondContact O-N 2.97Å; D670-N674 PolarHBondContact O-ND2 2.87Å; D670-N674 PolarHBondContact OD2-ND2 3.11Å; D671-N674 PolarHBondContact O-N 3.18Å; N674-P678 WeakPolarHBondContact O-CD 3.25Å; N674-P678 WeakPolarHBondContact O-CG 3.41Å
675	N	70.2	Confident	63.3	Low	122 Å²	122	66.3 Å²	66.3	65%	0.652	34%	0.342	S	S	*	.	H	α-helix	trans	-75.1	-32.3	173.7	-71.4	-28.1	0	0	0	112.9	D671 Q672 L673	D671-N675 WeakPolarHBondContact O-CB 3.41Å; D671-N675 PolarHBondContact O-N 3.39Å; D671-N675 PolarHBondContact O-ND2 2.9Å; D671-N675 VanDerWaalsContact O-ND2 3.11Å; Q672-N675 PolarHBondContact O-N 2.88Å; L673-N675 PolarHBondContact O-N 2.88Å
676	V	67.4	Low	64.3	Low	19 Å²	19	65.5 Å²	65.5	12%	0.115	34%	0.337	C	S	.	.	H	α-helix	trans	-86.9	-33.3	-178.3	-179	0	0	0	0	111.8	Q672 L673 T679 F680 F697 V701	Q672-V676 VanDerWaalsContact O-CG2 3.28Å; Q672-V676 WeakPolarHBondContact O-CG2 3.44Å; Q672-V676 PolarHBondContact O-N 2.91Å; L673-V676 PolarHBondContact O-N 2.89Å; L673-V676 VanDerWaalsContact O-N 3.09Å; V676-T679 VanDerWaalsContact O-CB 3.29Å; V676-T679 WeakPolarHBondContact O-CB 3.35Å; V676-T679 PolarHBondContact O-N 3.38Å; V676-T679 PolarHBondContact O-OG1 3.46Å; V676-F680 HydrophobicContact CG1-CE2 3.93Å; V676-F697 HydrophobicContact CB-CD2 4.32Å; V676-F697 HydrophobicContact CG1-CB 4.32Å; V676-F697 HydrophobicContact CG1-CD2 3.71Å; V676-V701 HydrophobicContact CG2-CG2 4.11Å
677	L	66.8	Low	65	Low	8 Å²	8	66.8 Å²	66.8	4%	0.042	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-55.2	-46.9	-177.4	-85	-171.3	0	0	0	115.3	V601 L673 T679 F680	V601-L677 HydrophobicContact CB-CD1 3.71Å; V601-L677 HydrophobicContact CG1-CD1 3.17Å; V601-L677 HydrophobicContact CG1-CG 4.15Å; L673-L677 HydrophobicContact CD1-CD2 4.36Å; L673-L677 HydrophobicContact CD1-CG 4.15Å; L673-L677 HydrophobicContact CG-CG 4.26Å; L673-L677 WeakPolarHBondContact O-CB 3.49Å; L673-L677 WeakPolarHBondContact O-CG 3.36Å; L673-L677 PolarHBondContact O-N 3.33Å; L677-T679 PolarHBondContact O-N 2.89Å; L677-T679 VanDerWaalsContact O-N 3.11Å; L677-F680 HydrophobicContact CD2-CD2 4.21Å; L677-F680 HydrophobicContact CD2-CE2 4.46Å; L677-F680 WeakPolarHBondContact O-CB 3.37Å; L677-F680 PolarHBondContact O-N 3.18Å
678	P	68.4	Low	65.4	Low	79 Å²	79	70.8 Å²	70.8	51%	0.513	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-58.1	-26.7	176.5	-25.9	34.9	0	0	0	112.8	N674 F680 K681	N674-P678 WeakPolarHBondContact O-CD 3.25Å; N674-P678 WeakPolarHBondContact O-CG 3.41Å; P678-F680 PolarHBondContact O-N 2.89Å; P678-K681 PolarHBondContact O-N 2.98Å
679	T	67	Low	65.8	Low	49 Å²	49	67.6 Å²	67.6	30%	0.301	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-67.5	-21.2	177.6	77.4	0	0	0	0	112.4	V676 L677 K685 M693	V676-T679 VanDerWaalsContact O-CB 3.29Å; V676-T679 WeakPolarHBondContact O-CB 3.35Å; V676-T679 PolarHBondContact O-N 3.38Å; V676-T679 PolarHBondContact O-OG1 3.46Å; L677-T679 PolarHBondContact O-N 2.89Å; L677-T679 VanDerWaalsContact O-N 3.11Å; T679-K685 PolarHBondContact O-NZ 3.33Å; T679-M693 VanDerWaalsContact O-CE 3.26Å; T679-M693 WeakPolarHBondContact O-CE 3.43Å; T679-M693 PolarHBondContact OG1-SD 3.37Å; T679-M693 VanDerWaalsContact OG1-SD 3.36Å
680	F	63.7	Low	66.2	Low	7 Å²	7	69.8 Å²	69.8	3%	0.031	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-78.4	-19.7	174.9	-71.6	-80.5	0	0	0	114	V532 P533 V676 L677 P678 Q682 M693 V694 F697	V532-F680 HydrophobicContact CB-CE1 4.4Å; V532-F680 HydrophobicContact CG2-CE1 3.93Å; V532-F680 HydrophobicContact CG2-CZ 4.47Å; P533-F680 VanDerWaalsContact CD-CD1 3.42Å; P533-F680 HydrophobicContact CG-CB 3.64Å; P533-F680 HydrophobicContact CG-CD1 4.29Å; P533-F680 HydrophobicContact CG-CG 4.3Å; V676-F680 HydrophobicContact CG1-CE2 3.93Å; L677-F680 HydrophobicContact CD2-CD2 4.21Å; L677-F680 HydrophobicContact CD2-CE2 4.46Å; L677-F680 WeakPolarHBondContact O-CB 3.37Å; L677-F680 PolarHBondContact O-N 3.18Å; P678-F680 PolarHBondContact O-N 2.89Å; F680-Q682 PolarHBondContact O-N 3.47Å; F680-M693 HydrophobicContact CB-SD 4.24Å; F680-M693 HydrophobicContact CD1-CE 4.4Å; F680-M693 HydrophobicContact CD1-SD 3.26Å; F680-M693 WeakPolarHBondContact CD1-SD 3.32Å; F680-M693 HydrophobicContact CD2-SD 3.98Å; F680-M693 HydrophobicContact CE1-CG 4.21Å; F680-M693 HydrophobicContact CE1-SD 3.47Å; F680-M693 WeakPolarHBondContact CE1-SD 3.41Å; F680-M693 HydrophobicContact CE2-SD 4.19Å; F680-M693 HydrophobicContact CG-SD 3.55Å; F680-M693 VanDerWaalsContact CG-SD 3.55Å; F680-M693 HydrophobicContact CZ-CG 4.35Å; F680-M693 HydrophobicContact CZ-SD 3.95Å; F680-V694 HydrophobicContact CE1-CG2 4.38Å; F680-F697 AromaticContact CE2-CD2 3.99Å; F680-F697 HydrophobicContact CE2-CD2 3.99Å; F680-F697 HydrophobicContact CE2-CE2 4.41Å; F680-F697 HydrophobicContact CZ-CD2 4.12Å
681	K	61.2	Low	66.5	Low	146 Å²	146	73.7 Å²	73.7	64%	0.635	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-77.9	-0.7	-175.8	-68.8	-171.9	175.4	-177.1	0	114.6	P678 D683	P678-K681 PolarHBondContact O-N 2.98Å; K681-D683 PolarHBondContact O-N 2.91Å
682	Q	57.2	Low	66.7	Low	109 Å²	109	71.9 Å²	71.9	51%	0.509	37%	0.373	S	S	.	.			trans	-87.5	103.1	-179.5	-73.6	177.4	-21.8	0	0	110.3	F680 T684 K685	F680-Q682 PolarHBondContact O-N 3.47Å; Q682-T684 PolarHBondContact O-N 3.19Å; Q682-K685 HydrophobicContact CB-CD 4.46Å
683	D	54.9	Low	66.7	Low	147 Å²	147	69 Å²	69	79%	0.786	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-11.5	177.8	-81.8	-29.3	0	0	0	114.3	K681	K681-D683 PolarHBondContact O-N 2.91Å
684	T	53.5	Low	66.9	Low	126 Å²	126	69.1 Å²	69.1	77%	0.773	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	14.4	-170.9	52.3	0	0	0	0	115.4	Q682	Q682-T684 PolarHBondContact O-N 3.19Å
685	K	65.9	Low	67.1	Low	38 Å²	38	68.7 Å²	68.7	17%	0.165	36%	0.356	C	S	.	.			trans	-89	133.1	-175.5	-70.1	-179.8	177.5	176.2	0	113.5	T679 Q682 E689 R690 M693	T679-K685 PolarHBondContact O-NZ 3.33Å; Q682-K685 HydrophobicContact CB-CD 4.46Å; K685-E689 WeakPolarHBondContact CA-OE2 3.45Å; K685-E689 HydrophobicContact CB-CB 4.1Å; K685-E689 HydrophobicContact CG-CB 4.39Å; K685-R690 HydrophobicContact CB-CG 3.97Å; K685-R690 PolarHBondContact O-NH2 3.36Å; K685-M693 HydrophobicContact CD-CE 3.24Å
686	T	75.9	Confident	67.1	Low	62 Å²	62	70.9 Å²	70.9	38%	0.38	36%	0.355	S	S	.	.			trans	-61.7	155.1	169.5	57.1	0	0	0	0	111.2	E688 E689 R690	T686-E688 PolarHBondContact O-N 2.94Å; T686-E689 PolarHBondContact N-OE2 2.75Å; T686-E689 PolarHBondContact O-N 3.42Å; T686-E689 VanDerWaalsContact O-N 3.12Å; T686-E689 WeakPolarHBondContact OG1-CB 3.48Å; T686-E689 WeakPolarHBondContact OG1-CG 3.48Å; T686-E689 PolarHBondContact OG1-N 2.99Å; T686-E689 PolarHBondContact OG1-OE2 3.34Å; T686-R690 PolarHBondContact O-N 2.82Å
687	P	69.7	Low	67.2	Low	58 Å²	58	70 Å²	70	38%	0.377	35%	0.35	S	S	.	.	H	α-helix	trans	-43.5	-45.4	170.7	-34.2	40.5	0	0	0	113.9	Q543 R690 R691	Q543-P687 VanDerWaalsContact NE2-CA 3.34Å; Q543-P687 PolarHBondContact NE2-O 2.81Å; Q543-P687 PolarHBondContact OE1-O 3.12Å; P687-R690 PolarHBondContact O-N 2.97Å; P687-R691 PolarHBondContact O-N 3.14Å; P687-R691 VanDerWaalsContact O-N 3.1Å
688	E	71.8	Confident	67.1	Low	133 Å²	133	69.7 Å²	69.7	62%	0.621	35%	0.348	S	S	*	.	H	α-helix	trans	-68.2	-40.3	-177.9	-65.2	67.6	-148	0	0	112.1	T686 R691 A692	T686-E688 PolarHBondContact O-N 2.94Å; E688-R691 PolarHBondContact O-N 3.5Å; E688-A692 WeakPolarHBondContact O-CB 3.49Å; E688-A692 PolarHBondContact O-N 3.45Å
689	E	71.5	Confident	67	Low	95 Å²	95	72.5 Å²	72.5	44%	0.444	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-38.8	175.8	-74.6	167.9	148	0	0	112.1	K685 T686 A692 M693	K685-E689 WeakPolarHBondContact CA-OE2 3.45Å; K685-E689 HydrophobicContact CB-CB 4.1Å; K685-E689 HydrophobicContact CG-CB 4.39Å; T686-E689 PolarHBondContact N-OE2 2.75Å; T686-E689 PolarHBondContact O-N 3.42Å; T686-E689 VanDerWaalsContact O-N 3.12Å; T686-E689 WeakPolarHBondContact OG1-CB 3.48Å; T686-E689 WeakPolarHBondContact OG1-CG 3.48Å; T686-E689 PolarHBondContact OG1-N 2.99Å; T686-E689 PolarHBondContact OG1-OE2 3.34Å; E689-A692 PolarHBondContact O-N 2.87Å; E689-M693 WeakPolarHBondContact O-CB 3.41Å; E689-M693 PolarHBondContact O-N 3.16Å
690	R	69.3	Low	66.7	Low	54 Å²	54	73.7 Å²	73.7	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-44.7	174.2	-69.3	-176.7	-178.6	131.4	7.7	111.1	E536 V540 K685 T686 P687 M693 V694	E536-R690 VanDerWaalsContact CD-NE 3.27Å; E536-R690 IonicContact OE1-CZ 2.81Å; E536-R690 VanDerWaalsContact OE1-CZ 3.31Å; E536-R690 IonicContact OE1-NE 2.64Å; E536-R690 PolarHBondContact OE1-NE 3.35Å; E536-R690 IonicContact OE1-NH2 2.87Å; E536-R690 PolarHBondContact OE1-NH2 2.87Å; E536-R690 IonicContact OE2-NE 2.9Å; V540-R690 HydrophobicContact CG2-CB 4.18Å; K685-R690 HydrophobicContact CB-CG 3.97Å; K685-R690 PolarHBondContact O-NH2 3.36Å; T686-R690 PolarHBondContact O-N 2.82Å; P687-R690 PolarHBondContact O-N 2.97Å; R690-M693 WeakPolarHBondContact O-CB 3.08Å; R690-M693 PolarHBondContact O-N 3.23Å; R690-V694 PolarHBondContact O-N 2.8Å
691	R	70.9	Confident	66.4	Low	88 Å²	88	73.4 Å²	73.4	33%	0.332	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-51.4	173.9	177.7	-175.1	163.2	-166.3	-3.9	112.1	L544 P687 E688 M693 V694 E695	L544-R691 HydrophobicContact CD2-CG 4.22Å; P687-R691 PolarHBondContact O-N 3.14Å; P687-R691 VanDerWaalsContact O-N 3.1Å; E688-R691 PolarHBondContact O-N 3.5Å; R691-M693 PolarHBondContact O-N 2.89Å; R691-V694 PolarHBondContact O-N 3.27Å; R691-E695 IonicContact CZ-OE1 3.68Å; R691-E695 VanDerWaalsContact CZ-OE1 3.28Å; R691-E695 IonicContact NE-OE1 3.87Å; R691-E695 PolarHBondContact NE-OE1 2.93Å; R691-E695 IonicContact NH2-OE1 3.28Å; R691-E695 PolarHBondContact NH2-OE1 3.12Å; R691-E695 PolarHBondContact O-N 2.92Å
692	A	73.2	Confident	66	Low	30 Å²	30	66.4 Å²	66.4	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-29.5	180	0	0	0	0	0	111.9	E688 E689 R696	E688-A692 WeakPolarHBondContact O-CB 3.49Å; E688-A692 PolarHBondContact O-N 3.45Å; E689-A692 PolarHBondContact O-N 2.87Å; A692-R696 WeakPolarHBondContact O-CB 3.34Å; A692-R696 VanDerWaalsContact O-CG 3.28Å; A692-R696 WeakPolarHBondContact O-CG 3.43Å; A692-R696 PolarHBondContact O-N 3.33Å
693	M	69.3	Low	65.6	Low	12 Å²	12	65.6 Å²	65.6	6%	0.059	33%	0.33	C	S	.	.	H	α-helix	trans	-67.4	-45.5	172.7	-168.2	-168	-42.6	0	0	112.2	T679 F680 K685 E689 R690 R691 E695 R696 F697	T679-M693 VanDerWaalsContact O-CE 3.26Å; T679-M693 WeakPolarHBondContact O-CE 3.43Å; T679-M693 PolarHBondContact OG1-SD 3.37Å; T679-M693 VanDerWaalsContact OG1-SD 3.36Å; F680-M693 HydrophobicContact CB-SD 4.24Å; F680-M693 HydrophobicContact CD1-CE 4.4Å; F680-M693 HydrophobicContact CD1-SD 3.26Å; F680-M693 WeakPolarHBondContact CD1-SD 3.32Å; F680-M693 HydrophobicContact CD2-SD 3.98Å; F680-M693 HydrophobicContact CE1-CG 4.21Å; F680-M693 HydrophobicContact CE1-SD 3.47Å; F680-M693 WeakPolarHBondContact CE1-SD 3.41Å; F680-M693 HydrophobicContact CE2-SD 4.19Å; F680-M693 HydrophobicContact CG-SD 3.55Å; F680-M693 VanDerWaalsContact CG-SD 3.55Å; F680-M693 HydrophobicContact CZ-CG 4.35Å; F680-M693 HydrophobicContact CZ-SD 3.95Å; K685-M693 HydrophobicContact CD-CE 3.24Å; E689-M693 WeakPolarHBondContact O-CB 3.41Å; E689-M693 PolarHBondContact O-N 3.16Å; R690-M693 WeakPolarHBondContact O-CB 3.08Å; R690-M693 PolarHBondContact O-N 3.23Å; R691-M693 PolarHBondContact O-N 2.89Å; M693-E695 VanDerWaalsContact C-N 3.33Å; M693-E695 PolarHBondContact O-N 3.12Å; M693-R696 CarbonylContact O-C 3.4Å; M693-R696 WeakPolarHBondContact O-CB 3.39Å; M693-R696 PolarHBondContact O-N 3.45Å; M693-F697 WeakPolarHBondContact O-CB 3.17Å; M693-F697 PolarHBondContact O-N 3.12Å
694	V	70.5	Confident	65.2	Low	1 Å²	1	60.7 Å²	60.7	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-39.7	174.9	175.9	0	0	0	0	111.4	A528 V532 V540 L544 F680 R690 R691 R696 F697 V698	A528-V694 HydrophobicContact CB-CG1 3.96Å; V532-V694 HydrophobicContact CG2-CG2 3.68Å; V540-V694 HydrophobicContact CG1-CB 4.47Å; V540-V694 HydrophobicContact CG1-CG2 3.65Å; L544-V694 HydrophobicContact CD1-CG1 4.22Å; F680-V694 HydrophobicContact CE1-CG2 4.38Å; R690-V694 PolarHBondContact O-N 2.8Å; R691-V694 PolarHBondContact O-N 3.27Å; V694-R696 PolarHBondContact O-N 2.99Å; V694-F697 WeakPolarHBondContact O-CB 3.49Å; V694-F697 PolarHBondContact O-N 3.22Å; V694-V698 HydrophobicContact CG1-CG2 4.32Å; V694-V698 VanDerWaalsContact O-CG2 3.28Å; V694-V698 WeakPolarHBondContact O-CG2 3.5Å; V694-V698 PolarHBondContact O-N 3.46Å
695	E	71.7	Confident	64.9	Low	60 Å²	60	55 Å²	55	28%	0.28	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-42.7	174.3	-70.5	177.8	176.8	0	0	111.6	R691 M693 V698 K699	R691-E695 IonicContact CZ-OE1 3.68Å; R691-E695 VanDerWaalsContact CZ-OE1 3.28Å; R691-E695 IonicContact NE-OE1 3.87Å; R691-E695 PolarHBondContact NE-OE1 2.93Å; R691-E695 IonicContact NH2-OE1 3.28Å; R691-E695 PolarHBondContact NH2-OE1 3.12Å; R691-E695 PolarHBondContact O-N 2.92Å; M693-E695 VanDerWaalsContact C-N 3.33Å; M693-E695 PolarHBondContact O-N 3.12Å; E695-V698 PolarHBondContact O-N 2.87Å; E695-K699 VanDerWaalsContact O-CB 3.3Å; E695-K699 WeakPolarHBondContact O-CB 3.35Å; E695-K699 PolarHBondContact O-N 2.57Å
696	R	70.3	Confident	64.3	Low	167 Å²	167	55.5 Å²	55.5	63%	0.63	27%	0.274	S	S	*	.	H	α-helix	trans	-61.8	-42.9	171.7	-78.1	-177.8	-124.2	-158.9	0.5	112.1	A692 M693 V694 K699 N700	A692-R696 WeakPolarHBondContact O-CB 3.34Å; A692-R696 VanDerWaalsContact O-CG 3.28Å; A692-R696 WeakPolarHBondContact O-CG 3.43Å; A692-R696 PolarHBondContact O-N 3.33Å; M693-R696 CarbonylContact O-C 3.4Å; M693-R696 WeakPolarHBondContact O-CB 3.39Å; M693-R696 PolarHBondContact O-N 3.45Å; V694-R696 PolarHBondContact O-N 2.99Å; R696-K699 PolarHBondContact O-N 2.92Å; R696-N700 VanDerWaalsContact O-CB 3.27Å; R696-N700 WeakPolarHBondContact O-CB 3.42Å; R696-N700 VanDerWaalsContact O-CG 3.25Å; R696-N700 PolarHBondContact O-N 2.94Å; R696-N700 PolarHBondContact O-ND2 3.41Å
697	F	69	Low	62.9	Low	1 Å²	1	52.7 Å²	52.7	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-47.3	175.1	-177.9	-83.3	0	0	0	110.6	A528 F531 L673 V676 F680 M693 V694 K699 N700 V701 C702 I705	A528-F697 HydrophobicContact CB-CD1 3.57Å; A528-F697 HydrophobicContact CB-CE1 3.88Å; F531-F697 HydrophobicContact CB-CE1 4.31Å; F531-F697 HydrophobicContact CB-CE2 3.8Å; F531-F697 HydrophobicContact CB-CZ 3.6Å; F531-F697 HydrophobicContact CD1-CZ 4.04Å; F531-F697 AromaticContact CD2-CE1 3.6Å; F531-F697 HydrophobicContact CD2-CE1 3.6Å; F531-F697 HydrophobicContact CD2-CE2 4.36Å; F531-F697 AromaticContact CD2-CZ 3.33Å; F531-F697 HydrophobicContact CD2-CZ 3.33Å; F531-F697 HydrophobicContact CE2-CE1 4.14Å; F531-F697 AromaticContact CE2-CZ 3.93Å; F531-F697 HydrophobicContact CE2-CZ 3.93Å; F531-F697 HydrophobicContact CG-CE1 4.1Å; F531-F697 HydrophobicContact CG-CE2 4.02Å; F531-F697 AromaticContact CG-CZ 3.37Å; F531-F697 HydrophobicContact CG-CZ 3.37Å; F531-F697 HydrophobicContact CZ-CZ 4.49Å; L673-F697 HydrophobicContact CD1-CD2 4.35Å; L673-F697 HydrophobicContact CD1-CE2 3.2Å; L673-F697 HydrophobicContact CD1-CZ 3.58Å; V676-F697 HydrophobicContact CB-CD2 4.32Å; V676-F697 HydrophobicContact CG1-CB 4.32Å; V676-F697 HydrophobicContact CG1-CD2 3.71Å; F680-F697 AromaticContact CE2-CD2 3.99Å; F680-F697 HydrophobicContact CE2-CD2 3.99Å; F680-F697 HydrophobicContact CE2-CE2 4.41Å; F680-F697 HydrophobicContact CZ-CD2 4.12Å; M693-F697 WeakPolarHBondContact O-CB 3.17Å; M693-F697 PolarHBondContact O-N 3.12Å; V694-F697 WeakPolarHBondContact O-CB 3.49Å; V694-F697 PolarHBondContact O-N 3.22Å; F697-K699 VanDerWaalsContact C-N 3.33Å; F697-K699 PolarHBondContact O-N 3.03Å; F697-N700 PolarHBondContact O-N 2.88Å; F697-V701 HydrophobicContact CD1-CB 4.24Å; F697-V701 HydrophobicContact CD2-CB 4.3Å; F697-V701 HydrophobicContact CD2-CG2 4.11Å; F697-V701 HydrophobicContact CE1-CB 4.12Å; F697-V701 HydrophobicContact CE1-CG1 4.05Å; F697-V701 HydrophobicContact CE2-CB 4.23Å; F697-V701 HydrophobicContact CE2-CG1 4.02Å; F697-V701 HydrophobicContact CE2-CG2 4.26Å; F697-V701 HydrophobicContact CG-CB 4.31Å; F697-V701 HydrophobicContact CG-CG2 4.41Å; F697-V701 HydrophobicContact CZ-CB 4.1Å; F697-V701 HydrophobicContact CZ-CG1 3.68Å; F697-V701 VanDerWaalsContact O-CA 3.31Å; F697-V701 WeakPolarHBondContact O-CA 3.31Å; F697-V701 WeakPolarHBondContact O-CB 3.48Å; F697-V701 PolarHBondContact O-N 2.96Å; F697-C702 PolarHBondContact O-N 3.3Å; F697-I705 HydrophobicContact CE1-CD1 4.42Å
698	V	65.1	Low	61.4	Low	2 Å²	2	52.5 Å²	52.5	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-41.4	179.6	176	0	0	0	0	111.2	H521 K524 Q525 A528 V694 E695 C702 C703	H521-V698 WeakPolarHBondContact CE1-CG1 3.39Å; H521-V698 VanDerWaalsContact ND1-CG1 3.32Å; H521-V698 WeakPolarHBondContact ND1-CG1 3.49Å; K524-V698 HydrophobicContact CB-CG1 3.99Å; Q525-V698 HydrophobicContact CB-CG2 4.24Å; Q525-V698 HydrophobicContact CG-CB 4.42Å; Q525-V698 HydrophobicContact CG-CG1 4.41Å; Q525-V698 HydrophobicContact CG-CG2 3.74Å; A528-V698 HydrophobicContact CB-CG2 3.47Å; A528-V698 VanDerWaalsContact CB-CG2 3.47Å; V694-V698 HydrophobicContact CG1-CG2 4.32Å; V694-V698 VanDerWaalsContact O-CG2 3.28Å; V694-V698 WeakPolarHBondContact O-CG2 3.5Å; V694-V698 PolarHBondContact O-N 3.46Å; E695-V698 PolarHBondContact O-N 2.87Å; V698-C702 HydrophobicContact CB-CB 4.13Å; V698-C702 HydrophobicContact CG1-CB 3.84Å; V698-C702 HydrophobicContact CG2-CB 4.34Å; V698-C702 WeakPolarHBondContact O-CB 3.42Å; V698-C702 PolarHBondContact O-N 2.94Å; V698-C703 PolarHBondContact O-N 2.93Å
699	K	65.9	Low	60.1	Low	138 Å²	138	49.7 Å²	49.7	60%	0.6	25%	0.247	S	C	*	.	H	α-helix	trans	-62.2	-46.6	177.9	-171.4	178.8	-179.5	-178.3	0	111.9	E695 R696 F697 C703	E695-K699 VanDerWaalsContact O-CB 3.3Å; E695-K699 WeakPolarHBondContact O-CB 3.35Å; E695-K699 PolarHBondContact O-N 2.57Å; R696-K699 PolarHBondContact O-N 2.92Å; F697-K699 VanDerWaalsContact C-N 3.33Å; F697-K699 PolarHBondContact O-N 3.03Å; K699-C703 PolarHBondContact O-SG 3Å; K699-C703 VanDerWaalsContact O-SG 3.36Å
700	N	59.8	Low	58.9	Low	74 Å²	74	47.3 Å²	47.3	40%	0.396	23%	0.234	S	C	.	.	H	α-helix	trans	-87.8	-38.1	-172.6	-64.8	-17.5	0	0	0	113.1	Q672 R696 F697	Q672-N700 PolarHBondContact OE1-O 3.22Å; R696-N700 VanDerWaalsContact O-CB 3.27Å; R696-N700 WeakPolarHBondContact O-CB 3.42Å; R696-N700 VanDerWaalsContact O-CG 3.25Å; R696-N700 PolarHBondContact O-N 2.94Å; R696-N700 PolarHBondContact O-ND2 3.41Å; F697-N700 PolarHBondContact O-N 2.88Å
701	V	57.3	Low	57.8	Low	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-47.6	-166.1	-174.4	0	0	0	0	110.7	F669 Q672 L673 V676 F697 C703 C704	F669-V701 HydrophobicContact CD2-CG1 3.74Å; F669-V701 WeakPolarHBondContact CD2-O 3.47Å; F669-V701 HydrophobicContact CE2-CB 4.34Å; F669-V701 HydrophobicContact CE2-CG1 3.21Å; F669-V701 VanDerWaalsContact CE2-O 3.22Å; F669-V701 WeakPolarHBondContact CE2-O 3.32Å; F669-V701 HydrophobicContact CZ-CG1 3.93Å; Q672-V701 HydrophobicContact CB-CG2 4.22Å; L673-V701 HydrophobicContact CB-CG1 4.31Å; L673-V701 HydrophobicContact CD1-CG1 4.1Å; V676-V701 HydrophobicContact CG2-CG2 4.11Å; F697-V701 HydrophobicContact CD1-CB 4.24Å; F697-V701 HydrophobicContact CD2-CB 4.3Å; F697-V701 HydrophobicContact CD2-CG2 4.11Å; F697-V701 HydrophobicContact CE1-CB 4.12Å; F697-V701 HydrophobicContact CE1-CG1 4.05Å; F697-V701 HydrophobicContact CE2-CB 4.23Å; F697-V701 HydrophobicContact CE2-CG1 4.02Å; F697-V701 HydrophobicContact CE2-CG2 4.26Å; F697-V701 HydrophobicContact CG-CB 4.31Å; F697-V701 HydrophobicContact CG-CG2 4.41Å; F697-V701 HydrophobicContact CZ-CB 4.1Å; F697-V701 HydrophobicContact CZ-CG1 3.68Å; F697-V701 VanDerWaalsContact O-CA 3.31Å; F697-V701 WeakPolarHBondContact O-CA 3.31Å; F697-V701 WeakPolarHBondContact O-CB 3.48Å; F697-V701 PolarHBondContact O-N 2.96Å; V701-C703 VanDerWaalsContact C-N 3.27Å; V701-C703 PolarHBondContact O-N 3.3Å; V701-C704 PolarHBondContact O-N 3.35Å; V701-C704 VanDerWaalsContact O-N 3.12Å
702	C	54.2	Low	56.4	Low	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-68.1	-20.1	-176	-68.4	0	0	0	0	114.6	K524 F697 V698 C704 I705	K524-C702 HydrophobicContact CB-CB 4.07Å; K524-C702 HydrophobicContact CD-CB 4.17Å; K524-C702 PolarHBondContact NZ-O 2.92Å; F697-C702 PolarHBondContact O-N 3.3Å; V698-C702 HydrophobicContact CB-CB 4.13Å; V698-C702 HydrophobicContact CG1-CB 3.84Å; V698-C702 HydrophobicContact CG2-CB 4.34Å; V698-C702 WeakPolarHBondContact O-CB 3.42Å; V698-C702 PolarHBondContact O-N 2.94Å; C702-C704 PolarHBondContact O-N 3.11Å; C702-C704 VanDerWaalsContact O-N 3.16Å; C702-I705 HydrophobicContact CB-CD1 4.18Å; C702-I705 PolarHBondContact O-N 2.63Å; C702-I705 VanDerWaalsContact SG-CD1 3.56Å
703	C	48.2	Very low	55.2	Low	92 Å²	92	43.9 Å²	43.9	62%	0.622	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-54	-33.1	172.2	-72.6	0	0	0	0	111.8	K524 V698 K699 V701	K524-C703 PolarHBondContact NZ-O 3.04Å; V698-C703 PolarHBondContact O-N 2.93Å; K699-C703 PolarHBondContact O-SG 3Å; K699-C703 VanDerWaalsContact O-SG 3.36Å; V701-C703 VanDerWaalsContact C-N 3.27Å; V701-C703 PolarHBondContact O-N 3.3Å
704	C	46.6	Very low	54.1	Low	44 Å²	44	47.3 Å²	47.3	30%	0.297	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-86.8	-14.3	176.7	-61	0	0	0	0	114.4	F669 V701 C702 F706	F669-C704 HydrophobicContact CB-CB 4.04Å; F669-C704 HydrophobicContact CD2-CB 3.44Å; F669-C704 VanDerWaalsContact CD2-CB 3.44Å; F669-C704 HydrophobicContact CE2-CB 4.14Å; F669-C704 HydrophobicContact CG-CB 4Å; V701-C704 PolarHBondContact O-N 3.35Å; V701-C704 VanDerWaalsContact O-N 3.12Å; C702-C704 PolarHBondContact O-N 3.11Å; C702-C704 VanDerWaalsContact O-N 3.16Å; C704-F706 VanDerWaalsContact C-N 3.34Å; C704-F706 PolarHBondContact O-N 3.03Å
705	I	46.7	Very low	53	Low	7 Å²	7	53.8 Å²	53.8	4%	0.036	26%	0.262	C	S	.	.	S	Bend	trans	-70.7	90.4	177.8	-61.2	179.4	0	0	0	110	K524 L527 F531 F669 F697 C702 L707	K524-I705 PolarHBondContact NZ-O 3.47Å; L527-I705 HydrophobicContact CD1-CG2 3.99Å; F531-I705 HydrophobicContact CE2-CD1 3.88Å; F531-I705 HydrophobicContact CZ-CD1 4.31Å; F669-I705 HydrophobicContact CE2-CD1 4.17Å; F669-I705 HydrophobicContact CE2-CG1 3.53Å; F669-I705 HydrophobicContact CZ-CD1 4.16Å; F669-I705 HydrophobicContact CZ-CG1 3.65Å; F697-I705 HydrophobicContact CE1-CD1 4.42Å; C702-I705 HydrophobicContact CB-CD1 4.18Å; C702-I705 PolarHBondContact O-N 2.63Å; C702-I705 VanDerWaalsContact SG-CD1 3.56Å; I705-L707 VanDerWaalsContact C-N 3.31Å; I705-L707 PolarHBondContact O-N 2.95Å
706	F	52.8	Low	51.8	Low	48 Å²	48	53.9 Å²	53.9	21%	0.211	26%	0.26	C	S	.	.	S	Bend		44.7	7	128.9	-72.4	-62.5	0	0	0	123.4	N610 C704 R710	N610-F706 WeakPolarHBondContact OD1-CE2 3.39Å; C704-F706 VanDerWaalsContact C-N 3.34Å; C704-F706 PolarHBondContact O-N 3.03Å; F706-R710 HydrophobicContact CB-CG 4.31Å; F706-R710 HydrophobicContact CD1-CG 3.8Å; F706-R710 VanDerWaalsContact CD1-NE 3.3Å; F706-R710 HydrophobicContact CG-CG 4.45Å; F706-R710 WeakPolarHBondContact O-CB 3.25Å
707	L	46.3	Very low	50.7	Low	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.236	C	C	.	.	S	Bend	trans	-76.7	-51.5	175.1	-77.2	167.4	0	0	0	114.4	D497 L500 W501 Y513 K524 L527 I705 Q711	D497-L707 HydrophobicContact CB-CD2 4.26Å; L500-L707 HydrophobicContact CD2-CD1 4.16Å; W501-L707 HydrophobicContact CB-CD2 4.21Å; Y513-L707 HydrophobicContact CE2-CD1 4.48Å; Y513-L707 WeakPolarHBondContact OH-CD1 3.47Å; K524-L707 HydrophobicContact CG-CD1 4.49Å; L527-L707 HydrophobicContact CD1-CD1 3.95Å; L527-L707 HydrophobicContact CD1-CG 4.35Å; I705-L707 VanDerWaalsContact C-N 3.31Å; I705-L707 PolarHBondContact O-N 2.95Å; L707-Q711 WeakPolarHBondContact O-CB 3.28Å; L707-Q711 WeakPolarHBondContact O-CG 3.27Å
708	P	38.7	Very low	49.5	Very low	53 Å²	53	54.4 Å²	54.4	34%	0.344	27%	0.271	S	S	.	.	H	α-helix	trans	-76.8	-48.6	-173.8	-15.6	30.9	0	0	0	113.4	R710 Q711 I712	P708-R710 PolarHBondContact O-N 2.79Å; P708-Q711 PolarHBondContact O-N 3.01Å; P708-I712 HydrophobicContact CB-CD1 4.17Å; P708-I712 VanDerWaalsContact O-CB 3.27Å; P708-I712 WeakPolarHBondContact O-CB 3.47Å; P708-I712 WeakPolarHBondContact O-CD1 3.32Å; P708-I712 WeakPolarHBondContact O-CG1 3.37Å; P708-I712 PolarHBondContact O-N 2.94Å
709	T	44	Very low	48.6	Very low	74 Å²	74	59 Å²	59	45%	0.454	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-43.1	-171.3	-39.3	0	0	0	0	112.1	A713 Y727	T709-A713 WeakPolarHBondContact O-CB 3.31Å; T709-A713 PolarHBondContact O-N 2.92Å; T709-A713 VanDerWaalsContact O-N 3.12Å; T709-Y727 HydrophobicContact CG2-CD1 3.59Å; T709-Y727 HydrophobicContact CG2-CE1 4.14Å
710	R	47.1	Very low	47.4	Very low	45 Å²	45	55.9 Å²	55.9	17%	0.17	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-42.1	177.7	-76.1	-175.5	175.1	164.4	-9.6	112.2	D497 F706 P708 K714	D497-R710 IonicContact OD2-NH1 3.52Å; D497-R710 PolarHBondContact OD2-NH1 3Å; F706-R710 HydrophobicContact CB-CG 4.31Å; F706-R710 HydrophobicContact CD1-CG 3.8Å; F706-R710 VanDerWaalsContact CD1-NE 3.3Å; F706-R710 HydrophobicContact CG-CG 4.45Å; F706-R710 WeakPolarHBondContact O-CB 3.25Å; P708-R710 PolarHBondContact O-N 2.79Å; R710-K714 WeakPolarHBondContact O-CB 3.32Å; R710-K714 VanDerWaalsContact O-CG 3.25Å; R710-K714 WeakPolarHBondContact O-CG 3.42Å; R710-K714 PolarHBondContact O-N 3.28Å
711	Q	46.8	Very low	46.3	Very low	28 Å²	28	56.8 Å²	56.8	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-81.2	-34.1	-174.4	-67.8	-175.9	-0.5	0	0	113.2	W501 L707 P708 K714 R715	W501-Q711 VanDerWaalsContact CD1-CD 3.4Å; W501-Q711 VanDerWaalsContact CG-CD 3.42Å; L707-Q711 WeakPolarHBondContact O-CB 3.28Å; L707-Q711 WeakPolarHBondContact O-CG 3.27Å; P708-Q711 PolarHBondContact O-N 3.01Å; Q711-K714 PolarHBondContact O-N 3.01Å; Q711-R715 WeakPolarHBondContact O-CB 3.43Å; Q711-R715 WeakPolarHBondContact O-CG 3.31Å; Q711-R715 PolarHBondContact O-N 2.9Å
712	I	42	Very low	45.5	Very low	58 Å²	58	68.2 Å²	68.2	30%	0.297	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-47.7	171.5	-68.6	166.6	0	0	0	109	P708 K714 R715 Y716 Y727	P708-I712 HydrophobicContact CB-CD1 4.17Å; P708-I712 VanDerWaalsContact O-CB 3.27Å; P708-I712 WeakPolarHBondContact O-CB 3.47Å; P708-I712 WeakPolarHBondContact O-CD1 3.32Å; P708-I712 WeakPolarHBondContact O-CG1 3.37Å; P708-I712 PolarHBondContact O-N 2.94Å; I712-K714 PolarHBondContact O-N 3.1Å; I712-R715 PolarHBondContact O-N 3.34Å; I712-Y716 HydrophobicContact CG2-CD2 3.52Å; I712-Y716 HydrophobicContact CG2-CE2 3.28Å; I712-Y716 WeakPolarHBondContact O-CD2 3.46Å; I712-Y716 PolarHBondContact O-N 3.37Å; I712-Y727 HydrophobicContact CB-CE1 4.28Å; I712-Y727 HydrophobicContact CG2-CE1 3.92Å; I712-Y727 HydrophobicContact CG2-CE2 4.05Å; I712-Y727 WeakPolarHBondContact CG2-OH 3.48Å
713	A	47.6	Very low	45	Very low	15 Å²	15	69.2 Å²	69.2	12%	0.124	36%	0.355	C	S	.	.	H	α-helix	trans	-56.9	-48.6	172.9	0	0	0	0	0	111.8	T709 R715 Y716 V717 I723	T709-A713 WeakPolarHBondContact O-CB 3.31Å; T709-A713 PolarHBondContact O-N 2.92Å; T709-A713 VanDerWaalsContact O-N 3.12Å; A713-R715 VanDerWaalsContact C-N 3.34Å; A713-R715 PolarHBondContact O-N 3.35Å; A713-Y716 PolarHBondContact O-N 2.96Å; A713-V717 WeakPolarHBondContact O-CG2 3.44Å; A713-V717 PolarHBondContact O-N 2.96Å; A713-I723 HydrophobicContact CB-CD1 4.15Å
714	K	46.1	Very low	44.6	Very low	83 Å²	83	66.8 Å²	66.8	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-38.3	175.5	-76.5	173.9	176.6	178.7	0	113	E498 R710 Q711 I712 V717 H718	E498-K714 IonicContact OE1-NZ 3.53Å; E498-K714 PolarHBondContact OE1-NZ 3.49Å; R710-K714 WeakPolarHBondContact O-CB 3.32Å; R710-K714 VanDerWaalsContact O-CG 3.25Å; R710-K714 WeakPolarHBondContact O-CG 3.42Å; R710-K714 PolarHBondContact O-N 3.28Å; Q711-K714 PolarHBondContact O-N 3.01Å; I712-K714 PolarHBondContact O-N 3.1Å; K714-V717 PolarHBondContact O-N 3.15Å; K714-H718 PolarHBondContact O-N 3.44Å
715	R	45.9	Very low	44.2	Very low	137 Å²	137	75.4 Å²	75.4	52%	0.517	37%	0.365	S	S	.	.	H	α-helix	trans	-71.4	-43.6	177.7	-82.5	-175	179.3	-176	-0.8	113.2	Q711 I712 A713 V717 H718 N719	Q711-R715 WeakPolarHBondContact O-CB 3.43Å; Q711-R715 WeakPolarHBondContact O-CG 3.31Å; Q711-R715 PolarHBondContact O-N 2.9Å; I712-R715 PolarHBondContact O-N 3.34Å; A713-R715 VanDerWaalsContact C-N 3.34Å; A713-R715 PolarHBondContact O-N 3.35Å; R715-V717 PolarHBondContact O-N 2.88Å; R715-H718 PolarHBondContact O-N 2.96Å; R715-H718 VanDerWaalsContact O-N 3.09Å; R715-N719 PolarHBondContact O-N 3.36Å
716	Y	47.4	Very low	43.8	Very low	62 Å²	62	82 Å²	82	24%	0.243	39%	0.389	C	S	.	.	H	α-helix	trans	-54.4	-40.2	173	-84.3	-73.1	0	0	0	109.9	I712 A713 G720 L721 P724 Y727	I712-Y716 HydrophobicContact CG2-CD2 3.52Å; I712-Y716 HydrophobicContact CG2-CE2 3.28Å; I712-Y716 WeakPolarHBondContact O-CD2 3.46Å; I712-Y716 PolarHBondContact O-N 3.37Å; A713-Y716 PolarHBondContact O-N 2.96Å; Y716-G720 PolarHBondContact O-N 3.45Å; Y716-L721 CarbonylContact C-O 3.58Å; Y716-L721 HydrophobicContact CD1-CB 3.65Å; Y716-L721 HydrophobicContact CD1-CD1 4.09Å; Y716-L721 HydrophobicContact CE1-CB 4.48Å; Y716-L721 HydrophobicContact CE1-CD1 4.38Å; Y716-L721 CarbonylContact O-C 3.51Å; Y716-L721 WeakPolarHBondContact O-CA 3.45Å; Y716-L721 WeakPolarHBondContact O-CB 3.48Å; Y716-L721 PolarHBondContact O-N 3Å; Y716-P724 HydrophobicContact CE1-CG 4.41Å; Y716-P724 HydrophobicContact CE2-CG 4.26Å; Y716-Y727 HydrophobicContact CE2-CE2 4.07Å
717	V	46.7	Very low	43.2	Very low	20 Å²	20	82.2 Å²	82.2	12%	0.121	39%	0.389	C	S	.	.	H	α-helix	trans	-69.4	-41.2	175.9	-173.7	0	0	0	0	113.2	Y620 L621 V624 A713 K714 R715 N719 G720 I723	Y620-V717 HydrophobicContact CD1-CG1 4.4Å; Y620-V717 HydrophobicContact CE1-CB 4.09Å; Y620-V717 HydrophobicContact CE1-CG1 3.43Å; Y620-V717 VanDerWaalsContact CE1-CG1 3.43Å; Y620-V717 HydrophobicContact CE1-CG2 4.36Å; L621-V717 HydrophobicContact CD2-CG1 4.36Å; L621-V717 HydrophobicContact CD2-CG2 3.34Å; V624-V717 HydrophobicContact CG2-CG1 4.17Å; A713-V717 WeakPolarHBondContact O-CG2 3.44Å; A713-V717 PolarHBondContact O-N 2.96Å; K714-V717 PolarHBondContact O-N 3.15Å; R715-V717 PolarHBondContact O-N 2.88Å; V717-N719 VanDerWaalsContact C-N 3.26Å; V717-N719 PolarHBondContact O-N 3.02Å; V717-G720 PolarHBondContact O-N 3.28Å; V717-G720 VanDerWaalsContact O-N 3.11Å; V717-I723 HydrophobicContact CG2-CD1 3.73Å; V717-I723 HydrophobicContact CG2-CG1 4.14Å
718	H	45	Very low	42.7	Very low	159 Å²	159	88.6 Å²	88.6	74%	0.736	42%	0.417	S	S	*	.	H	α-helix	trans	-59.8	-38.8	178.5	-169.7	65.9	0	0	0	112.3	K714 R715 G720	K714-H718 PolarHBondContact O-N 3.44Å; R715-H718 PolarHBondContact O-N 2.96Å; R715-H718 VanDerWaalsContact O-N 3.09Å; H718-G720 VanDerWaalsContact C-N 3.27Å; H718-G720 PolarHBondContact O-N 3.15Å
719	N	46.6	Very low	42.3	Very low	99 Å²	99	96.9 Å²	96.9	53%	0.529	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	6	179.6	-65.2	0.6	0	0	0	113.2	R715 V717 L721	R715-N719 PolarHBondContact O-N 3.36Å; V717-N719 VanDerWaalsContact C-N 3.26Å; V717-N719 PolarHBondContact O-N 3.02Å; N719-L721 HydrophobicContact CB-CD1 3.88Å; N719-L721 HydrophobicContact CB-CG 4Å; N719-L721 PolarHBondContact O-N 3.18Å
720	G	39.3	Very low	42.2	Very low	73 Å²	73	98.1 Å²	98.1	75%	0.753	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	16.4	-176.8	0	0	0	0	0	114.4	Y716 V717 H718	Y716-G720 PolarHBondContact O-N 3.45Å; V717-G720 PolarHBondContact O-N 3.28Å; V717-G720 VanDerWaalsContact O-N 3.11Å; H718-G720 VanDerWaalsContact C-N 3.27Å; H718-G720 PolarHBondContact O-N 3.15Å
721	L	37.5	Very low	41.9	Very low	93 Å²	93	100.8 Å²	100.8	49%	0.487	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-87.9	146.3	-178.7	-64.5	170	0	0	0	111.1	Y716 N719 I723	Y716-L721 CarbonylContact C-O 3.58Å; Y716-L721 HydrophobicContact CD1-CB 3.65Å; Y716-L721 HydrophobicContact CD1-CD1 4.09Å; Y716-L721 HydrophobicContact CE1-CB 4.48Å; Y716-L721 HydrophobicContact CE1-CD1 4.38Å; Y716-L721 CarbonylContact O-C 3.51Å; Y716-L721 WeakPolarHBondContact O-CA 3.45Å; Y716-L721 WeakPolarHBondContact O-CB 3.48Å; Y716-L721 PolarHBondContact O-N 3Å; N719-L721 HydrophobicContact CB-CD1 3.88Å; N719-L721 HydrophobicContact CB-CG 4Å; N719-L721 PolarHBondContact O-N 3.18Å; L721-I723 PolarHBondContact O-N 3.21Å
722	R	40.6	Very low	41.6	Very low	240 Å²	240	104.9 Å²	104.9	91%	0.906	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-68	123.1	173.7	-79.6	-175.9	174.6	-179.1	-0.3	109.9	P724	R722-P724 VanDerWaalsContact O-CD 3.29Å; R722-P724 WeakPolarHBondContact O-CD 3.36Å
723	I	43.1	Very low	41.6	Very low	20 Å²	20	107.6 Å²	107.6	10%	0.103	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-58.4	123.5	168.5	-61.4	172.5	0	0	0	108.5	L621 A713 V717 L721 R725 Y727 F728	L621-I723 HydrophobicContact CD1-CD1 3.93Å; L621-I723 HydrophobicContact CD2-CD1 3.83Å; L621-I723 HydrophobicContact CG-CD1 4.49Å; A713-I723 HydrophobicContact CB-CD1 4.15Å; V717-I723 HydrophobicContact CG2-CD1 3.73Å; V717-I723 HydrophobicContact CG2-CG1 4.14Å; L721-I723 PolarHBondContact O-N 3.21Å; I723-R725 PolarHBondContact O-N 2.95Å; I723-Y727 VanDerWaalsContact CG2-CB 3.5Å; I723-Y727 HydrophobicContact CG2-CD2 3.93Å; I723-Y727 HydrophobicContact CG2-CG 4.07Å; I723-F728 HydrophobicContact CB-CD2 4.34Å; I723-F728 HydrophobicContact CB-CE2 3.73Å; I723-F728 HydrophobicContact CB-CZ 4.36Å; I723-F728 HydrophobicContact CG2-CD2 4.09Å; I723-F728 HydrophobicContact CG2-CE2 3.96Å
724	P	40	Very low	41.2	Very low	41 Å²	41	113.4 Å²	113.4	27%	0.266	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-54.7	139	173.6	-28.8	36	0	0	0	111.7	Y716 R722 R726 Y727	Y716-P724 HydrophobicContact CE1-CG 4.41Å; Y716-P724 HydrophobicContact CE2-CG 4.26Å; R722-P724 VanDerWaalsContact O-CD 3.29Å; R722-P724 WeakPolarHBondContact O-CD 3.36Å; P724-R726 HydrophobicContact CB-CG 4.04Å; P724-R726 PolarHBondContact O-N 3.49Å; P724-Y727 HydrophobicContact CB-CD2 3.87Å; P724-Y727 HydrophobicContact CB-CE2 4.02Å; P724-Y727 HydrophobicContact CG-CD2 4.02Å; P724-Y727 HydrophobicContact CG-CE2 3.86Å; P724-Y727 PolarHBondContact O-N 3Å
725	R	37.7	Very low	40.9	Very low	226 Å²	226	115.5 Å²	115.5	85%	0.853	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-51	-22.4	-179.4	-83.5	-176	170.1	-177.3	-3.9	114.6	I723 Y727 F728 R729	I723-R725 PolarHBondContact O-N 2.95Å; R725-Y727 VanDerWaalsContact C-N 3.28Å; R725-Y727 PolarHBondContact O-N 3.13Å; R725-F728 PolarHBondContact O-N 3.27Å; R725-R729 PolarHBondContact O-N 3.04Å
726	R	39.7	Very low	40.6	Very low	145 Å²	145	113.9 Å²	113.9	55%	0.547	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-66.3	-22.8	176.5	68.5	177.8	179.6	-163.6	-3.1	114.4	D34 P724	D34-R726 IonicContact OD1-NH2 2.81Å; D34-R726 PolarHBondContact OD1-NH2 3.5Å; P724-R726 HydrophobicContact CB-CG 4.04Å; P724-R726 PolarHBondContact O-N 3.49Å
727	Y	40.4	Very low	40	Very low	52 Å²	52	117.9 Å²	117.9	20%	0.204	54%	0.536	C	S	.	.	G	3₁₀ helix	trans	-91.9	-13.8	176.5	-61	-79	0	0	0	113	T709 I712 Y716 I723 P724 R725	T709-Y727 HydrophobicContact CG2-CD1 3.59Å; T709-Y727 HydrophobicContact CG2-CE1 4.14Å; I712-Y727 HydrophobicContact CB-CE1 4.28Å; I712-Y727 HydrophobicContact CG2-CE1 3.92Å; I712-Y727 HydrophobicContact CG2-CE2 4.05Å; I712-Y727 WeakPolarHBondContact CG2-OH 3.48Å; Y716-Y727 HydrophobicContact CE2-CE2 4.07Å; I723-Y727 VanDerWaalsContact CG2-CB 3.5Å; I723-Y727 HydrophobicContact CG2-CD2 3.93Å; I723-Y727 HydrophobicContact CG2-CG 4.07Å; P724-Y727 HydrophobicContact CB-CD2 3.87Å; P724-Y727 HydrophobicContact CB-CE2 4.02Å; P724-Y727 HydrophobicContact CG-CD2 4.02Å; P724-Y727 HydrophobicContact CG-CE2 3.86Å; P724-Y727 PolarHBondContact O-N 3Å; R725-Y727 VanDerWaalsContact C-N 3.28Å; R725-Y727 PolarHBondContact O-N 3.13Å
728	F	35.6	Very low	39.5	Very low	137 Å²	137	126.1 Å²	126.1	60%	0.601	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-19.2	171.7	-81.4	-79.3	0	0	0	112.6	L621 I723 R725	L621-F728 HydrophobicContact CD1-CE1 3.88Å; L621-F728 HydrophobicContact CD1-CZ 4.02Å; I723-F728 HydrophobicContact CB-CD2 4.34Å; I723-F728 HydrophobicContact CB-CE2 3.73Å; I723-F728 HydrophobicContact CB-CZ 4.36Å; I723-F728 HydrophobicContact CG2-CD2 4.09Å; I723-F728 HydrophobicContact CG2-CE2 3.96Å; R725-F728 PolarHBondContact O-N 3.27Å
729	R	28.6	Very low	39	Very low	228 Å²	228	123.1 Å²	123.1	86%	0.86	56%	0.555	S	S	*	*			trans	-83.4	0	165.6	-71.7	-177.2	176.6	-174.5	-3.4	106.1	T663 R725	T663-R729 WeakPolarHBondContact CG2-O 3.28Å; R725-R729 PolarHBondContact O-N 3.04Å

Retrieved 729 of 729 residues in 317.2 ms (Link to these results)

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