A0A077Z0V6_TRITR Loading...

RUN domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0V6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 567 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	38.3	Very low	38.8	Very low	231 Å²	231	154.6 Å²	154.6	100%	1.138	81%	0.805	S	S	*	*				0	126.4	0	-79.2	164.5	154	0	0	106.7
2	E	36.2	Very low	39.1	Very low	158 Å²	158	150.6 Å²	150.6	74%	0.738	80%	0.799	S	S	*	*			trans	63	158.4	168.4	-55.2	-171.4	90.8	0	0	116.3
3	R	38.9	Very low	39.2	Very low	210 Å²	210	147 Å²	147	79%	0.792	79%	0.79	S	S	*	*			cis	-164.6	152.9	-23.2	-108.3	-179.8	156.4	135.2	-10.6	107.2
4	S	43.3	Very low	39.3	Very low	83 Å²	83	147.8 Å²	147.8	58%	0.58	79%	0.794	S	S	*	*			cis	-175	132.5	-27.3	46.4	0	0	0	0	111.3
5	N	38.7	Very low	39.4	Very low	161 Å²	161	148.2 Å²	148.2	86%	0.861	80%	0.796	S	S	*	*			trans	74.5	153.9	155.1	-54.2	7	0	0	0	119.7
6	G	42.6	Very low	39.4	Very low	76 Å²	76	144.9 Å²	144.9	78%	0.784	79%	0.788	S	S	*	*			trans	167.1	57.8	-176.5	0	0	0	0	0	114.2
7	D	42.4	Very low	39.5	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	79%	0.793	S	S	*	*			trans	-23.9	135.4	176.6	-39.4	-36.1	0	0	0	116.7
8	L	35.9	Very low	39.5	Very low	152 Å²	152	144.2 Å²	144.2	80%	0.796	79%	0.794	S	S	*	*			cis	75.6	96.2	37.8	-163.5	128.8	0	0	0	115.7
9	L	41.9	Very low	39.5	Very low	178 Å²	178	146.6 Å²	146.6	93%	0.932	80%	0.799	S	S	*	*			trans	-139.8	152.3	151.9	-78.8	-177.5	0	0	0	110.3
10	L	33.8	Very low	39.4	Very low	128 Å²	128	148.2 Å²	148.2	67%	0.67	80%	0.798	S	S	*	*			trans	-156.1	170.8	-169	-141	171.8	0	0	0	108.3
11	F	35	Very low	39	Very low	180 Å²	180	147 Å²	147	79%	0.789	80%	0.796	S	S	*	*			trans	75.4	147.5	178.4	-53.3	-80.2	0	0	0	115.4
12	S	42	Very low	38.9	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	78%	0.777	S	S	*	*			cis	-135.8	162.5	5.4	-69.4	0	0	0	0	112.8
13	P	40.5	Very low	38.8	Very low	104 Å²	104	142.9 Å²	142.9	68%	0.675	79%	0.785	S	S	*	*			trans	-87.4	-159.5	159.9	39.9	-35.8	0	0	0	112.2
14	D	40.3	Very low	38.9	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	79%	0.788	S	S	*	*			trans	77.7	146.6	-175.6	-48.3	-29.2	0	0	0	113.9
15	D	41	Very low	38.6	Very low	154 Å²	154	142.2 Å²	142.2	82%	0.824	80%	0.797	S	S	*	*			cis	-138.3	-175.8	11.3	-163.1	-7.2	0	0	0	111.6
16	S	39.7	Very low	38.6	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	80%	0.797	S	S	*	*			trans	-91.2	158.7	-159.2	55.3	0	0	0	0	117.5
17	S	41.5	Very low	38.5	Very low	124 Å²	124	143.3 Å²	143.3	87%	0.867	80%	0.798	S	S	*	*			trans	-175.6	138.9	136.2	26.5	0	0	0	0	113.1
18	D	39.2	Very low	38.7	Very low	152 Å²	152	147.9 Å²	147.9	81%	0.813	81%	0.805	S	S	*	*			trans	-87	134	-175.2	-68.9	-85.3	0	0	0	115.4
19	Q	40.1	Very low	39.7	Very low	190 Å²	190	148 Å²	148	89%	0.888	81%	0.805	S	S	*	*			trans	-152	66.6	156.5	-145.4	102.3	111.8	0	0	116
20	K	37	Very low	40.6	Very low	179 Å²	179	144.6 Å²	144.6	78%	0.778	79%	0.792	S	S	*	*			trans	28.8	125.4	132.8	-168.5	175.1	-179.7	176.6	0	120.7
21	T	31.4	Very low	41.5	Very low	124 Å²	124	143.5 Å²	143.5	76%	0.761	79%	0.792	S	S	*	*			trans	65.3	140.7	159.3	51.8	0	0	0	0	117.7
22	S	35.5	Very low	42.2	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	80%	0.8	S	S	*	*			cis	-142.5	163.2	24.1	-66.6	0	0	0	0	113.9
23	E	33.7	Very low	42.7	Very low	194 Å²	194	142.4 Å²	142.4	91%	0.907	80%	0.802	S	S	*	*			trans	-70.2	140.3	165.7	-57.7	173.9	132.4	0	0	111.2
24	L	41.9	Very low	43.1	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	79%	0.794	S	S	*	*			trans	-136.5	149.8	164.1	-77.3	176.1	0	0	0	110.1
25	P	37.6	Very low	43.2	Very low	118 Å²	118	136.9 Å²	136.9	77%	0.766	79%	0.788	S	S	*	*			trans	-75.3	152.6	-165.5	-15.8	32.2	0	0	0	113.5	E27	P25-E27 PolarHBondContact O-N 3.49Å; P25-E27 VanDerWaalsContact O-N 3.08Å
26	G	38.2	Very low	43.6	Very low	83 Å²	83	134.8 Å²	134.8	86%	0.856	79%	0.785	S	S	*	*			trans	-55.5	111.5	-177.2	0	0	0	0	0	113.7	R28	G26-R28 PolarHBondContact O-N 3.37Å
27	E	40.8	Very low	43.8	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.822	79%	0.794	S	S	*	*			trans	-72.9	112.6	-175	-166.9	167.1	-136.5	0	0	111.2	P25 L29	P25-E27 PolarHBondContact O-N 3.49Å; P25-E27 VanDerWaalsContact O-N 3.08Å; E27-L29 PolarHBondContact O-N 3.26Å
28	R	45.1	Very low	44	Very low	241 Å²	241	140.2 Å²	140.2	91%	0.909	79%	0.791	S	S	*	*			trans	-80.6	85.2	-174.7	-167.6	-175.6	-168.3	-165.3	4.5	110.6	G26 V30	G26-R28 PolarHBondContact O-N 3.37Å; R28-V30 PolarHBondContact O-N 2.9Å
29	L	57.3	Low	44.5	Very low	153 Å²	153	140.7 Å²	140.7	80%	0.801	79%	0.792	S	S	*	*			trans	-43.9	125	178.6	-66.2	174.2	0	0	0	112.4	E27	E27-L29 PolarHBondContact O-N 3.26Å
30	V	61.6	Low	44.2	Very low	107 Å²	107	141.5 Å²	141.5	65%	0.648	80%	0.796	S	S	*	*			trans	-71.2	139.7	178.7	-176.9	0	0	0	0	109.5	R28 I32 A34	R28-V30 PolarHBondContact O-N 2.9Å; V30-I32 PolarHBondContact O-N 3.5Å; V30-A34 HydrophobicContact CG1-CB 3.85Å
31	P	52.1	Low	44.6	Very low	105 Å²	105	135 Å²	135	68%	0.682	78%	0.78	S	S	*	*			trans	-57.5	131.4	180	-26.7	35.6	0	0	0	113.2	G33 A34	P31-G33 PolarHBondContact O-N 2.86Å; P31-A34 PolarHBondContact O-N 3.25Å; P31-A34 VanDerWaalsContact O-N 3.14Å
32	I	50.3	Low	45.1	Very low	187 Å²	187	135.6 Å²	135.6	96%	0.959	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	103.7	175.4	-57.7	172.7	0	0	0	108.3	V30	V30-I32 PolarHBondContact O-N 3.5Å
33	G	51.3	Low	45.2	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	138.2	-13.5	-172.6	0	0	0	0	0	114.6	P31 A35	P31-G33 PolarHBondContact O-N 2.86Å; G33-A35 PolarHBondContact O-N 2.95Å
34	A	50	Low	45.6	Very low	61 Å²	61	138.3 Å²	138.3	50%	0.504	79%	0.788	S	S	.	*			trans	-67.7	119	165.3	0	0	0	0	0	110	V30 P31 S36	V30-A34 HydrophobicContact CG1-CB 3.85Å; P31-A34 PolarHBondContact O-N 3.25Å; P31-A34 VanDerWaalsContact O-N 3.14Å; A34-S36 PolarHBondContact O-N 3.42Å
35	A	43.2	Very low	45.5	Very low	85 Å²	85	139.4 Å²	139.4	70%	0.702	79%	0.789	S	S	*	*			trans	-80.7	104.5	172.8	0	0	0	0	0	109.4	G33 D37	G33-A35 PolarHBondContact O-N 2.95Å; A35-D37 PolarHBondContact O-N 3Å
36	S	47.9	Very low	45.9	Very low	110 Å²	110	139.6 Å²	139.6	77%	0.769	79%	0.788	S	S	*	*			trans	-80.9	92.7	169.8	-61.1	0	0	0	0	109.4	A34 E38	A34-S36 PolarHBondContact O-N 3.42Å; S36-E38 PolarHBondContact O-N 3.25Å
37	D	44.2	Very low	46.3	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	78%	0.782	S	S	*	*			trans	-73.7	59.7	175.1	-79.9	-30.2	0	0	0	112.1	A35	A35-D37 PolarHBondContact O-N 3Å
38	E	46.2	Very low	47	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	77%	0.765	S	S	*	*			trans	-138.5	156.3	166.5	-73.3	-162.4	176.2	0	0	111.9	S36	S36-E38 PolarHBondContact O-N 3.25Å
39	I	48.8	Very low	47.6	Very low	162 Å²	162	130.6 Å²	130.6	83%	0.831	75%	0.75	S	S	*	*			trans	77.2	89.7	-178	-48.8	170	0	0	0	114.3	G41	I39-G41 PolarHBondContact O-N 2.9Å
40	E	35.3	Very low	48.1	Very low	208 Å²	208	127.6 Å²	127.6	97%	0.972	74%	0.739	S	S	*	*			trans	-63.8	116.8	158	-66.4	-172.8	133.7	0	0	110
41	G	44.1	Very low	48.6	Very low	43 Å²	43	128.4 Å²	128.4	44%	0.443	74%	0.736	S	S	.	*			trans	-149.7	147	173	0	0	0	0	0	110.8	I39 L43	I39-G41 PolarHBondContact O-N 2.9Å; G41-L43 PolarHBondContact O-N 2.82Å
42	P	41.4	Very low	49.8	Very low	136 Å²	136	131.5 Å²	131.5	88%	0.883	73%	0.734	S	S	*	*			trans	-66.6	106.5	-177.1	26.6	-33.7	0	0	0	110.3	K44	P42-K44 PolarHBondContact O-N 3.39Å
43	L	39.3	Very low	50.6	Low	162 Å²	162	127.3 Å²	127.3	85%	0.848	71%	0.712	S	S	*	*			trans	-61.1	102.5	-177.1	-67.5	173.9	0	0	0	111	G41 E45	G41-L43 PolarHBondContact O-N 2.82Å; L43-E45 PolarHBondContact O-N 3.19Å; L43-E45 VanDerWaalsContact O-N 3.14Å
44	K	41.3	Very low	51.7	Low	195 Å²	195	127 Å²	127	85%	0.848	70%	0.697	S	S	*	*			trans	-68.1	102.6	153.1	-89.1	-175.2	172.4	179.4	0	107.3	P42 T46	P42-K44 PolarHBondContact O-N 3.39Å; K44-T46 VanDerWaalsContact C-N 3.29Å; K44-T46 PolarHBondContact O-N 3Å
45	E	39.3	Very low	53.2	Low	186 Å²	186	131.3 Å²	131.3	87%	0.869	70%	0.701	S	S	*	*			trans	-60.6	93.8	166.1	-67.7	-177.7	121.3	0	0	109.2	L43 C47	L43-E45 PolarHBondContact O-N 3.19Å; L43-E45 VanDerWaalsContact O-N 3.14Å; E45-C47 VanDerWaalsContact C-N 3.28Å; E45-C47 PolarHBondContact O-N 3.4Å
46	T	46.3	Very low	54.9	Low	122 Å²	122	131.8 Å²	131.8	75%	0.748	69%	0.691	S	S	*	*			trans	-68.8	91.3	166.2	51.6	0	0	0	0	107.6	K44 V48	K44-T46 VanDerWaalsContact C-N 3.29Å; K44-T46 PolarHBondContact O-N 3Å; T46-V48 PolarHBondContact O-N 3.49Å
47	C	45.7	Very low	56.2	Low	107 Å²	107	132.4 Å²	132.4	72%	0.723	68%	0.682	S	S	*	*			trans	-50.7	110.9	175.2	-172.6	0	0	0	0	109.3	E45 E49	E45-C47 VanDerWaalsContact C-N 3.28Å; E45-C47 PolarHBondContact O-N 3.4Å; C47-E49 PolarHBondContact O-N 2.82Å
48	V	56.7	Low	57.9	Low	79 Å²	79	130.8 Å²	130.8	48%	0.479	67%	0.669	S	S	.	*			trans	-77.1	108.2	173.9	178.6	0	0	0	0	106.6	T46 M53	T46-V48 PolarHBondContact O-N 3.49Å; V48-M53 HydrophobicContact CB-CE 4.38Å; V48-M53 HydrophobicContact CG1-CE 4.12Å
49	E	58	Low	59.6	Low	125 Å²	125	127.3 Å²	127.3	58%	0.584	65%	0.653	S	S	*	*			trans	-42.6	122.8	-179	-75.3	-63.6	162.3	0	0	111.5	C47 E51 R52 M53	C47-E49 PolarHBondContact O-N 2.82Å; E49-E51 PolarHBondContact O-N 2.89Å; E49-E51 VanDerWaalsContact O-N 3.14Å; E49-R52 HydrophobicContact CB-CB 4.37Å; E49-R52 WeakPolarHBondContact O-CA 3.37Å; E49-R52 WeakPolarHBondContact O-CB 3.33Å; E49-R52 PolarHBondContact O-N 3.45Å; E49-M53 PolarHBondContact O-N 3.49Å
50	P	66.5	Low	61.2	Low	89 Å²	89	125.8 Å²	125.8	58%	0.578	64%	0.642	S	S	*	*	H	α-helix	trans	-63.3	-26.2	-172.2	24.2	-33.8	0	0	0	112.2	R52 M53 S54	P50-R52 VanDerWaalsContact C-N 3.35Å; P50-M53 PolarHBondContact O-N 3.01Å; P50-S54 WeakPolarHBondContact O-CB 3.31Å; P50-S54 PolarHBondContact O-N 3.14Å
51	E	72	Confident	63.3	Low	124 Å²	124	121.3 Å²	121.3	58%	0.579	62%	0.621	S	S	*	*	H	α-helix	trans	-61.5	-39.7	169.6	-69.5	-163.7	-160.7	0	0	113.1	E49 R55	E49-E51 PolarHBondContact O-N 2.89Å; E49-E51 VanDerWaalsContact O-N 3.14Å; E51-R55 VanDerWaalsContact O-CG 3.24Å; E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 3.18Å; E51-R55 IonicContact OE2-CZ 3.92Å; E51-R55 IonicContact OE2-NH2 3.95Å; E51-R55 PolarHBondContact OE2-NH2 3.49Å
52	R	78.2	Confident	65	Low	171 Å²	171	126 Å²	126	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-69.9	-38.7	179.1	-172.5	-179.3	179.5	-158	-1.5	110.7	E49 P50 L56	E49-R52 HydrophobicContact CB-CB 4.37Å; E49-R52 WeakPolarHBondContact O-CA 3.37Å; E49-R52 WeakPolarHBondContact O-CB 3.33Å; E49-R52 PolarHBondContact O-N 3.45Å; P50-R52 VanDerWaalsContact C-N 3.35Å; R52-L56 HydrophobicContact CG-CD1 4.3Å; R52-L56 WeakPolarHBondContact O-CG 3.31Å; R52-L56 PolarHBondContact O-N 2.9Å; R52-L56 VanDerWaalsContact O-N 3.1Å
53	M	68	Low	67.1	Low	99 Å²	99	125.4 Å²	125.4	49%	0.488	61%	0.614	S	S	.	*	H	α-helix	trans	-63.8	-48.7	174.9	-168.9	161	-73.8	0	0	110.9	V48 E49 P50 R55 L56 E57	V48-M53 HydrophobicContact CB-CE 4.38Å; V48-M53 HydrophobicContact CG1-CE 4.12Å; E49-M53 PolarHBondContact O-N 3.49Å; P50-M53 PolarHBondContact O-N 3.01Å; M53-R55 PolarHBondContact O-N 3.31Å; M53-L56 PolarHBondContact O-N 3.45Å; M53-L56 VanDerWaalsContact O-N 3.14Å; M53-E57 WeakPolarHBondContact O-CG 3.23Å; M53-E57 PolarHBondContact O-N 2.91Å
54	S	73.9	Confident	69	Low	69 Å²	69	120.7 Å²	120.7	48%	0.483	60%	0.595	S	S	.	*	H	α-helix	trans	-58.5	-41.8	176.9	-179.1	0	0	0	0	113.2	P50 E57 E58	P50-S54 WeakPolarHBondContact O-CB 3.31Å; P50-S54 PolarHBondContact O-N 3.14Å; S54-E57 PolarHBondContact O-N 3.24Å; S54-E58 PolarHBondContact O-N 3.46Å
55	R	80.9	Confident	70.6	Confident	151 Å²	151	112.1 Å²	112.1	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-64.2	-41.3	174.9	-69.4	173	-153	-161.8	8.8	112.2	E51 M53 E57 E58 E59	E51-R55 VanDerWaalsContact O-CG 3.24Å; E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 3.18Å; E51-R55 IonicContact OE2-CZ 3.92Å; E51-R55 IonicContact OE2-NH2 3.95Å; E51-R55 PolarHBondContact OE2-NH2 3.49Å; M53-R55 PolarHBondContact O-N 3.31Å; R55-E57 VanDerWaalsContact C-N 3.32Å; R55-E58 PolarHBondContact O-N 2.84Å; R55-E59 WeakPolarHBondContact O-CG 3.47Å; R55-E59 PolarHBondContact O-N 3.34Å
56	L	78.9	Confident	72.6	Confident	95 Å²	95	106 Å²	106	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-33.1	175.9	-71.5	168.7	0	0	0	112.2	R52 M53 H60	R52-L56 HydrophobicContact CG-CD1 4.3Å; R52-L56 WeakPolarHBondContact O-CG 3.31Å; R52-L56 PolarHBondContact O-N 2.9Å; R52-L56 VanDerWaalsContact O-N 3.1Å; M53-L56 PolarHBondContact O-N 3.45Å; M53-L56 VanDerWaalsContact O-N 3.14Å; L56-H60 VanDerWaalsContact O-CB 3.23Å; L56-H60 WeakPolarHBondContact O-CB 3.44Å; L56-H60 PolarHBondContact O-N 3.46Å
57	E	75.7	Confident	74.6	Confident	123 Å²	123	105.2 Å²	105.2	58%	0.575	53%	0.528	S	S	*	.	H	α-helix	trans	-66.2	-44.4	171.5	-71	178.3	155.9	0	0	111.7	M53 S54 R55 H60 E61	M53-E57 WeakPolarHBondContact O-CG 3.23Å; M53-E57 PolarHBondContact O-N 2.91Å; S54-E57 PolarHBondContact O-N 3.24Å; R55-E57 VanDerWaalsContact C-N 3.32Å; E57-H60 PolarHBondContact O-N 2.92Å; E57-E61 PolarHBondContact O-N 3.36Å
58	E	80	Confident	76.2	Confident	127 Å²	127	105.8 Å²	105.8	59%	0.593	52%	0.523	S	S	*	.	H	α-helix	trans	-63.4	-42.7	175.4	-173	178.6	-173.2	0	0	112.1	S54 R55 H60 E61 R62	S54-E58 PolarHBondContact O-N 3.46Å; R55-E58 PolarHBondContact O-N 2.84Å; E58-H60 VanDerWaalsContact C-N 3.34Å; E58-H60 PolarHBondContact O-N 2.72Å; E58-E61 PolarHBondContact O-N 2.91Å; E58-R62 WeakPolarHBondContact O-CB 3.47Å; E58-R62 PolarHBondContact O-N 3.32Å
59	E	80.7	Confident	77.3	Confident	101 Å²	101	102.7 Å²	102.7	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-66.9	-34.7	175.6	-68.3	-158.5	122.4	0	0	112.7	R55 R62 L63	R55-E59 WeakPolarHBondContact O-CG 3.47Å; R55-E59 PolarHBondContact O-N 3.34Å; E59-R62 IonicContact OE1-CZ 2.79Å; E59-R62 IonicContact OE1-NH2 3.92Å; E59-R62 PolarHBondContact OE1-NH2 2.88Å; E59-L63 WeakPolarHBondContact O-CB 3.33Å; E59-L63 PolarHBondContact O-N 2.92Å
60	H	84.1	Confident	78.5	Confident	129 Å²	129	102 Å²	102	60%	0.597	51%	0.505	S	S	*	.	H	α-helix	trans	-70	-43	174.2	-176.3	75.5	0	0	0	112.1	L56 E57 E58 R62 L63 S64	L56-H60 VanDerWaalsContact O-CB 3.23Å; L56-H60 WeakPolarHBondContact O-CB 3.44Å; L56-H60 PolarHBondContact O-N 3.46Å; E57-H60 PolarHBondContact O-N 2.92Å; E58-H60 VanDerWaalsContact C-N 3.34Å; E58-H60 PolarHBondContact O-N 2.72Å; H60-R62 VanDerWaalsContact C-N 3.34Å; H60-R62 PolarHBondContact O-N 3.27Å; H60-L63 PolarHBondContact O-N 2.95Å; H60-S64 WeakPolarHBondContact O-CB 3.49Å; H60-S64 PolarHBondContact O-N 3.33Å
61	E	79.3	Confident	79.4	Confident	115 Å²	115	100.8 Å²	100.8	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-45.2	172.9	-77.8	-155.3	172.7	0	0	111	E57 E58 S64 S65	E57-E61 PolarHBondContact O-N 3.36Å; E58-E61 PolarHBondContact O-N 2.91Å; E61-S64 PolarHBondContact O-N 2.91Å; E61-S65 WeakPolarHBondContact O-CB 3.27Å; E61-S65 PolarHBondContact O-N 3.38Å; E61-S65 PolarHBondContact O-OG 2.99Å
62	R	78	Confident	79.8	Confident	142 Å²	142	97.9 Å²	97.9	54%	0.536	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-48.3	176.4	-177.6	-175.7	64.4	-167.1	-8.6	112.3	E58 E59 H60 S64 S65 S66	E58-R62 WeakPolarHBondContact O-CB 3.47Å; E58-R62 PolarHBondContact O-N 3.32Å; E59-R62 IonicContact OE1-CZ 2.79Å; E59-R62 IonicContact OE1-NH2 3.92Å; E59-R62 PolarHBondContact OE1-NH2 2.88Å; H60-R62 VanDerWaalsContact C-N 3.34Å; H60-R62 PolarHBondContact O-N 3.27Å; R62-S64 VanDerWaalsContact C-N 3.31Å; R62-S64 PolarHBondContact O-N 2.86Å; R62-S65 PolarHBondContact O-N 3.28Å; R62-S65 PolarHBondContact O-OG 3.17Å; R62-S66 PolarHBondContact O-N 3.13Å; R62-S66 PolarHBondContact O-OG 3.01Å; R62-S66 VanDerWaalsContact O-OG 3.06Å
63	L	85.6	Confident	79.9	Confident	122 Å²	122	91.1 Å²	91.1	64%	0.639	47%	0.467	S	S	*	.	H	α-helix	trans	-65.8	-37.3	179.8	-174.9	63.4	0	0	0	111.5	E59 H60 L67	E59-L63 WeakPolarHBondContact O-CB 3.33Å; E59-L63 PolarHBondContact O-N 2.92Å; H60-L63 PolarHBondContact O-N 2.95Å; L63-L67 VanDerWaalsContact O-CB 3.29Å; L63-L67 WeakPolarHBondContact O-CB 3.33Å; L63-L67 PolarHBondContact O-N 3.24Å
64	S	79.6	Confident	80.7	Confident	64 Å²	64	92 Å²	92	45%	0.448	47%	0.469	S	S	.	.	H	α-helix	trans	-67.7	-40.3	176.5	-169.9	0	0	0	0	112.1	H60 E61 R62 L67 L68	H60-S64 WeakPolarHBondContact O-CB 3.49Å; H60-S64 PolarHBondContact O-N 3.33Å; E61-S64 PolarHBondContact O-N 2.91Å; R62-S64 VanDerWaalsContact C-N 3.31Å; R62-S64 PolarHBondContact O-N 2.86Å; S64-L67 PolarHBondContact O-N 3.39Å; S64-L68 WeakPolarHBondContact O-CB 3.32Å; S64-L68 PolarHBondContact O-N 3.18Å
65	S	75.9	Confident	81.2	Confident	15 Å²	15	91.2 Å²	91.2	11%	0.105	47%	0.466	C	S	.	.	H	α-helix	trans	-67.2	-43.4	174.6	68.6	0	0	0	0	112	E61 R62 L67 L68 A69	E61-S65 WeakPolarHBondContact O-CB 3.27Å; E61-S65 PolarHBondContact O-N 3.38Å; E61-S65 PolarHBondContact O-OG 2.99Å; R62-S65 PolarHBondContact O-N 3.28Å; R62-S65 PolarHBondContact O-OG 3.17Å; S65-L67 PolarHBondContact O-N 2.96Å; S65-L68 PolarHBondContact O-N 3.32Å; S65-A69 VanDerWaalsContact O-CB 3.32Å; S65-A69 WeakPolarHBondContact O-CB 3.41Å; S65-A69 PolarHBondContact O-N 3.07Å
66	S	81.2	Confident	81.3	Confident	56 Å²	56	88.4 Å²	88.4	39%	0.392	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-43	174.3	-58.1	0	0	0	0	112.2	R62 A69 L70	R62-S66 PolarHBondContact O-N 3.13Å; R62-S66 PolarHBondContact O-OG 3.01Å; R62-S66 VanDerWaalsContact O-OG 3.06Å; S66-A69 PolarHBondContact O-N 2.92Å; S66-L70 WeakPolarHBondContact O-CB 3.35Å; S66-L70 PolarHBondContact O-N 3.26Å
67	L	87	Confident	81.6	Confident	107 Å²	107	85.5 Å²	85.5	56%	0.56	45%	0.445	S	S	*	.	H	α-helix	trans	-63.9	-42.2	176.7	179.6	62.9	0	0	0	111.9	L63 S64 S65 S71	L63-L67 VanDerWaalsContact O-CB 3.29Å; L63-L67 WeakPolarHBondContact O-CB 3.33Å; L63-L67 PolarHBondContact O-N 3.24Å; S64-L67 PolarHBondContact O-N 3.39Å; S65-L67 PolarHBondContact O-N 2.96Å; L67-S71 VanDerWaalsContact O-CB 3.25Å; L67-S71 WeakPolarHBondContact O-CB 3.42Å; L67-S71 PolarHBondContact O-N 3.49Å; L67-S71 PolarHBondContact O-OG 3.45Å
68	L	79.5	Confident	82	Confident	119 Å²	119	84.6 Å²	84.6	62%	0.623	44%	0.441	S	S	*	.	H	α-helix	trans	-65.6	-42.5	176.6	-177.8	65.3	0	0	0	111.7	S64 S65 S71 C72	S64-L68 WeakPolarHBondContact O-CB 3.32Å; S64-L68 PolarHBondContact O-N 3.18Å; S65-L68 PolarHBondContact O-N 3.32Å; L68-S71 PolarHBondContact O-N 3.22Å; L68-C72 VanDerWaalsContact O-CB 3.31Å; L68-C72 WeakPolarHBondContact O-CB 3.25Å; L68-C72 PolarHBondContact O-N 2.89Å
69	A	79.6	Confident	82.1	Confident	14 Å²	14	84.5 Å²	84.5	12%	0.116	44%	0.439	C	S	.	.	H	α-helix	trans	-63.5	-49.5	178.5	0	0	0	0	0	111.1	S65 S66 S71 C72 H73 C107	S65-A69 VanDerWaalsContact O-CB 3.32Å; S65-A69 WeakPolarHBondContact O-CB 3.41Å; S65-A69 PolarHBondContact O-N 3.07Å; S66-A69 PolarHBondContact O-N 2.92Å; A69-S71 VanDerWaalsContact C-N 3.34Å; A69-S71 PolarHBondContact O-N 3Å; A69-C72 WeakPolarHBondContact O-CB 3.4Å; A69-C72 PolarHBondContact O-N 3.18Å; A69-H73 PolarHBondContact O-N 3.09Å; A69-C107 VanDerWaalsContact C-SG 3.53Å; A69-C107 PolarHBondContact O-SG 2.82Å
70	L	83.9	Confident	82.1	Confident	111 Å²	111	83.9 Å²	83.9	58%	0.581	43%	0.432	S	S	*	.	H	α-helix	trans	-59.2	-42.6	175	-179.7	62.9	0	0	0	112.2	S66 C72 H73 F74	S66-L70 WeakPolarHBondContact O-CB 3.35Å; S66-L70 PolarHBondContact O-N 3.26Å; L70-C72 VanDerWaalsContact C-N 3.34Å; L70-C72 PolarHBondContact O-N 3.2Å; L70-H73 PolarHBondContact O-N 3.17Å; L70-F74 WeakPolarHBondContact O-CB 3.46Å; L70-F74 PolarHBondContact O-N 3.03Å
71	S	84.8	Confident	82.1	Confident	62 Å²	62	82.5 Å²	82.5	43%	0.434	43%	0.429	S	S	.	.	H	α-helix	trans	-65.4	-37.2	177.5	-59.6	0	0	0	0	112.2	L67 L68 A69 A75	L67-S71 VanDerWaalsContact O-CB 3.25Å; L67-S71 WeakPolarHBondContact O-CB 3.42Å; L67-S71 PolarHBondContact O-N 3.49Å; L67-S71 PolarHBondContact O-OG 3.45Å; L68-S71 PolarHBondContact O-N 3.22Å; A69-S71 VanDerWaalsContact C-N 3.34Å; A69-S71 PolarHBondContact O-N 3Å; S71-A75 WeakPolarHBondContact O-CB 3.29Å; S71-A75 PolarHBondContact O-N 3.47Å
72	C	80.1	Confident	82.3	Confident	64 Å²	64	82.2 Å²	82.2	43%	0.432	43%	0.428	S	S	.	.	H	α-helix	trans	-67.3	-48.3	175.8	-168.2	0	0	0	0	111.2	L68 A69 L70 F74 A75 Q76	L68-C72 VanDerWaalsContact O-CB 3.31Å; L68-C72 WeakPolarHBondContact O-CB 3.25Å; L68-C72 PolarHBondContact O-N 2.89Å; A69-C72 WeakPolarHBondContact O-CB 3.4Å; A69-C72 PolarHBondContact O-N 3.18Å; L70-C72 VanDerWaalsContact C-N 3.34Å; L70-C72 PolarHBondContact O-N 3.2Å; C72-F74 PolarHBondContact O-N 3.4Å; C72-A75 PolarHBondContact O-N 2.73Å; C72-Q76 VanDerWaalsContact O-CG 3.31Å; C72-Q76 WeakPolarHBondContact O-CG 3.37Å; C72-Q76 PolarHBondContact O-N 3.28Å
73	H	81.2	Confident	82.6	Confident	29 Å²	29	79.4 Å²	79.4	13%	0.134	42%	0.421	C	S	.	.	H	α-helix	trans	-59.5	-44.8	176.4	-179	93	0	0	0	111.5	A69 L70 A75 Q76 V77 F102	A69-H73 PolarHBondContact O-N 3.09Å; L70-H73 PolarHBondContact O-N 3.17Å; H73-A75 PolarHBondContact O-N 2.77Å; H73-Q76 WeakPolarHBondContact O-CB 3.33Å; H73-Q76 PolarHBondContact O-N 3.07Å; H73-V77 WeakPolarHBondContact O-CG2 3.45Å; H73-V77 PolarHBondContact O-N 2.97Å; H73-F102 AromaticContact CE1-CE1 3.85Å; H73-F102 PolarHBondContact CE1-O 2.99Å; H73-F102 VanDerWaalsContact CE1-O 3.29Å; H73-F102 AromaticContact ND1-CE1 3.84Å; H73-F102 AromaticContact ND1-CZ 3.91Å
74	F	85.7	Confident	82.5	Confident	118 Å²	118	74.3 Å²	74.3	52%	0.518	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-42.2	174.7	-178.1	-106.8	0	0	0	112.6	L70 C72 Q76 V77 Q78	L70-F74 WeakPolarHBondContact O-CB 3.46Å; L70-F74 PolarHBondContact O-N 3.03Å; C72-F74 PolarHBondContact O-N 3.4Å; F74-Q76 VanDerWaalsContact C-N 3.34Å; F74-Q76 PolarHBondContact O-N 3.44Å; F74-V77 PolarHBondContact O-N 3.32Å; F74-Q78 HydrophobicContact CD1-CG 4.42Å; F74-Q78 VanDerWaalsContact CE1-CD 3.48Å; F74-Q78 HydrophobicContact CE1-CG 4.11Å; F74-Q78 HydrophobicContact CE2-CG 4.49Å; F74-Q78 HydrophobicContact CZ-CG 4.15Å; F74-Q78 VanDerWaalsContact CZ-NE2 3.29Å; F74-Q78 WeakPolarHBondContact O-CB 3.48Å; F74-Q78 WeakPolarHBondContact O-CG 3.39Å; F74-Q78 PolarHBondContact O-N 3.37Å
75	A	84.3	Confident	82.6	Confident	51 Å²	51	78.9 Å²	78.9	42%	0.421	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-35.8	175.1	0	0	0	0	0	112.6	S71 C72 H73 F79	S71-A75 WeakPolarHBondContact O-CB 3.29Å; S71-A75 PolarHBondContact O-N 3.47Å; C72-A75 PolarHBondContact O-N 2.73Å; H73-A75 PolarHBondContact O-N 2.77Å; A75-F79 WeakPolarHBondContact O-CB 3.44Å; A75-F79 PolarHBondContact O-N 3.45Å
76	Q	81.7	Confident	82.8	Confident	92 Å²	92	84.4 Å²	84.4	43%	0.43	43%	0.427	S	S	.	.	H	α-helix	trans	-67.8	-43.6	174.6	-72.2	167.5	-30.9	0	0	111.6	C72 H73 F74 F79 R80 F102	C72-Q76 VanDerWaalsContact O-CG 3.31Å; C72-Q76 WeakPolarHBondContact O-CG 3.37Å; C72-Q76 PolarHBondContact O-N 3.28Å; H73-Q76 WeakPolarHBondContact O-CB 3.33Å; H73-Q76 PolarHBondContact O-N 3.07Å; F74-Q76 VanDerWaalsContact C-N 3.34Å; F74-Q76 PolarHBondContact O-N 3.44Å; Q76-F79 PolarHBondContact O-N 2.87Å; Q76-R80 WeakPolarHBondContact O-CB 3.49Å; Q76-R80 WeakPolarHBondContact O-CG 3.41Å; Q76-R80 PolarHBondContact O-N 3.38Å; Q76-F102 HydrophobicContact CB-CE1 3.79Å; Q76-F102 HydrophobicContact CB-CZ 3.85Å
77	V	86.2	Confident	82.5	Confident	34 Å²	34	82.4 Å²	82.4	21%	0.206	41%	0.413	C	S	.	.	H	α-helix	trans	-59.1	-47.4	171.7	165.5	0	0	0	0	111	H73 F74 F79 R80 L81 L99 F102	H73-V77 WeakPolarHBondContact O-CG2 3.45Å; H73-V77 PolarHBondContact O-N 2.97Å; F74-V77 PolarHBondContact O-N 3.32Å; V77-F79 PolarHBondContact O-N 2.84Å; V77-R80 PolarHBondContact O-N 2.82Å; V77-L81 VanDerWaalsContact O-CB 3.31Å; V77-L81 WeakPolarHBondContact O-CB 3.38Å; V77-L81 PolarHBondContact O-N 3.42Å; V77-L99 HydrophobicContact CB-CD1 4.4Å; V77-L99 HydrophobicContact CG1-CD1 4.23Å; V77-L99 HydrophobicContact CG2-CD1 4.25Å; V77-F102 HydrophobicContact CG2-CD1 3.98Å; V77-F102 HydrophobicContact CG2-CE1 3.97Å
78	Q	83.6	Confident	82.1	Confident	105 Å²	105	80.7 Å²	80.7	49%	0.491	41%	0.409	S	S	.	.	H	α-helix	trans	-60.9	-41.5	176.2	-76.8	-168.9	-27.7	0	0	112.6	F74 L81 Q82	F74-Q78 HydrophobicContact CD1-CG 4.42Å; F74-Q78 VanDerWaalsContact CE1-CD 3.48Å; F74-Q78 HydrophobicContact CE1-CG 4.11Å; F74-Q78 HydrophobicContact CE2-CG 4.49Å; F74-Q78 HydrophobicContact CZ-CG 4.15Å; F74-Q78 VanDerWaalsContact CZ-NE2 3.29Å; F74-Q78 WeakPolarHBondContact O-CB 3.48Å; F74-Q78 WeakPolarHBondContact O-CG 3.39Å; F74-Q78 PolarHBondContact O-N 3.37Å; Q78-L81 PolarHBondContact O-N 3.32Å; Q78-Q82 WeakPolarHBondContact O-CB 3.37Å; Q78-Q82 PolarHBondContact O-N 2.58Å
79	F	83	Confident	81.7	Confident	124 Å²	124	82 Å²	82	54%	0.544	41%	0.413	S	S	.	.	H	α-helix	trans	-65.6	-47.3	177.9	-177.1	-99.3	0	0	0	111.8	A75 Q76 V77 L81 Q82 Q83	A75-F79 WeakPolarHBondContact O-CB 3.44Å; A75-F79 PolarHBondContact O-N 3.45Å; Q76-F79 PolarHBondContact O-N 2.87Å; V77-F79 PolarHBondContact O-N 2.84Å; F79-L81 PolarHBondContact O-N 2.79Å; F79-Q82 CarbonylContact O-C 3.58Å; F79-Q82 WeakPolarHBondContact O-CB 3.01Å; F79-Q82 PolarHBondContact O-N 2.85Å; F79-Q82 VanDerWaalsContact O-N 3.14Å; F79-Q83 HydrophobicContact CD1-CG 4.31Å; F79-Q83 VanDerWaalsContact CD1-OE1 3.31Å; F79-Q83 HydrophobicContact CE1-CG 3.99Å; F79-Q83 VanDerWaalsContact CE1-OE1 3.24Å; F79-Q83 HydrophobicContact CZ-CG 4.33Å; F79-Q83 WeakPolarHBondContact O-CG 3.27Å; F79-Q83 PolarHBondContact O-N 3.5Å
80	R	80.3	Confident	81.5	Confident	88 Å²	88	89.8 Å²	89.8	33%	0.332	45%	0.448	S	S	.	.	H	α-helix	trans	-59.9	-43.2	174.8	-78.7	-76.9	-169.2	156.9	2.4	111.9	Q76 V77 Q82 Q83 I84 E98 L99	Q76-R80 WeakPolarHBondContact O-CB 3.49Å; Q76-R80 WeakPolarHBondContact O-CG 3.41Å; Q76-R80 PolarHBondContact O-N 3.38Å; V77-R80 PolarHBondContact O-N 2.82Å; R80-Q82 VanDerWaalsContact C-N 3.3Å; R80-Q82 PolarHBondContact O-N 3.44Å; R80-Q83 WeakPolarHBondContact O-CB 3.4Å; R80-Q83 PolarHBondContact O-N 3.02Å; R80-Q83 VanDerWaalsContact O-N 3.09Å; R80-I84 WeakPolarHBondContact O-CG1 3.46Å; R80-I84 PolarHBondContact O-N 3.31Å; R80-E98 IonicContact CZ-OE2 3.21Å; R80-E98 IonicContact NH1-OE2 3.68Å; R80-E98 PolarHBondContact NH1-OE2 2.89Å; R80-E98 IonicContact NH2-OE2 3.06Å; R80-L99 HydrophobicContact CB-CD1 3.78Å
81	L	84.6	Confident	81.2	Confident	101 Å²	101	87 Å²	87	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-39.3	174.1	-167.1	76.8	0	0	0	112	V77 Q78 F79 I84 R85 L99	V77-L81 VanDerWaalsContact O-CB 3.31Å; V77-L81 WeakPolarHBondContact O-CB 3.38Å; V77-L81 PolarHBondContact O-N 3.42Å; Q78-L81 PolarHBondContact O-N 3.32Å; F79-L81 PolarHBondContact O-N 2.79Å; L81-I84 PolarHBondContact O-N 2.89Å; L81-R85 PolarHBondContact O-N 3.29Å; L81-R85 VanDerWaalsContact O-N 3.14Å; L81-L99 HydrophobicContact CB-CD2 4.18Å; L81-L99 HydrophobicContact CD1-CD2 3.84Å
82	Q	83.2	Confident	81.1	Confident	109 Å²	109	88.1 Å²	88.1	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-68.8	-33.4	174	-178.3	164.3	-49.7	0	0	112.6	Q78 F79 R80 M86	Q78-Q82 WeakPolarHBondContact O-CB 3.37Å; Q78-Q82 PolarHBondContact O-N 2.58Å; F79-Q82 CarbonylContact O-C 3.58Å; F79-Q82 WeakPolarHBondContact O-CB 3.01Å; F79-Q82 PolarHBondContact O-N 2.85Å; F79-Q82 VanDerWaalsContact O-N 3.14Å; R80-Q82 VanDerWaalsContact C-N 3.3Å; R80-Q82 PolarHBondContact O-N 3.44Å; Q82-M86 WeakPolarHBondContact O-CG 3.37Å; Q82-M86 PolarHBondContact O-N 3.36Å
83	Q	83.4	Confident	81.1	Confident	83 Å²	83	92.3 Å²	92.3	39%	0.388	44%	0.441	S	S	.	.	H	α-helix	trans	-64.5	-47.3	171.9	-68.9	176	-77.2	0	0	111.4	F79 R80 R85 M86 A87	F79-Q83 HydrophobicContact CD1-CG 4.31Å; F79-Q83 VanDerWaalsContact CD1-OE1 3.31Å; F79-Q83 HydrophobicContact CE1-CG 3.99Å; F79-Q83 VanDerWaalsContact CE1-OE1 3.24Å; F79-Q83 HydrophobicContact CZ-CG 4.33Å; F79-Q83 WeakPolarHBondContact O-CG 3.27Å; F79-Q83 PolarHBondContact O-N 3.5Å; R80-Q83 WeakPolarHBondContact O-CB 3.4Å; R80-Q83 PolarHBondContact O-N 3.02Å; R80-Q83 VanDerWaalsContact O-N 3.09Å; Q83-R85 VanDerWaalsContact C-N 3.27Å; Q83-R85 PolarHBondContact O-N 3.38Å; Q83-M86 CarbonylContact O-C 3.58Å; Q83-M86 PolarHBondContact O-N 3.33Å; Q83-A87 PolarHBondContact O-N 3.46Å
84	I	83.9	Confident	81.2	Confident	14 Å²	14	96.7 Å²	96.7	7%	0.072	46%	0.456	C	S	.	.	H	α-helix	trans	-54.6	-43.1	176	-67.6	162	0	0	0	111.3	R80 L81 M86 A87 R92 L95 L96 L99	R80-I84 WeakPolarHBondContact O-CG1 3.46Å; R80-I84 PolarHBondContact O-N 3.31Å; L81-I84 PolarHBondContact O-N 2.89Å; I84-M86 PolarHBondContact O-N 3.24Å; I84-A87 PolarHBondContact O-N 2.85Å; I84-R92 HydrophobicContact CG2-CG 4.29Å; I84-R92 PolarHBondContact O-NE 3.24Å; I84-L95 HydrophobicContact CD1-CB 4.4Å; I84-L95 WeakPolarHBondContact CD1-O 3.37Å; I84-L95 HydrophobicContact CG1-CB 3.62Å; I84-L96 HydrophobicContact CD1-CD2 3.94Å; I84-L96 HydrophobicContact CD1-CG 4.14Å; I84-L96 HydrophobicContact CG2-CD1 4.47Å; I84-L96 HydrophobicContact CG2-CD2 4.22Å; I84-L96 HydrophobicContact CG2-CG 4Å; I84-L99 HydrophobicContact CD1-CB 3.88Å; I84-L99 HydrophobicContact CD1-CD2 3.47Å; I84-L99 VanDerWaalsContact CD1-CD2 3.47Å; I84-L99 HydrophobicContact CD1-CG 4.32Å
85	R	81.8	Confident	81	Confident	160 Å²	160	92.3 Å²	92.3	60%	0.604	44%	0.438	S	S	*	.	H	α-helix	trans	-61.7	-30.4	177.3	-169.9	-179.8	66.9	178.8	-4	113.2	L81 Q83	L81-R85 PolarHBondContact O-N 3.29Å; L81-R85 VanDerWaalsContact O-N 3.14Å; Q83-R85 VanDerWaalsContact C-N 3.27Å; Q83-R85 PolarHBondContact O-N 3.38Å
86	M	79	Confident	81	Confident	132 Å²	132	93.7 Å²	93.7	65%	0.65	44%	0.438	S	S	*	.	H	α-helix	trans	-93.4	-18.7	-180	-59.6	-56.4	-177.6	0	0	113.6	Q82 Q83 I84	Q82-M86 WeakPolarHBondContact O-CG 3.37Å; Q82-M86 PolarHBondContact O-N 3.36Å; Q83-M86 CarbonylContact O-C 3.58Å; Q83-M86 PolarHBondContact O-N 3.33Å; I84-M86 PolarHBondContact O-N 3.24Å
87	A	76.3	Confident	81.1	Confident	13 Å²	13	95.9 Å²	95.9	11%	0.107	45%	0.448	C	S	.	.	S	Bend	trans	-64.7	151.8	179.4	0	0	0	0	0	112.3	Q83 I84 D91 R92 L95	Q83-A87 PolarHBondContact O-N 3.46Å; I84-A87 PolarHBondContact O-N 2.85Å; A87-D91 HydrophobicContact CB-CB 4.37Å; A87-R92 HydrophobicContact CB-CG 4.23Å; A87-R92 VanDerWaalsContact O-CZ 3.25Å; A87-R92 PolarHBondContact O-NE 2.77Å; A87-R92 PolarHBondContact O-NH2 2.75Å; A87-L95 HydrophobicContact CB-CD1 3.56Å
88	P	77.8	Confident	80.9	Confident	71 Å²	71	97.4 Å²	97.4	46%	0.461	45%	0.453	S	S	.	.			trans	-63.9	159	168.8	30.7	-36.1	0	0	0	110.8	E90 D91 R92	P88-E90 PolarHBondContact O-N 3.41Å; P88-E90 VanDerWaalsContact O-N 3.17Å; P88-D91 HydrophobicContact CG-CB 4.33Å; P88-D91 WeakPolarHBondContact CG-OD2 3.34Å; P88-D91 PolarHBondContact O-N 3.18Å; P88-R92 WeakPolarHBondContact O-CG 3.4Å; P88-R92 PolarHBondContact O-N 3.35Å
89	M	71.2	Confident	80.9	Confident	146 Å²	146	93 Å²	93	72%	0.719	43%	0.433	S	S	*	.	H	α-helix	trans	-55.3	-38	-173.3	-62.9	-82.6	-99.1	0	0	112.7	D91 R92	M89-D91 PolarHBondContact O-N 2.9Å; M89-R92 PolarHBondContact O-N 3.21Å; M89-R92 PolarHBondContact SD-NH1 3.2Å
90	E	75.9	Confident	80.8	Confident	179 Å²	179	90.6 Å²	90.6	84%	0.836	43%	0.428	S	S	*	.	H	α-helix	trans	-64.8	-34	-177.2	-68.4	143.8	-129.8	0	0	114	P88	P88-E90 PolarHBondContact O-N 3.41Å; P88-E90 VanDerWaalsContact O-N 3.17Å
91	D	77.9	Confident	80.9	Confident	52 Å²	52	92.4 Å²	92.4	28%	0.278	44%	0.441	S	S	.	.	H	α-helix	trans	-86.3	-15.1	178.7	-76.7	-62.9	0	0	0	113.2	A87 P88 M89 E93 R94 L95	A87-D91 HydrophobicContact CB-CB 4.37Å; P88-D91 HydrophobicContact CG-CB 4.33Å; P88-D91 WeakPolarHBondContact CG-OD2 3.34Å; P88-D91 PolarHBondContact O-N 3.18Å; M89-D91 PolarHBondContact O-N 2.9Å; D91-E93 PolarHBondContact O-N 3.1Å; D91-R94 PolarHBondContact O-N 2.89Å; D91-R94 IonicContact OD1-CZ 3.2Å; D91-R94 IonicContact OD1-NH1 2.73Å; D91-R94 PolarHBondContact OD1-NH1 3.12Å; D91-R94 IonicContact OD1-NH2 2.69Å; D91-R94 PolarHBondContact OD1-NH2 3.47Å; D91-L95 HydrophobicContact CB-CD1 3.95Å; D91-L95 HydrophobicContact CB-CG 4.49Å; D91-L95 WeakPolarHBondContact O-CB 3.25Å; D91-L95 VanDerWaalsContact O-CG 3.27Å; D91-L95 WeakPolarHBondContact O-CG 3.39Å; D91-L95 PolarHBondContact O-N 2.95Å
92	R	81.7	Confident	80.6	Confident	85 Å²	85	90.1 Å²	90.1	32%	0.321	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-38.3	-169.6	-78.2	177.1	-170	170.5	3.3	113.7	I84 A87 P88 M89 L96	I84-R92 HydrophobicContact CG2-CG 4.29Å; I84-R92 PolarHBondContact O-NE 3.24Å; A87-R92 HydrophobicContact CB-CG 4.23Å; A87-R92 VanDerWaalsContact O-CZ 3.25Å; A87-R92 PolarHBondContact O-NE 2.77Å; A87-R92 PolarHBondContact O-NH2 2.75Å; P88-R92 WeakPolarHBondContact O-CG 3.4Å; P88-R92 PolarHBondContact O-N 3.35Å; M89-R92 PolarHBondContact O-N 3.21Å; M89-R92 PolarHBondContact SD-NH1 3.2Å; R92-L96 VanDerWaalsContact O-CB 3.3Å; R92-L96 WeakPolarHBondContact O-CB 3.42Å; R92-L96 WeakPolarHBondContact O-CD1 3.44Å; R92-L96 VanDerWaalsContact O-CG 3.23Å; R92-L96 WeakPolarHBondContact O-CG 3.32Å; R92-L96 PolarHBondContact O-N 2.85Å
93	E	79.8	Confident	80.2	Confident	153 Å²	153	87.5 Å²	87.5	72%	0.715	42%	0.421	S	S	*	.	H	α-helix	trans	-68.1	-48	-179.2	-64.9	-173.8	153.9	0	0	110.4	D91 L95 L96 E97	D91-E93 PolarHBondContact O-N 3.1Å; E93-L95 PolarHBondContact O-N 3.28Å; E93-L96 WeakPolarHBondContact O-CB 3.4Å; E93-L96 PolarHBondContact O-N 2.84Å; E93-L96 VanDerWaalsContact O-N 3.1Å; E93-E97 WeakPolarHBondContact O-CG 3.26Å; E93-E97 PolarHBondContact O-N 3.38Å
94	R	83.9	Confident	79.6	Confident	120 Å²	120	91.8 Å²	91.8	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-58.1	-45.4	173.2	-169.4	-171.1	69.5	-110.7	-3.6	112.2	D91 L96 E97 E98	D91-R94 PolarHBondContact O-N 2.89Å; D91-R94 IonicContact OD1-CZ 3.2Å; D91-R94 IonicContact OD1-NH1 2.73Å; D91-R94 PolarHBondContact OD1-NH1 3.12Å; D91-R94 IonicContact OD1-NH2 2.69Å; D91-R94 PolarHBondContact OD1-NH2 3.47Å; R94-L96 VanDerWaalsContact C-N 3.28Å; R94-L96 PolarHBondContact O-N 2.9Å; R94-E97 PolarHBondContact O-N 3.39Å; R94-E98 IonicContact NE-OE1 2.85Å; R94-E98 PolarHBondContact NE-OE1 2.84Å; R94-E98 WeakPolarHBondContact O-CG 3.15Å; R94-E98 PolarHBondContact O-N 2.85Å
95	L	81.8	Confident	79	Confident	27 Å²	27	95.6 Å²	95.6	14%	0.141	46%	0.456	C	S	.	.	H	α-helix	trans	-68.3	-26.1	178.9	-68.7	168	0	0	0	112.9	I84 A87 D91 E93 L99	I84-L95 HydrophobicContact CD1-CB 4.4Å; I84-L95 WeakPolarHBondContact CD1-O 3.37Å; I84-L95 HydrophobicContact CG1-CB 3.62Å; A87-L95 HydrophobicContact CB-CD1 3.56Å; D91-L95 HydrophobicContact CB-CD1 3.95Å; D91-L95 HydrophobicContact CB-CG 4.49Å; D91-L95 WeakPolarHBondContact O-CB 3.25Å; D91-L95 VanDerWaalsContact O-CG 3.27Å; D91-L95 WeakPolarHBondContact O-CG 3.39Å; D91-L95 PolarHBondContact O-N 2.95Å; E93-L95 PolarHBondContact O-N 3.28Å; L95-L99 WeakPolarHBondContact O-CB 3.4Å; L95-L99 PolarHBondContact O-N 3.04Å
96	L	84	Confident	78.1	Confident	79 Å²	79	96.9 Å²	96.9	41%	0.414	47%	0.468	S	S	.	.	H	α-helix	trans	-74.7	-37	170.9	-80.6	163.8	0	0	0	111.8	I84 R92 E93 R94 L99 T100	I84-L96 HydrophobicContact CD1-CD2 3.94Å; I84-L96 HydrophobicContact CD1-CG 4.14Å; I84-L96 HydrophobicContact CG2-CD1 4.47Å; I84-L96 HydrophobicContact CG2-CD2 4.22Å; I84-L96 HydrophobicContact CG2-CG 4Å; R92-L96 VanDerWaalsContact O-CB 3.3Å; R92-L96 WeakPolarHBondContact O-CB 3.42Å; R92-L96 WeakPolarHBondContact O-CD1 3.44Å; R92-L96 VanDerWaalsContact O-CG 3.23Å; R92-L96 WeakPolarHBondContact O-CG 3.32Å; R92-L96 PolarHBondContact O-N 2.85Å; E93-L96 WeakPolarHBondContact O-CB 3.4Å; E93-L96 PolarHBondContact O-N 2.84Å; E93-L96 VanDerWaalsContact O-N 3.1Å; R94-L96 VanDerWaalsContact C-N 3.28Å; R94-L96 PolarHBondContact O-N 2.9Å; L96-L99 PolarHBondContact O-N 2.91Å; L96-T100 VanDerWaalsContact O-CB 3.32Å; L96-T100 WeakPolarHBondContact O-CB 3.47Å; L96-T100 PolarHBondContact O-N 3.2Å; L96-T100 PolarHBondContact O-OG1 3.1Å
97	E	84	Confident	77.2	Confident	138 Å²	138	93.1 Å²	93.1	65%	0.645	46%	0.455	S	S	*	.	H	α-helix	trans	-64	-48.6	170.8	-69.5	178.1	155.9	0	0	110.8	E93 R94 L99 T100 E101	E93-E97 WeakPolarHBondContact O-CG 3.26Å; E93-E97 PolarHBondContact O-N 3.38Å; R94-E97 PolarHBondContact O-N 3.39Å; E97-L99 VanDerWaalsContact C-N 3.3Å; E97-L99 PolarHBondContact O-N 3.3Å; E97-T100 WeakPolarHBondContact O-CB 3.43Å; E97-T100 PolarHBondContact O-N 3.47Å; E97-T100 VanDerWaalsContact O-N 3.09Å; E97-E101 PolarHBondContact O-N 2.91Å
98	E	82.2	Confident	76.3	Confident	66 Å²	66	97.4 Å²	97.4	31%	0.308	48%	0.482	S	S	.	.	H	α-helix	trans	-54.7	-42.9	172.8	-73.2	175.9	-131.3	0	0	112	R80 R94 F102	R80-E98 IonicContact CZ-OE2 3.21Å; R80-E98 IonicContact NH1-OE2 3.68Å; R80-E98 PolarHBondContact NH1-OE2 2.89Å; R80-E98 IonicContact NH2-OE2 3.06Å; R94-E98 IonicContact NE-OE1 2.85Å; R94-E98 PolarHBondContact NE-OE1 2.84Å; R94-E98 WeakPolarHBondContact O-CG 3.15Å; R94-E98 PolarHBondContact O-N 2.85Å; E98-F102 VanDerWaalsContact O-CB 3.23Å; E98-F102 WeakPolarHBondContact O-CB 3.47Å; E98-F102 PolarHBondContact O-N 2.82Å
99	L	82.3	Confident	75.1	Confident	14 Å²	14	96.4 Å²	96.4	7%	0.073	47%	0.472	C	S	.	.	H	α-helix	trans	-71.1	-36	176.9	179.4	57.4	0	0	0	112.4	V77 R80 L81 I84 L95 L96 E97 F102 S103	V77-L99 HydrophobicContact CB-CD1 4.4Å; V77-L99 HydrophobicContact CG1-CD1 4.23Å; V77-L99 HydrophobicContact CG2-CD1 4.25Å; R80-L99 HydrophobicContact CB-CD1 3.78Å; L81-L99 HydrophobicContact CB-CD2 4.18Å; L81-L99 HydrophobicContact CD1-CD2 3.84Å; I84-L99 HydrophobicContact CD1-CB 3.88Å; I84-L99 HydrophobicContact CD1-CD2 3.47Å; I84-L99 VanDerWaalsContact CD1-CD2 3.47Å; I84-L99 HydrophobicContact CD1-CG 4.32Å; L95-L99 WeakPolarHBondContact O-CB 3.4Å; L95-L99 PolarHBondContact O-N 3.04Å; L96-L99 PolarHBondContact O-N 2.91Å; E97-L99 VanDerWaalsContact C-N 3.3Å; E97-L99 PolarHBondContact O-N 3.3Å; L99-F102 PolarHBondContact O-N 3.32Å; L99-S103 VanDerWaalsContact O-CB 3.27Å; L99-S103 WeakPolarHBondContact O-CB 3.3Å; L99-S103 PolarHBondContact O-N 2.87Å; L99-S103 PolarHBondContact O-OG 3.14Å
100	T	80.7	Confident	74.5	Confident	72 Å²	72	94.9 Å²	94.9	44%	0.442	47%	0.466	S	S	.	.	H	α-helix	trans	-64.4	-51.3	177.2	-59.5	0	0	0	0	109.4	L96 E97 F102 S103 F104	L96-T100 VanDerWaalsContact O-CB 3.32Å; L96-T100 WeakPolarHBondContact O-CB 3.47Å; L96-T100 PolarHBondContact O-N 3.2Å; L96-T100 PolarHBondContact O-OG1 3.1Å; E97-T100 WeakPolarHBondContact O-CB 3.43Å; E97-T100 PolarHBondContact O-N 3.47Å; E97-T100 VanDerWaalsContact O-N 3.09Å; T100-F102 PolarHBondContact O-N 2.96Å; T100-S103 PolarHBondContact O-N 3.37Å; T100-S103 PolarHBondContact O-OG 3.29Å; T100-F104 HydrophobicContact CG2-CD2 3.95Å; T100-F104 HydrophobicContact CG2-CE2 3.89Å; T100-F104 VanDerWaalsContact O-CD2 3.26Å; T100-F104 WeakPolarHBondContact O-CD2 3.23Å; T100-F104 PolarHBondContact O-N 2.96Å
101	E	83.2	Confident	73.3	Confident	126 Å²	126	89.9 Å²	89.9	59%	0.589	44%	0.441	S	S	*	.	H	α-helix	trans	-56.3	-51.2	174.8	-163.8	-164.2	149.4	0	0	110.9	E97 S103 F104 Q105	E97-E101 PolarHBondContact O-N 2.91Å; E101-S103 VanDerWaalsContact C-N 3.28Å; E101-S103 PolarHBondContact O-N 2.83Å; E101-F104 CarbonylContact O-C 3.56Å; E101-F104 PolarHBondContact O-N 3.31Å; E101-Q105 WeakPolarHBondContact O-CG 3.27Å; E101-Q105 PolarHBondContact O-N 3.09Å; E101-Q105 PolarHBondContact OE1-NE2 3.28Å
102	F	78	Confident	72.2	Confident	53 Å²	53	93 Å²	93	23%	0.232	45%	0.454	C	S	.	.	H	α-helix	trans	-57.7	-38.4	178.5	-176.5	-100.8	0	0	0	112.9	H73 Q76 V77 E98 L99 T100 F104 Q105	H73-F102 AromaticContact CE1-CE1 3.85Å; H73-F102 PolarHBondContact CE1-O 2.99Å; H73-F102 VanDerWaalsContact CE1-O 3.29Å; H73-F102 AromaticContact ND1-CE1 3.84Å; H73-F102 AromaticContact ND1-CZ 3.91Å; Q76-F102 HydrophobicContact CB-CE1 3.79Å; Q76-F102 HydrophobicContact CB-CZ 3.85Å; V77-F102 HydrophobicContact CG2-CD1 3.98Å; V77-F102 HydrophobicContact CG2-CE1 3.97Å; E98-F102 VanDerWaalsContact O-CB 3.23Å; E98-F102 WeakPolarHBondContact O-CB 3.47Å; E98-F102 PolarHBondContact O-N 2.82Å; L99-F102 PolarHBondContact O-N 3.32Å; T100-F102 PolarHBondContact O-N 2.96Å; F102-F104 VanDerWaalsContact C-N 3.29Å; F102-F104 PolarHBondContact O-N 3.37Å; F102-Q105 PolarHBondContact O-N 3.22Å
103	S	75.1	Confident	70.7	Confident	55 Å²	55	92.6 Å²	92.6	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-72.5	-17.8	178.9	72	0	0	0	0	114.6	L99 T100 E101	L99-S103 VanDerWaalsContact O-CB 3.27Å; L99-S103 WeakPolarHBondContact O-CB 3.3Å; L99-S103 PolarHBondContact O-N 2.87Å; L99-S103 PolarHBondContact O-OG 3.14Å; T100-S103 PolarHBondContact O-N 3.37Å; T100-S103 PolarHBondContact O-OG 3.29Å; E101-S103 VanDerWaalsContact C-N 3.28Å; E101-S103 PolarHBondContact O-N 2.83Å
104	F	72	Confident	69.5	Low	172 Å²	172	90.1 Å²	90.1	75%	0.754	45%	0.448	S	S	*	.	H	α-helix	trans	-101.8	-10	173.9	-74.5	-65.7	0	0	0	113.5	T100 E101 F102 E106	T100-F104 HydrophobicContact CG2-CD2 3.95Å; T100-F104 HydrophobicContact CG2-CE2 3.89Å; T100-F104 VanDerWaalsContact O-CD2 3.26Å; T100-F104 WeakPolarHBondContact O-CD2 3.23Å; T100-F104 PolarHBondContact O-N 2.96Å; E101-F104 CarbonylContact O-C 3.56Å; E101-F104 PolarHBondContact O-N 3.31Å; F102-F104 VanDerWaalsContact C-N 3.29Å; F102-F104 PolarHBondContact O-N 3.37Å; F104-E106 PolarHBondContact O-N 2.89Å
105	Q	70.3	Confident	68.1	Low	95 Å²	95	92.9 Å²	92.9	44%	0.444	46%	0.459	S	S	.	.	S	Bend	trans	-69.4	125.3	169.6	-75.2	174.8	8.7	0	0	109.9	E101 F102 C107	E101-Q105 WeakPolarHBondContact O-CG 3.27Å; E101-Q105 PolarHBondContact O-N 3.09Å; E101-Q105 PolarHBondContact OE1-NE2 3.28Å; F102-Q105 PolarHBondContact O-N 3.22Å; Q105-C107 PolarHBondContact O-N 3.36Å
106	E	64	Low	66.5	Low	186 Å²	186	97.9 Å²	97.9	87%	0.869	48%	0.479	S	S	*	.			trans	-57.3	133.5	-178.7	-64.2	-176.4	150.1	0	0	111.4	F104 P108	F104-E106 PolarHBondContact O-N 2.89Å; E106-P108 VanDerWaalsContact O-CD 3.31Å; E106-P108 WeakPolarHBondContact O-CD 3.45Å; E106-P108 VanDerWaalsContact O-N 3.11Å
107	C	59.5	Low	65.1	Low	53 Å²	53	100.1 Å²	100.1	36%	0.358	49%	0.491	S	S	.	.			trans	-62	114.2	-175.1	-177	0	0	0	0	110.4	A69 Q105 D109	A69-C107 VanDerWaalsContact C-SG 3.53Å; A69-C107 PolarHBondContact O-SG 2.82Å; Q105-C107 PolarHBondContact O-N 3.36Å; C107-D109 PolarHBondContact O-N 2.68Å
108	P	57.6	Low	63.6	Low	104 Å²	104	97.4 Å²	97.4	68%	0.675	49%	0.487	S	S	*	.			trans	-70.3	109.1	-167.5	26.3	-34.4	0	0	0	111.1	E106 I110	E106-P108 VanDerWaalsContact O-CD 3.31Å; E106-P108 WeakPolarHBondContact O-CD 3.45Å; E106-P108 VanDerWaalsContact O-N 3.11Å; P108-I110 PolarHBondContact O-N 3.2Å; P108-I110 VanDerWaalsContact O-N 3.09Å
109	D	53	Low	62.2	Low	50 Å²	50	97.4 Å²	97.4	27%	0.267	50%	0.499	S	S	.	.			trans	-71.5	110.3	-180	-168.1	-0.4	0	0	0	111	C107 F111 E112 T113	C107-D109 PolarHBondContact O-N 2.68Å; D109-F111 PolarHBondContact O-N 2.86Å; D109-F111 WeakPolarHBondContact OD1-CB 3.31Å; D109-F111 PolarHBondContact OD1-N 3.45Å; D109-E112 HydrophobicContact CB-CB 4.13Å; D109-E112 HydrophobicContact CB-CG 4.07Å; D109-E112 PolarHBondContact O-N 3.2Å; D109-E112 VanDerWaalsContact O-N 3.07Å; D109-T113 PolarHBondContact O-N 2.84Å; D109-T113 PolarHBondContact O-OG1 2.93Å
110	I	57.4	Low	60.4	Low	113 Å²	113	100.8 Å²	100.8	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-58.4	-25.9	174.3	-54.9	173.3	0	0	0	110.3	P108 T113 K114	P108-I110 PolarHBondContact O-N 3.2Å; P108-I110 VanDerWaalsContact O-N 3.09Å; I110-T113 WeakPolarHBondContact CA-OG1 3.48Å; I110-T113 PolarHBondContact O-OG1 3.48Å; I110-T113 VanDerWaalsContact O-OG1 3.09Å; I110-K114 VanDerWaalsContact O-CB 3.29Å; I110-K114 WeakPolarHBondContact O-CB 3.28Å; I110-K114 PolarHBondContact O-N 2.87Å; I110-K114 VanDerWaalsContact O-N 3.16Å
111	F	51.6	Low	58.7	Low	74 Å²	74	105.3 Å²	105.3	33%	0.325	54%	0.535	S	S	.	.	H	α-helix	trans	-86.7	-24.9	175.2	-85.9	-111	0	0	0	114.4	D109 K114 R115	D109-F111 PolarHBondContact O-N 2.86Å; D109-F111 WeakPolarHBondContact OD1-CB 3.31Å; D109-F111 PolarHBondContact OD1-N 3.45Å; F111-K114 HydrophobicContact CD1-CD 3.95Å; F111-K114 HydrophobicContact CE1-CD 3.96Å; F111-K114 HydrophobicContact CG-CD 4.32Å; F111-K114 HydrophobicContact CZ-CD 4.29Å; F111-K114 PolarHBondContact O-N 3.37Å; F111-R115 WeakPolarHBondContact O-CB 3.42Å; F111-R115 PolarHBondContact O-N 3.21Å
112	E	54.2	Low	57	Low	118 Å²	118	107.9 Å²	107.9	55%	0.551	55%	0.547	S	S	*	.	H	α-helix	trans	-65.6	-49.2	167.1	-80.4	-143	148.2	0	0	110.8	D109 K114 R115 F116	D109-E112 HydrophobicContact CB-CB 4.13Å; D109-E112 HydrophobicContact CB-CG 4.07Å; D109-E112 PolarHBondContact O-N 3.2Å; D109-E112 VanDerWaalsContact O-N 3.07Å; E112-K114 VanDerWaalsContact C-N 3.29Å; E112-K114 PolarHBondContact O-N 3.01Å; E112-R115 CarbonylContact O-C 3.44Å; E112-R115 WeakPolarHBondContact O-CA 3.21Å; E112-R115 WeakPolarHBondContact O-CB 3.45Å; E112-R115 PolarHBondContact O-N 2.86Å; E112-F116 HydrophobicContact CB-CE2 4.46Å; E112-F116 WeakPolarHBondContact O-CD2 3.39Å; E112-F116 PolarHBondContact O-N 3.33Å
113	T	50.8	Low	55.3	Low	76 Å²	76	115.8 Å²	115.8	47%	0.466	58%	0.575	S	S	.	*	H	α-helix	trans	-57.7	-41.7	174.5	39.3	0	0	0	0	111.9	D109 I110 R115 L117	D109-T113 PolarHBondContact O-N 2.84Å; D109-T113 PolarHBondContact O-OG1 2.93Å; I110-T113 WeakPolarHBondContact CA-OG1 3.48Å; I110-T113 PolarHBondContact O-OG1 3.48Å; I110-T113 VanDerWaalsContact O-OG1 3.09Å; T113-R115 VanDerWaalsContact C-N 3.35Å; T113-R115 PolarHBondContact O-N 3.49Å; T113-L117 WeakPolarHBondContact O-CB 3.32Å; T113-L117 VanDerWaalsContact O-CG 3.25Å; T113-L117 WeakPolarHBondContact O-CG 3.42Å; T113-L117 PolarHBondContact O-N 2.95Å
114	K	53.9	Low	53.5	Low	102 Å²	102	121 Å²	121	44%	0.443	60%	0.599	S	S	.	*	H	α-helix	trans	-62.8	-35.9	171.2	-168.1	-173.5	177.9	-165.4	0	112.8	I110 F111 E112 S118	I110-K114 VanDerWaalsContact O-CB 3.29Å; I110-K114 WeakPolarHBondContact O-CB 3.28Å; I110-K114 PolarHBondContact O-N 2.87Å; I110-K114 VanDerWaalsContact O-N 3.16Å; F111-K114 HydrophobicContact CD1-CD 3.95Å; F111-K114 HydrophobicContact CE1-CD 3.96Å; F111-K114 HydrophobicContact CG-CD 4.32Å; F111-K114 HydrophobicContact CZ-CD 4.29Å; F111-K114 PolarHBondContact O-N 3.37Å; E112-K114 VanDerWaalsContact C-N 3.29Å; E112-K114 PolarHBondContact O-N 3.01Å; K114-S118 VanDerWaalsContact O-CB 3.28Å; K114-S118 WeakPolarHBondContact O-CB 3.39Å; K114-S118 PolarHBondContact O-N 3.23Å; K114-S118 PolarHBondContact O-OG 3.11Å
115	R	53.6	Low	52.4	Low	178 Å²	178	114 Å²	114	67%	0.672	58%	0.575	S	S	*	*	H	α-helix	trans	-73	-41.6	179.5	-168.7	177.4	-164.4	164.1	9.7	111.8	F111 E112 T113 S118 A119	F111-R115 WeakPolarHBondContact O-CB 3.42Å; F111-R115 PolarHBondContact O-N 3.21Å; E112-R115 CarbonylContact O-C 3.44Å; E112-R115 WeakPolarHBondContact O-CA 3.21Å; E112-R115 WeakPolarHBondContact O-CB 3.45Å; E112-R115 PolarHBondContact O-N 2.86Å; T113-R115 VanDerWaalsContact C-N 3.35Å; T113-R115 PolarHBondContact O-N 3.49Å; R115-S118 PolarHBondContact O-N 3.43Å; R115-A119 VanDerWaalsContact O-CB 3.24Å; R115-A119 WeakPolarHBondContact O-CB 3.49Å; R115-A119 PolarHBondContact O-N 3.02Å
116	F	49.7	Very low	51.7	Low	131 Å²	131	115.4 Å²	115.4	58%	0.575	59%	0.59	S	S	*	*	H	α-helix	trans	-57.9	-49.2	169.2	-77.8	-69.4	0	0	0	110.8	E112 S118 N120	E112-F116 HydrophobicContact CB-CE2 4.46Å; E112-F116 WeakPolarHBondContact O-CD2 3.39Å; E112-F116 PolarHBondContact O-N 3.33Å; F116-S118 VanDerWaalsContact C-N 3.29Å; F116-S118 PolarHBondContact O-N 2.68Å; F116-N120 WeakPolarHBondContact O-CB 3.38Å; F116-N120 PolarHBondContact O-N 2.83Å; F116-N120 PolarHBondContact O-ND2 2.87Å; F116-N120 PolarHBondContact O-OD1 2.97Å
117	L	53.4	Low	51.2	Low	126 Å²	126	114.3 Å²	114.3	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-31.9	176.7	-70.9	168.7	0	0	0	113.5	T113	T113-L117 WeakPolarHBondContact O-CB 3.32Å; T113-L117 VanDerWaalsContact O-CG 3.25Å; T113-L117 WeakPolarHBondContact O-CG 3.42Å; T113-L117 PolarHBondContact O-N 2.95Å
118	S	53	Low	50.9	Low	81 Å²	81	117.1 Å²	117.1	57%	0.566	60%	0.597	S	S	*	*	H	α-helix	trans	-84.9	-37	-178.8	-56	0	0	0	0	113.2	K114 R115 F116	K114-S118 VanDerWaalsContact O-CB 3.28Å; K114-S118 WeakPolarHBondContact O-CB 3.39Å; K114-S118 PolarHBondContact O-N 3.23Å; K114-S118 PolarHBondContact O-OG 3.11Å; R115-S118 PolarHBondContact O-N 3.43Å; F116-S118 VanDerWaalsContact C-N 3.29Å; F116-S118 PolarHBondContact O-N 2.68Å
119	A	52.2	Low	50.6	Low	66 Å²	66	114.3 Å²	114.3	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-73.3	-27.7	178.9	0	0	0	0	0	112.7	R115 M121	R115-A119 VanDerWaalsContact O-CB 3.24Å; R115-A119 WeakPolarHBondContact O-CB 3.49Å; R115-A119 PolarHBondContact O-N 3.02Å; A119-M121 PolarHBondContact O-N 3.34Å
120	N	44.3	Very low	50.9	Low	85 Å²	85	119.9 Å²	119.9	46%	0.455	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	-1.4	-178.2	-78.1	-6.7	0	0	0	115.1	F116	F116-N120 WeakPolarHBondContact O-CB 3.38Å; F116-N120 PolarHBondContact O-N 2.83Å; F116-N120 PolarHBondContact O-ND2 2.87Å; F116-N120 PolarHBondContact O-OD1 2.97Å
121	M	46.9	Very low	51.1	Low	168 Å²	168	120 Å²	120	83%	0.828	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-1.9	176.2	-73	-150.5	72.3	0	0	115.5	A119	A119-M121 PolarHBondContact O-N 3.34Å
122	Q	47.3	Very low	51.6	Low	179 Å²	179	119.1 Å²	119.1	84%	0.836	60%	0.598	S	S	*	*	S	Bend	trans	-133.4	5.2	-168.7	-70.3	-166.3	-6.1	0	0	118.2
123	R	41.7	Very low	52.2	Low	220 Å²	220	117 Å²	117	83%	0.83	59%	0.593	S	S	*	*			trans	-135.8	115.1	174.6	-67.4	-172.5	-174.3	138.6	7	113
124	D	37.6	Very low	53.4	Low	164 Å²	164	116.6 Å²	116.6	88%	0.877	59%	0.591	S	S	*	*			trans	-86.6	139	175.6	-164	-3.9	0	0	0	110.3
125	G	48.3	Very low	54.5	Low	25 Å²	25	117.3 Å²	117.3	26%	0.258	59%	0.594	S	S	.	*			trans	-176.1	89.7	-164.5	0	0	0	0	0	112.3	L127 E128 A129	G125-L127 VanDerWaalsContact C-N 3.28Å; G125-L127 PolarHBondContact O-N 3.27Å; G125-L127 VanDerWaalsContact O-N 3.15Å; G125-E128 PolarHBondContact O-N 3.18Å; G125-A129 PolarHBondContact O-N 2.78Å
126	V	56.2	Low	55.4	Low	124 Å²	124	113.8 Å²	113.8	75%	0.752	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-29.3	-165.3	-176.9	0	0	0	0	114.4	A129	V126-A129 WeakPolarHBondContact O-CB 3.49Å
127	L	53.4	Low	56.8	Low	163 Å²	163	112.6 Å²	112.6	85%	0.853	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-42.2	178.1	-79.6	166	0	0	0	112.5	G125 A129 K130	G125-L127 VanDerWaalsContact C-N 3.28Å; G125-L127 PolarHBondContact O-N 3.27Å; G125-L127 VanDerWaalsContact O-N 3.15Å; L127-A129 PolarHBondContact O-N 2.87Å; L127-K130 PolarHBondContact O-N 3.46Å
128	E	52.8	Low	58.1	Low	113 Å²	113	111.7 Å²	111.7	53%	0.528	58%	0.577	S	S	.	*	H	α-helix	trans	-62.8	-28.3	175.2	-59.8	-176.2	162.5	0	0	111.9	G125 K130 E131 K132	G125-E128 PolarHBondContact O-N 3.18Å; E128-K130 PolarHBondContact O-N 3.09Å; E128-K130 VanDerWaalsContact O-N 3.15Å; E128-E131 PolarHBondContact O-N 2.8Å; E128-E131 VanDerWaalsContact O-N 3.16Å; E128-K132 HydrophobicContact CB-CD 4.18Å; E128-K132 WeakPolarHBondContact O-CB 3.39Å; E128-K132 VanDerWaalsContact O-CG 3.31Å; E128-K132 WeakPolarHBondContact O-CG 3.49Å; E128-K132 PolarHBondContact O-N 3.14Å; E128-K132 VanDerWaalsContact OE2-CE 3.32Å; E128-K132 WeakPolarHBondContact OE2-CE 3.48Å; E128-K132 IonicContact OE2-NZ 3.76Å; E128-K132 PolarHBondContact OE2-NZ 2.85Å
129	A	51.9	Low	59.3	Low	44 Å²	44	111.8 Å²	111.8	36%	0.364	57%	0.571	S	S	.	*	H	α-helix	trans	-54.9	-32.9	-178.8	0	0	0	0	0	113.4	G125 V126 L127 T133	G125-A129 PolarHBondContact O-N 2.78Å; V126-A129 WeakPolarHBondContact O-CB 3.49Å; L127-A129 PolarHBondContact O-N 2.87Å; A129-T133 WeakPolarHBondContact O-CB 3.42Å; A129-T133 PolarHBondContact O-N 2.97Å; A129-T133 PolarHBondContact O-OG1 3.19Å
130	K	58.8	Low	60.6	Low	167 Å²	167	112.7 Å²	112.7	73%	0.726	57%	0.565	S	S	*	*	H	α-helix	trans	-72	-45.2	177.2	-73.9	-172.1	175.4	-177.1	0	112.6	L127 E128 K132 T133 T134	L127-K130 PolarHBondContact O-N 3.46Å; E128-K130 PolarHBondContact O-N 3.09Å; E128-K130 VanDerWaalsContact O-N 3.15Å; K130-K132 VanDerWaalsContact C-N 3.33Å; K130-T133 WeakPolarHBondContact O-CB 3.37Å; K130-T133 PolarHBondContact O-N 3.18Å; K130-T134 PolarHBondContact O-N 3.28Å
131	E	62.4	Low	62.3	Low	116 Å²	116	111.4 Å²	111.4	54%	0.542	57%	0.567	S	S	.	*	H	α-helix	trans	-65.9	-35.4	173.9	-73.1	-163	-176.5	0	0	112.9	E128 T133 T134 K135	E128-E131 PolarHBondContact O-N 2.8Å; E128-E131 VanDerWaalsContact O-N 3.16Å; E131-T133 VanDerWaalsContact C-N 3.33Å; E131-T134 PolarHBondContact O-N 3.06Å; E131-T134 PolarHBondContact O-OG1 3.32Å; E131-K135 WeakPolarHBondContact O-CB 3.43Å; E131-K135 WeakPolarHBondContact O-CD 3.43Å; E131-K135 VanDerWaalsContact O-CG 3.25Å; E131-K135 WeakPolarHBondContact O-CG 3.41Å; E131-K135 PolarHBondContact O-N 2.87Å; E131-K135 IonicContact OE2-NZ 3.11Å; E131-K135 PolarHBondContact OE2-NZ 3.08Å
132	K	60.6	Low	64	Low	55 Å²	55	109.8 Å²	109.8	24%	0.239	56%	0.555	C	S	.	*	H	α-helix	trans	-59.5	-47.1	172	-71.9	166.3	-177.7	166.8	0	109.7	E128 K130 T134 K135 E136	E128-K132 HydrophobicContact CB-CD 4.18Å; E128-K132 WeakPolarHBondContact O-CB 3.39Å; E128-K132 VanDerWaalsContact O-CG 3.31Å; E128-K132 WeakPolarHBondContact O-CG 3.49Å; E128-K132 PolarHBondContact O-N 3.14Å; E128-K132 VanDerWaalsContact OE2-CE 3.32Å; E128-K132 WeakPolarHBondContact OE2-CE 3.48Å; E128-K132 IonicContact OE2-NZ 3.76Å; E128-K132 PolarHBondContact OE2-NZ 2.85Å; K130-K132 VanDerWaalsContact C-N 3.33Å; K132-T134 PolarHBondContact O-N 3.46Å; K132-K135 PolarHBondContact O-N 2.93Å; K132-E136 WeakPolarHBondContact O-CB 3.37Å; K132-E136 VanDerWaalsContact O-CG 3.3Å; K132-E136 WeakPolarHBondContact O-CG 3.45Å; K132-E136 PolarHBondContact O-N 3.14Å
133	T	67.8	Low	65.7	Low	73 Å²	73	105.4 Å²	105.4	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-60.6	-41.3	176.8	-47.5	0	0	0	0	112.8	A129 K130 E131 L137	A129-T133 WeakPolarHBondContact O-CB 3.42Å; A129-T133 PolarHBondContact O-N 2.97Å; A129-T133 PolarHBondContact O-OG1 3.19Å; K130-T133 WeakPolarHBondContact O-CB 3.37Å; K130-T133 PolarHBondContact O-N 3.18Å; E131-T133 VanDerWaalsContact C-N 3.33Å; T133-L137 HydrophobicContact CG2-CD1 4.23Å; T133-L137 WeakPolarHBondContact O-CB 3.41Å; T133-L137 VanDerWaalsContact O-CG 3.31Å; T133-L137 WeakPolarHBondContact O-CG 3.35Å; T133-L137 PolarHBondContact O-N 2.98Å
134	T	76.1	Confident	67.6	Low	68 Å²	68	103 Å²	103	42%	0.417	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-42.8	177.8	57.1	0	0	0	0	111.9	K130 E131 K132 E136 L137 E138	K130-T134 PolarHBondContact O-N 3.28Å; E131-T134 PolarHBondContact O-N 3.06Å; E131-T134 PolarHBondContact O-OG1 3.32Å; K132-T134 PolarHBondContact O-N 3.46Å; T134-E136 VanDerWaalsContact C-N 3.32Å; T134-E136 PolarHBondContact O-N 2.91Å; T134-L137 PolarHBondContact O-N 3.39Å; T134-E138 WeakPolarHBondContact O-CG 3.19Å; T134-E138 PolarHBondContact O-N 3.32Å
135	K	76.7	Confident	69.8	Low	118 Å²	118	100.9 Å²	100.9	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-36.1	176.3	-69.7	163.7	-174.1	164.1	0	111.9	E131 K132 L139	E131-K135 WeakPolarHBondContact O-CB 3.43Å; E131-K135 WeakPolarHBondContact O-CD 3.43Å; E131-K135 VanDerWaalsContact O-CG 3.25Å; E131-K135 WeakPolarHBondContact O-CG 3.41Å; E131-K135 PolarHBondContact O-N 2.87Å; E131-K135 IonicContact OE2-NZ 3.11Å; E131-K135 PolarHBondContact OE2-NZ 3.08Å; K132-K135 PolarHBondContact O-N 2.93Å; K135-L139 WeakPolarHBondContact O-CB 3.34Å; K135-L139 PolarHBondContact O-N 3.02Å
136	E	72.8	Confident	71.4	Confident	104 Å²	104	105.1 Å²	105.1	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-66.9	-42.3	171.8	-75.8	171.9	-170.4	0	0	112.3	K132 T134 L139 I140	K132-E136 WeakPolarHBondContact O-CB 3.37Å; K132-E136 VanDerWaalsContact O-CG 3.3Å; K132-E136 WeakPolarHBondContact O-CG 3.45Å; K132-E136 PolarHBondContact O-N 3.14Å; T134-E136 VanDerWaalsContact C-N 3.32Å; T134-E136 PolarHBondContact O-N 2.91Å; E136-L139 PolarHBondContact O-N 2.98Å; E136-I140 WeakPolarHBondContact O-CB 3.43Å; E136-I140 WeakPolarHBondContact O-CD1 3.27Å; E136-I140 VanDerWaalsContact O-CG1 3.24Å; E136-I140 WeakPolarHBondContact O-CG1 3.28Å; E136-I140 PolarHBondContact O-N 2.88Å
137	L	79	Confident	72.6	Confident	105 Å²	105	103.9 Å²	103.9	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-40.5	175	-76	167.6	0	0	0	112.6	T133 T134 I140 A141	T133-L137 HydrophobicContact CG2-CD1 4.23Å; T133-L137 WeakPolarHBondContact O-CB 3.41Å; T133-L137 VanDerWaalsContact O-CG 3.31Å; T133-L137 WeakPolarHBondContact O-CG 3.35Å; T133-L137 PolarHBondContact O-N 2.98Å; T134-L137 PolarHBondContact O-N 3.39Å; L137-I140 PolarHBondContact O-N 3.48Å; L137-A141 WeakPolarHBondContact O-CB 3.33Å; L137-A141 PolarHBondContact O-N 2.76Å
138	E	79.6	Confident	74	Confident	107 Å²	107	99 Å²	99	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-62.6	-41.9	173.3	-75.1	170.9	-147.8	0	0	111.9	T134 A141 K142	T134-E138 WeakPolarHBondContact O-CG 3.19Å; T134-E138 PolarHBondContact O-N 3.32Å; E138-A141 PolarHBondContact O-N 3.49Å; E138-K142 WeakPolarHBondContact O-CG 3.32Å; E138-K142 PolarHBondContact O-N 3.41Å
139	L	79.5	Confident	75.3	Confident	84 Å²	84	97.1 Å²	97.1	44%	0.44	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-41.2	175.3	-177.4	61.4	0	0	0	111.5	K135 E136 A141 K142 L143	K135-L139 WeakPolarHBondContact O-CB 3.34Å; K135-L139 PolarHBondContact O-N 3.02Å; E136-L139 PolarHBondContact O-N 2.98Å; L139-A141 VanDerWaalsContact C-N 3.33Å; L139-A141 PolarHBondContact O-N 2.88Å; L139-K142 PolarHBondContact O-N 2.91Å; L139-L143 HydrophobicContact CD1-CD1 4.21Å; L139-L143 HydrophobicContact CD1-CG 4.28Å; L139-L143 HydrophobicContact CG-CD1 3.99Å; L139-L143 HydrophobicContact CG-CG 4.48Å; L139-L143 WeakPolarHBondContact O-CB 3.23Å; L139-L143 VanDerWaalsContact O-CG 3.27Å; L139-L143 WeakPolarHBondContact O-CG 3.26Å; L139-L143 PolarHBondContact O-N 3.44Å
140	I	79.5	Confident	76.6	Confident	84 Å²	84	100.4 Å²	100.4	43%	0.431	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-38.5	174.1	-70.6	163.5	0	0	0	111	E136 L137 R144	E136-I140 WeakPolarHBondContact O-CB 3.43Å; E136-I140 WeakPolarHBondContact O-CD1 3.27Å; E136-I140 VanDerWaalsContact O-CG1 3.24Å; E136-I140 WeakPolarHBondContact O-CG1 3.28Å; E136-I140 PolarHBondContact O-N 2.88Å; L137-I140 PolarHBondContact O-N 3.48Å; I140-R144 WeakPolarHBondContact O-CB 3.49Å; I140-R144 VanDerWaalsContact O-CG 3.28Å; I140-R144 WeakPolarHBondContact O-CG 3.5Å; I140-R144 PolarHBondContact O-N 3.3Å
141	A	80.6	Confident	77.6	Confident	59 Å²	59	95.4 Å²	95.4	49%	0.488	47%	0.473	S	S	.	.	H	α-helix	trans	-65.2	-46.3	175.5	0	0	0	0	0	111.8	L137 E138 L139 R144 H145	L137-A141 WeakPolarHBondContact O-CB 3.33Å; L137-A141 PolarHBondContact O-N 2.76Å; E138-A141 PolarHBondContact O-N 3.49Å; L139-A141 VanDerWaalsContact C-N 3.33Å; L139-A141 PolarHBondContact O-N 2.88Å; A141-R144 PolarHBondContact O-N 2.94Å; A141-H145 PolarHBondContact O-N 2.86Å
142	K	81.7	Confident	78.4	Confident	133 Å²	133	93.1 Å²	93.1	58%	0.578	46%	0.462	S	S	*	.	H	α-helix	trans	-60.7	-45.5	175.3	-72.5	172.2	-179.8	176.5	0	112.1	E138 L139 R144 H145 Q146	E138-K142 WeakPolarHBondContact O-CG 3.32Å; E138-K142 PolarHBondContact O-N 3.41Å; L139-K142 PolarHBondContact O-N 2.91Å; K142-R144 VanDerWaalsContact C-N 3.33Å; K142-R144 PolarHBondContact O-N 3.3Å; K142-H145 PolarHBondContact O-N 3.45Å; K142-Q146 WeakPolarHBondContact O-CG 3.27Å; K142-Q146 PolarHBondContact O-N 3.44Å
143	L	83.6	Confident	79.3	Confident	88 Å²	88	95.2 Å²	95.2	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-67.6	-29.7	177.6	-71.6	171.3	0	0	0	113.2	L139 L147	L139-L143 HydrophobicContact CD1-CD1 4.21Å; L139-L143 HydrophobicContact CD1-CG 4.28Å; L139-L143 HydrophobicContact CG-CD1 3.99Å; L139-L143 HydrophobicContact CG-CG 4.48Å; L139-L143 WeakPolarHBondContact O-CB 3.23Å; L139-L143 VanDerWaalsContact O-CG 3.27Å; L139-L143 WeakPolarHBondContact O-CG 3.26Å; L139-L143 PolarHBondContact O-N 3.44Å; L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.25Å; L143-L147 VanDerWaalsContact O-N 3.14Å
144	R	81	Confident	79.7	Confident	168 Å²	168	93.5 Å²	93.5	63%	0.634	47%	0.468	S	S	*	.	H	α-helix	trans	-69.3	-49.4	171.9	-80.7	175.6	173.6	-162	-2.6	111.6	I140 A141 K142 Q146 L147 D148	I140-R144 WeakPolarHBondContact O-CB 3.49Å; I140-R144 VanDerWaalsContact O-CG 3.28Å; I140-R144 WeakPolarHBondContact O-CG 3.5Å; I140-R144 PolarHBondContact O-N 3.3Å; A141-R144 PolarHBondContact O-N 2.94Å; K142-R144 VanDerWaalsContact C-N 3.33Å; K142-R144 PolarHBondContact O-N 3.3Å; R144-Q146 VanDerWaalsContact C-N 3.31Å; R144-Q146 PolarHBondContact O-N 2.91Å; R144-L147 CarbonylContact O-C 3.55Å; R144-L147 WeakPolarHBondContact O-CA 3.49Å; R144-L147 WeakPolarHBondContact O-CB 3.49Å; R144-L147 PolarHBondContact O-N 2.86Å; R144-D148 PolarHBondContact O-N 3.37Å
145	H	82.7	Confident	79.8	Confident	120 Å²	120	95.6 Å²	95.6	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-55.8	-46	175.4	-177	-2.4	0	0	0	111.4	A141 K142 L147 D148 D149	A141-H145 PolarHBondContact O-N 2.86Å; K142-H145 PolarHBondContact O-N 3.45Å; H145-L147 PolarHBondContact O-N 2.68Å; H145-D148 PolarHBondContact O-N 3.03Å; H145-D149 IonicContact CE1-OD1 3.94Å; H145-D149 PolarHBondContact CE1-OD1 3.27Å; H145-D149 IonicContact CE1-OD2 2.68Å; H145-D149 PolarHBondContact CE1-OD2 3.36Å; H145-D149 IonicContact ND1-OD1 3.21Å; H145-D149 PolarHBondContact ND1-OD1 3.43Å; H145-D149 IonicContact ND1-OD2 3.84Å; H145-D149 PolarHBondContact ND1-OD2 3.19Å; H145-D149 PolarHBondContact O-N 3.42Å; H145-D149 VanDerWaalsContact O-OD1 3.13Å
146	Q	82.1	Confident	79.8	Confident	115 Å²	115	96.7 Å²	96.7	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-25.2	175.3	-72.5	179.7	-27.6	0	0	114	K142 R144 L150	K142-Q146 WeakPolarHBondContact O-CG 3.27Å; K142-Q146 PolarHBondContact O-N 3.44Å; R144-Q146 VanDerWaalsContact C-N 3.31Å; R144-Q146 PolarHBondContact O-N 2.91Å; Q146-L150 WeakPolarHBondContact O-CB 3.49Å; Q146-L150 WeakPolarHBondContact O-CD1 3.38Å; Q146-L150 WeakPolarHBondContact O-CG 3.24Å; Q146-L150 PolarHBondContact O-N 2.95Å
147	L	82.6	Confident	79.8	Confident	98 Å²	98	102.1 Å²	102.1	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-78.6	-45	172.2	-83.1	164.8	0	0	0	111.7	L143 R144 H145 D149 L150 E151	L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.25Å; L143-L147 VanDerWaalsContact O-N 3.14Å; R144-L147 CarbonylContact O-C 3.55Å; R144-L147 WeakPolarHBondContact O-CA 3.49Å; R144-L147 WeakPolarHBondContact O-CB 3.49Å; R144-L147 PolarHBondContact O-N 2.86Å; H145-L147 PolarHBondContact O-N 2.68Å; L147-D149 VanDerWaalsContact C-N 3.32Å; L147-D149 PolarHBondContact O-N 3.11Å; L147-L150 PolarHBondContact O-N 3.14Å; L147-E151 WeakPolarHBondContact O-CB 3.48Å; L147-E151 WeakPolarHBondContact O-CG 3.31Å; L147-E151 PolarHBondContact O-N 2.99Å
148	D	81.5	Confident	79.3	Confident	61 Å²	61	100.5 Å²	100.5	33%	0.326	50%	0.502	S	S	.	.	H	α-helix	trans	-58	-44	175	-78.6	-62.1	0	0	0	111	R144 H145 L150 E151 E152 S165	R144-D148 PolarHBondContact O-N 3.37Å; H145-D148 PolarHBondContact O-N 3.03Å; D148-L150 PolarHBondContact O-N 3.36Å; D148-E151 PolarHBondContact O-N 3.4Å; D148-E152 WeakPolarHBondContact O-CB 3.43Å; D148-E152 PolarHBondContact O-N 3Å; D148-S165 WeakPolarHBondContact OD1-CB 3.38Å; D148-S165 PolarHBondContact OD1-OG 2.86Å
149	D	81.3	Confident	78.4	Confident	72 Å²	72	99.8 Å²	99.8	39%	0.385	51%	0.514	S	S	.	.	H	α-helix	trans	-60.4	-42.4	175.3	-63	-6.9	0	0	0	112.2	H145 L147 L153	H145-D149 IonicContact CE1-OD1 3.94Å; H145-D149 PolarHBondContact CE1-OD1 3.27Å; H145-D149 IonicContact CE1-OD2 2.68Å; H145-D149 PolarHBondContact CE1-OD2 3.36Å; H145-D149 IonicContact ND1-OD1 3.21Å; H145-D149 PolarHBondContact ND1-OD1 3.43Å; H145-D149 IonicContact ND1-OD2 3.84Å; H145-D149 PolarHBondContact ND1-OD2 3.19Å; H145-D149 PolarHBondContact O-N 3.42Å; H145-D149 VanDerWaalsContact O-OD1 3.13Å; L147-D149 VanDerWaalsContact C-N 3.32Å; L147-D149 PolarHBondContact O-N 3.11Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 VanDerWaalsContact O-CG 3.24Å; D149-L153 WeakPolarHBondContact O-CG 3.33Å; D149-L153 PolarHBondContact O-N 3.13Å
150	L	78.7	Confident	77.6	Confident	113 Å²	113	97.2 Å²	97.2	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-72.1	-32.9	178.9	-76.1	172.3	0	0	0	112.4	Q146 L147 D148 A154	Q146-L150 WeakPolarHBondContact O-CB 3.49Å; Q146-L150 WeakPolarHBondContact O-CD1 3.38Å; Q146-L150 WeakPolarHBondContact O-CG 3.24Å; Q146-L150 PolarHBondContact O-N 2.95Å; L147-L150 PolarHBondContact O-N 3.14Å; D148-L150 PolarHBondContact O-N 3.36Å; L150-A154 VanDerWaalsContact O-CB 3.27Å; L150-A154 WeakPolarHBondContact O-CB 3.18Å; L150-A154 PolarHBondContact O-N 2.95Å
151	E	79.4	Confident	76.9	Confident	63 Å²	63	101.7 Å²	101.7	29%	0.294	53%	0.526	S	S	.	.	H	α-helix	trans	-71.6	-42	174.2	-73.9	-176.5	-163.5	0	0	111.4	L147 D148 A154 Y155 P163 S164	L147-E151 WeakPolarHBondContact O-CB 3.48Å; L147-E151 WeakPolarHBondContact O-CG 3.31Å; L147-E151 PolarHBondContact O-N 2.99Å; D148-E151 PolarHBondContact O-N 3.4Å; E151-A154 PolarHBondContact O-N 2.9Å; E151-Y155 WeakPolarHBondContact O-CB 3.17Å; E151-Y155 PolarHBondContact O-N 3.42Å; E151-P163 HydrophobicContact CB-CB 4.04Å; E151-P163 HydrophobicContact CB-CG 4.48Å; E151-S164 PolarHBondContact OE1-OG 2.94Å; E151-S164 WeakPolarHBondContact OE2-CB 3.42Å; E151-S164 PolarHBondContact OE2-N 3.09Å; E151-S164 PolarHBondContact OE2-OG 3.45Å
152	E	80.3	Confident	76.3	Confident	67 Å²	67	101 Å²	101	31%	0.313	51%	0.514	S	S	.	.	H	α-helix	trans	-57.3	-53.2	171.2	-175.9	92.5	-83.8	0	0	110.7	D148 A154 Y155 E156 K166	D148-E152 WeakPolarHBondContact O-CB 3.43Å; D148-E152 PolarHBondContact O-N 3Å; E152-A154 VanDerWaalsContact C-N 3.28Å; E152-A154 PolarHBondContact O-N 3.04Å; E152-Y155 WeakPolarHBondContact O-CB 3.3Å; E152-Y155 PolarHBondContact O-N 3.06Å; E152-Y155 VanDerWaalsContact O-N 3.08Å; E152-E156 WeakPolarHBondContact O-CG 3.36Å; E152-E156 PolarHBondContact O-N 3.26Å; E152-K166 IonicContact OE1-NZ 2.77Å; E152-K166 PolarHBondContact OE1-NZ 3.35Å; E152-K166 IonicContact OE2-NZ 2.58Å; E152-K166 PolarHBondContact OE2-NZ 3.43Å
153	L	78.4	Confident	75.9	Confident	100 Å²	100	94.7 Å²	94.7	52%	0.524	49%	0.487	S	S	.	.	H	α-helix	trans	-62.5	-30.7	178.2	-73.2	170.1	0	0	0	113.6	D149 R157	D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 VanDerWaalsContact O-CG 3.24Å; D149-L153 WeakPolarHBondContact O-CG 3.33Å; D149-L153 PolarHBondContact O-N 3.13Å; L153-R157 PolarHBondContact O-N 3.39Å
154	A	76.1	Confident	75.5	Confident	36 Å²	36	93 Å²	93	30%	0.298	48%	0.483	S	S	.	.	H	α-helix	trans	-72.3	-38.9	173.9	0	0	0	0	0	111.8	L150 E151 E152 G158 A159 G160	L150-A154 VanDerWaalsContact O-CB 3.27Å; L150-A154 WeakPolarHBondContact O-CB 3.18Å; L150-A154 PolarHBondContact O-N 2.95Å; E151-A154 PolarHBondContact O-N 2.9Å; E152-A154 VanDerWaalsContact C-N 3.28Å; E152-A154 PolarHBondContact O-N 3.04Å; A154-G158 PolarHBondContact O-N 3.45Å; A154-A159 PolarHBondContact O-N 3.39Å; A154-G160 PolarHBondContact O-N 2.93Å
155	Y	78.2	Confident	75.2	Confident	112 Å²	112	87 Å²	87	44%	0.439	47%	0.466	S	S	.	.	H	α-helix	trans	-67.2	-46.1	176.2	-176.9	-108.2	0	0	0	111.9	E151 E152 R157 G158 E161 L162 P163	E151-Y155 WeakPolarHBondContact O-CB 3.17Å; E151-Y155 PolarHBondContact O-N 3.42Å; E152-Y155 WeakPolarHBondContact O-CB 3.3Å; E152-Y155 PolarHBondContact O-N 3.06Å; E152-Y155 VanDerWaalsContact O-N 3.08Å; Y155-R157 VanDerWaalsContact C-N 3.28Å; Y155-R157 PolarHBondContact O-N 3.29Å; Y155-G158 WeakPolarHBondContact O-CA 3.42Å; Y155-G158 PolarHBondContact O-N 3.28Å; Y155-E161 WeakPolarHBondContact CD2-O 3.45Å; Y155-L162 HydrophobicContact CE1-CD1 4.47Å; Y155-L162 HydrophobicContact CE2-CD1 3.93Å; Y155-P163 HydrophobicContact CD1-CG 4.46Å; Y155-P163 HydrophobicContact CG-CG 4.13Å
156	E	78.1	Confident	74.8	Confident	142 Å²	142	84.6 Å²	84.6	66%	0.664	45%	0.454	S	S	*	.	H	α-helix	trans	-59.9	-35.5	175.9	-72.2	-168.8	149.5	0	0	112.9	E152 G158	E152-E156 WeakPolarHBondContact O-CG 3.36Å; E152-E156 PolarHBondContact O-N 3.26Å; E156-G158 PolarHBondContact O-N 2.94Å
157	R	71.3	Confident	74.6	Confident	217 Å²	217	82.3 Å²	82.3	82%	0.819	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	0.5	173.1	-87.7	-178.4	164.2	168.7	-2.1	114.6	L153 Y155 A159	L153-R157 PolarHBondContact O-N 3.39Å; Y155-R157 VanDerWaalsContact C-N 3.28Å; Y155-R157 PolarHBondContact O-N 3.29Å; R157-A159 PolarHBondContact O-N 2.95Å
158	G	68.9	Low	74.4	Confident	72 Å²	72	82.6 Å²	82.6	74%	0.742	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	20.8	-179.1	0	0	0	0	0	114.1	A154 Y155 E156	A154-G158 PolarHBondContact O-N 3.45Å; Y155-G158 WeakPolarHBondContact O-CA 3.42Å; Y155-G158 PolarHBondContact O-N 3.28Å; E156-G158 PolarHBondContact O-N 2.94Å
159	A	60.9	Low	74.3	Confident	91 Å²	91	85.8 Å²	85.8	75%	0.752	46%	0.459	S	S	*	.			trans	-115.5	-14.4	-175.9	0	0	0	0	0	113.5	A154 R157	A154-A159 PolarHBondContact O-N 3.39Å; R157-A159 PolarHBondContact O-N 2.95Å
160	G	63.3	Low	74.1	Confident	30 Å²	30	87.8 Å²	87.8	31%	0.309	47%	0.465	S	S	.	.	S	Bend	trans	-98.6	163.2	175.6	0	0	0	0	0	113.5	A154	A154-G160 PolarHBondContact O-N 2.93Å
161	E	63.5	Low	74	Confident	178 Å²	178	87.2 Å²	87.2	83%	0.832	46%	0.459	S	S	*	.			trans	-75.5	177.8	164.4	-62.6	-176.8	171.1	0	0	109.8	Y155	Y155-E161 WeakPolarHBondContact CD2-O 3.45Å
162	L	68.3	Low	74	Confident	44 Å²	44	92.3 Å²	92.3	23%	0.23	48%	0.476	C	S	.	.	S	Bend	trans	-64.7	129.3	178.5	-175.8	76.9	0	0	0	109.9	Y155 K166 L167 K170	Y155-L162 HydrophobicContact CE1-CD1 4.47Å; Y155-L162 HydrophobicContact CE2-CD1 3.93Å; L162-K166 HydrophobicContact CD1-CB 4.39Å; L162-K166 HydrophobicContact CG-CB 4.33Å; L162-L167 HydrophobicContact CD2-CB 4.11Å; L162-L167 HydrophobicContact CD2-CG 4.48Å; L162-K170 HydrophobicContact CD2-CD 3.75Å
163	P	74	Confident	73.8	Confident	1 Å²	1	92.2 Å²	92.2	1%	0.006	49%	0.486	C	S	.	.			trans	-54.1	141.5	-176	-28.3	35.5	0	0	0	113.1	E151 Y155 S165 K166 L167	E151-P163 HydrophobicContact CB-CB 4.04Å; E151-P163 HydrophobicContact CB-CG 4.48Å; Y155-P163 HydrophobicContact CD1-CG 4.46Å; Y155-P163 HydrophobicContact CG-CG 4.13Å; P163-S165 VanDerWaalsContact C-N 3.27Å; P163-S165 PolarHBondContact O-N 2.87Å; P163-K166 CarbonylContact O-C 3.48Å; P163-K166 PolarHBondContact O-N 3.49Å; P163-L167 WeakPolarHBondContact O-CB 3.38Å; P163-L167 PolarHBondContact O-N 3.31Å
164	S	74.8	Confident	73.6	Confident	53 Å²	53	92.4 Å²	92.4	37%	0.371	49%	0.486	S	S	.	.	H	α-helix	trans	-55.1	-41.2	-173.1	-64.5	0	0	0	0	112.3	E151 L167 I168	E151-S164 PolarHBondContact OE1-OG 2.94Å; E151-S164 WeakPolarHBondContact OE2-CB 3.42Å; E151-S164 PolarHBondContact OE2-N 3.09Å; E151-S164 PolarHBondContact OE2-OG 3.45Å; S164-L167 PolarHBondContact O-N 3.03Å; S164-I168 WeakPolarHBondContact O-CB 3.36Å; S164-I168 WeakPolarHBondContact O-CD1 3.4Å; S164-I168 WeakPolarHBondContact O-CG1 3.41Å; S164-I168 PolarHBondContact O-N 3.48Å
165	S	75.3	Confident	73.3	Confident	42 Å²	42	94.8 Å²	94.8	29%	0.294	49%	0.493	S	S	.	.	H	α-helix	trans	-52.9	-58.5	170.1	44.1	0	0	0	0	112.5	D148 P163 L167 I168 E169	D148-S165 WeakPolarHBondContact OD1-CB 3.38Å; D148-S165 PolarHBondContact OD1-OG 2.86Å; P163-S165 VanDerWaalsContact C-N 3.27Å; P163-S165 PolarHBondContact O-N 2.87Å; S165-L167 VanDerWaalsContact C-N 3.26Å; S165-L167 PolarHBondContact O-N 2.88Å; S165-I168 PolarHBondContact O-N 3.19Å; S165-E169 WeakPolarHBondContact O-CG 3.28Å; S165-E169 PolarHBondContact O-N 2.88Å
166	K	73.7	Confident	73.1	Confident	70 Å²	70	93.2 Å²	93.2	30%	0.304	49%	0.493	S	S	.	.	H	α-helix	trans	-68.6	-22.1	-179	-63.2	178.8	-172.9	174.2	0	113.2	E152 L162 P163 K170	E152-K166 IonicContact OE1-NZ 2.77Å; E152-K166 PolarHBondContact OE1-NZ 3.35Å; E152-K166 IonicContact OE2-NZ 2.58Å; E152-K166 PolarHBondContact OE2-NZ 3.43Å; L162-K166 HydrophobicContact CD1-CB 4.39Å; L162-K166 HydrophobicContact CG-CB 4.33Å; P163-K166 CarbonylContact O-C 3.48Å; P163-K166 PolarHBondContact O-N 3.49Å; K166-K170 VanDerWaalsContact O-CG 3.32Å; K166-K170 WeakPolarHBondContact O-CG 3.43Å; K166-K170 PolarHBondContact O-N 3.01Å
167	L	78.3	Confident	72.5	Confident	67 Å²	67	92.6 Å²	92.6	35%	0.351	49%	0.489	S	S	.	.	H	α-helix	trans	-76.3	-45.3	172.2	-163.2	158.4	0	0	0	110.6	L162 P163 S164 S165 K170 Q171	L162-L167 HydrophobicContact CD2-CB 4.11Å; L162-L167 HydrophobicContact CD2-CG 4.48Å; P163-L167 WeakPolarHBondContact O-CB 3.38Å; P163-L167 PolarHBondContact O-N 3.31Å; S164-L167 PolarHBondContact O-N 3.03Å; S165-L167 VanDerWaalsContact C-N 3.26Å; S165-L167 PolarHBondContact O-N 2.88Å; L167-K170 PolarHBondContact O-N 3.45Å; L167-Q171 HydrophobicContact CD2-CG 4.1Å; L167-Q171 WeakPolarHBondContact O-CG 3.31Å; L167-Q171 PolarHBondContact O-N 2.9Å
168	I	78.8	Confident	72.1	Confident	104 Å²	104	86.3 Å²	86.3	53%	0.533	47%	0.471	S	S	.	.	H	α-helix	trans	-62.9	-40.3	173.5	-70.8	164.3	0	0	0	110.7	S164 S165 Q171 R172	S164-I168 WeakPolarHBondContact O-CB 3.36Å; S164-I168 WeakPolarHBondContact O-CD1 3.4Å; S164-I168 WeakPolarHBondContact O-CG1 3.41Å; S164-I168 PolarHBondContact O-N 3.48Å; S165-I168 PolarHBondContact O-N 3.19Å; I168-Q171 PolarHBondContact O-N 3.45Å; I168-R172 VanDerWaalsContact O-CB 3.28Å; I168-R172 WeakPolarHBondContact O-CB 3.4Å; I168-R172 PolarHBondContact O-N 2.62Å
169	E	79.9	Confident	71.7	Confident	127 Å²	127	86.5 Å²	86.5	59%	0.593	45%	0.453	S	S	*	.	H	α-helix	trans	-61	-44.9	173.8	-75.1	-176.1	150.3	0	0	112.4	S165 R172 A173	S165-E169 WeakPolarHBondContact O-CG 3.28Å; S165-E169 PolarHBondContact O-N 2.88Å; E169-R172 WeakPolarHBondContact O-CB 3.49Å; E169-R172 PolarHBondContact O-N 2.89Å; E169-A173 PolarHBondContact O-N 3.41Å
170	K	76.4	Confident	71.9	Confident	115 Å²	115	85.5 Å²	85.5	50%	0.5	45%	0.451	S	S	.	.	H	α-helix	trans	-65.9	-40.7	176	-74.1	174.8	-168.5	172	0	111.9	L162 K166 L167 R172 A173 I174	L162-K170 HydrophobicContact CD2-CD 3.75Å; K166-K170 VanDerWaalsContact O-CG 3.32Å; K166-K170 WeakPolarHBondContact O-CG 3.43Å; K166-K170 PolarHBondContact O-N 3.01Å; L167-K170 PolarHBondContact O-N 3.45Å; K170-R172 VanDerWaalsContact C-N 3.31Å; K170-R172 PolarHBondContact O-N 3.19Å; K170-A173 PolarHBondContact O-N 3.39Å; K170-I174 WeakPolarHBondContact O-CD1 3.37Å; K170-I174 VanDerWaalsContact O-CG1 3.26Å; K170-I174 WeakPolarHBondContact O-CG1 3.31Å; K170-I174 PolarHBondContact O-N 2.86Å
171	Q	76	Confident	71.6	Confident	101 Å²	101	89.2 Å²	89.2	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-60.8	-42.2	172.1	-76	179.8	-12.5	0	0	111.1	L167 I168 I174 I175	L167-Q171 HydrophobicContact CD2-CG 4.1Å; L167-Q171 WeakPolarHBondContact O-CG 3.31Å; L167-Q171 PolarHBondContact O-N 2.9Å; I168-Q171 PolarHBondContact O-N 3.45Å; Q171-I174 PolarHBondContact O-N 3Å; Q171-I175 VanDerWaalsContact O-CB 3.31Å; Q171-I175 WeakPolarHBondContact O-CB 3.31Å; Q171-I175 WeakPolarHBondContact O-CD1 3.4Å; Q171-I175 WeakPolarHBondContact O-CG1 3.46Å; Q171-I175 PolarHBondContact O-N 3.18Å
172	R	79.5	Confident	71.3	Confident	170 Å²	170	81.8 Å²	81.8	64%	0.642	43%	0.428	S	S	*	.	H	α-helix	trans	-63.3	-46.7	176.9	-166.2	179.5	-169.2	-179.1	6.5	111.7	I168 E169 K170 I174 I175 D176	I168-R172 VanDerWaalsContact O-CB 3.28Å; I168-R172 WeakPolarHBondContact O-CB 3.4Å; I168-R172 PolarHBondContact O-N 2.62Å; E169-R172 WeakPolarHBondContact O-CB 3.49Å; E169-R172 PolarHBondContact O-N 2.89Å; K170-R172 VanDerWaalsContact C-N 3.31Å; K170-R172 PolarHBondContact O-N 3.19Å; R172-I174 VanDerWaalsContact C-N 3.3Å; R172-I174 PolarHBondContact O-N 3.35Å; R172-I175 CarbonylContact O-C 3.58Å; R172-I175 PolarHBondContact O-N 2.87Å; R172-I175 VanDerWaalsContact O-N 3.1Å; R172-D176 WeakPolarHBondContact O-CB 3.38Å; R172-D176 PolarHBondContact O-N 3.34Å
173	A	76.6	Confident	70.7	Confident	64 Å²	64	85.5 Å²	85.5	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-61	-37.5	175.9	0	0	0	0	0	112.8	E169 K170 H177	E169-A173 PolarHBondContact O-N 3.41Å; K170-A173 PolarHBondContact O-N 3.39Å; A173-H177 WeakPolarHBondContact O-CB 3.31Å; A173-H177 PolarHBondContact O-N 2.89Å
174	I	74.3	Confident	69.9	Low	104 Å²	104	87.4 Å²	87.4	53%	0.533	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-45.3	172.3	-68.5	163.6	0	0	0	110.6	K170 Q171 R172 H177 L178	K170-I174 WeakPolarHBondContact O-CD1 3.37Å; K170-I174 VanDerWaalsContact O-CG1 3.26Å; K170-I174 WeakPolarHBondContact O-CG1 3.31Å; K170-I174 PolarHBondContact O-N 2.86Å; Q171-I174 PolarHBondContact O-N 3Å; R172-I174 VanDerWaalsContact C-N 3.3Å; R172-I174 PolarHBondContact O-N 3.35Å; I174-H177 PolarHBondContact O-N 2.97Å; I174-L178 HydrophobicContact CG2-CD1 3.88Å; I174-L178 HydrophobicContact CG2-CG 4.46Å; I174-L178 WeakPolarHBondContact O-CB 3.37Å; I174-L178 VanDerWaalsContact O-CG 3.25Å; I174-L178 WeakPolarHBondContact O-CG 3.49Å; I174-L178 PolarHBondContact O-N 3.39Å
175	I	69.1	Low	68.7	Low	87 Å²	87	91.2 Å²	91.2	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-38.9	178.6	-76.4	164.2	0	0	0	111.7	Q171 R172 L178 Q179	Q171-I175 VanDerWaalsContact O-CB 3.31Å; Q171-I175 WeakPolarHBondContact O-CB 3.31Å; Q171-I175 WeakPolarHBondContact O-CD1 3.4Å; Q171-I175 WeakPolarHBondContact O-CG1 3.46Å; Q171-I175 PolarHBondContact O-N 3.18Å; R172-I175 CarbonylContact O-C 3.58Å; R172-I175 PolarHBondContact O-N 2.87Å; R172-I175 VanDerWaalsContact O-N 3.1Å; I175-L178 PolarHBondContact O-N 2.72Å; I175-Q179 VanDerWaalsContact CG2-NE2 3.35Å; I175-Q179 VanDerWaalsContact O-CG 3.32Å; I175-Q179 WeakPolarHBondContact O-CG 3.36Å; I175-Q179 PolarHBondContact O-N 2.98Å; I175-Q179 PolarHBondContact O-NE2 2.97Å; I175-Q179 VanDerWaalsContact O-NE2 3.12Å
176	D	73.3	Confident	67.8	Low	79 Å²	79	91.8 Å²	91.8	42%	0.422	48%	0.48	S	S	.	.	H	α-helix	trans	-73	-36.6	177.7	-66.2	-19.7	0	0	0	111.4	R172 Q179 G180	R172-D176 WeakPolarHBondContact O-CB 3.38Å; R172-D176 PolarHBondContact O-N 3.34Å; D176-Q179 PolarHBondContact O-N 2.86Å; D176-Q179 PolarHBondContact OD1-NE2 3.15Å; D176-G180 PolarHBondContact O-N 3.42Å
177	H	66.6	Low	67	Low	128 Å²	128	95.8 Å²	95.8	59%	0.593	51%	0.505	S	S	*	.	H	α-helix	trans	-66.2	-40.1	171	-170.3	64.9	0	0	0	112	A173 I174 G180 M181	A173-H177 WeakPolarHBondContact O-CB 3.31Å; A173-H177 PolarHBondContact O-N 2.89Å; I174-H177 PolarHBondContact O-N 2.97Å; H177-G180 PolarHBondContact O-N 3.42Å; H177-M181 PolarHBondContact O-N 3.02Å
178	L	63.1	Low	65.8	Low	85 Å²	85	98.4 Å²	98.4	45%	0.445	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-39.4	174.6	-71.9	170.4	0	0	0	112.1	I174 I175 G180 M181 L182	I174-L178 HydrophobicContact CG2-CD1 3.88Å; I174-L178 HydrophobicContact CG2-CG 4.46Å; I174-L178 WeakPolarHBondContact O-CB 3.37Å; I174-L178 VanDerWaalsContact O-CG 3.25Å; I174-L178 WeakPolarHBondContact O-CG 3.49Å; I174-L178 PolarHBondContact O-N 3.39Å; I175-L178 PolarHBondContact O-N 2.72Å; L178-G180 VanDerWaalsContact C-N 3.29Å; L178-G180 PolarHBondContact O-N 2.68Å; L178-M181 CarbonylContact O-C 3.56Å; L178-M181 PolarHBondContact O-N 3.27Å; L178-M181 VanDerWaalsContact O-N 3.07Å; L178-L182 WeakPolarHBondContact O-CB 3.27Å; L178-L182 PolarHBondContact O-N 3.23Å
179	Q	60	Low	64.5	Low	77 Å²	77	97.9 Å²	97.9	36%	0.36	51%	0.513	S	S	.	.	H	α-helix	trans	-58.7	-39.9	169	-77.9	166.7	78.5	0	0	111.9	I175 D176 M181 L182 L186	I175-Q179 VanDerWaalsContact CG2-NE2 3.35Å; I175-Q179 VanDerWaalsContact O-CG 3.32Å; I175-Q179 WeakPolarHBondContact O-CG 3.36Å; I175-Q179 PolarHBondContact O-N 2.98Å; I175-Q179 PolarHBondContact O-NE2 2.97Å; I175-Q179 VanDerWaalsContact O-NE2 3.12Å; D176-Q179 PolarHBondContact O-N 2.86Å; D176-Q179 PolarHBondContact OD1-NE2 3.15Å; Q179-M181 PolarHBondContact O-N 3.16Å; Q179-L182 CarbonylContact O-C 3.54Å; Q179-L182 PolarHBondContact O-N 3.16Å; Q179-L186 VanDerWaalsContact CD-CD1 3.45Å; Q179-L186 HydrophobicContact CG-CD1 3.65Å
180	G	64.6	Low	63.3	Low	69 Å²	69	100 Å²	100	71%	0.711	53%	0.529	S	S	*	.	H	α-helix	trans	-62.5	-24.2	174.2	0	0	0	0	0	114.1	D176 H177 L178	D176-G180 PolarHBondContact O-N 3.42Å; H177-G180 PolarHBondContact O-N 3.42Å; L178-G180 VanDerWaalsContact C-N 3.29Å; L178-G180 PolarHBondContact O-N 2.68Å
181	M	57.4	Low	62.3	Low	109 Å²	109	105 Å²	105	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-101.1	-17	177.6	-64.5	-165.3	74.2	0	0	114.4	H177 L178 Q179	H177-M181 PolarHBondContact O-N 3.02Å; L178-M181 CarbonylContact O-C 3.56Å; L178-M181 PolarHBondContact O-N 3.27Å; L178-M181 VanDerWaalsContact O-N 3.07Å; Q179-M181 PolarHBondContact O-N 3.16Å
182	L	57.4	Low	61.1	Low	21 Å²	21	103.6 Å²	103.6	11%	0.11	54%	0.539	C	S	.	.	S	Bend	trans	-132.7	108.6	-176.6	-73	142.9	0	0	0	109.5	L178 Q179 I184 A204 L205	L178-L182 WeakPolarHBondContact O-CB 3.27Å; L178-L182 PolarHBondContact O-N 3.23Å; Q179-L182 CarbonylContact O-C 3.54Å; Q179-L182 PolarHBondContact O-N 3.16Å; L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 HydrophobicContact CB-CD1 4.11Å; L182-I184 HydrophobicContact CB-CG1 4.25Å; L182-I184 PolarHBondContact O-N 3.36Å; L182-A204 HydrophobicContact CD2-CB 3.74Å; L182-L205 HydrophobicContact CD2-CD1 4.19Å
183	P	55.5	Low	60.1	Low	123 Å²	123	98 Å²	98	80%	0.799	53%	0.527	S	S	*	.			trans	-73.9	78.8	-177.9	30.9	-35.7	0	0	0	111.5
184	I	57.4	Low	58.9	Low	40 Å²	40	99.1 Å²	99.1	21%	0.205	53%	0.531	C	S	.	.			trans	-108.1	121.1	177.8	-59.8	173.8	0	0	0	108.1	L182 L186	L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 HydrophobicContact CB-CD1 4.11Å; L182-I184 HydrophobicContact CB-CG1 4.25Å; L182-I184 PolarHBondContact O-N 3.36Å; I184-L186 HydrophobicContact CG2-CD2 3.77Å; I184-L186 HydrophobicContact CG2-CG 4.34Å; I184-L186 PolarHBondContact O-N 3.41Å
185	N	49.7	Very low	58.3	Low	133 Å²	133	100.6 Å²	100.6	71%	0.711	54%	0.535	S	S	*	.			trans	-83.5	80.3	-177.1	-71.3	-77.7	0	0	0	110.7	N187	N185-N187 PolarHBondContact O-N 3.38Å
186	L	56.6	Low	58	Low	55 Å²	55	100 Å²	100	29%	0.288	53%	0.531	S	S	.	.			trans	-62.4	-3.4	-175.5	-61.7	175.2	0	0	0	115.3	Q179 I184 Q188 L189	Q179-L186 VanDerWaalsContact CD-CD1 3.45Å; Q179-L186 HydrophobicContact CG-CD1 3.65Å; I184-L186 HydrophobicContact CG2-CD2 3.77Å; I184-L186 HydrophobicContact CG2-CG 4.34Å; I184-L186 PolarHBondContact O-N 3.41Å; L186-Q188 PolarHBondContact O-N 3.02Å; L186-L189 HydrophobicContact CD2-CD1 3.86Å; L186-L189 PolarHBondContact O-N 3.49Å; L186-L189 VanDerWaalsContact O-N 3.14Å
187	N	55.9	Low	57.4	Low	153 Å²	153	99.5 Å²	99.5	82%	0.818	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	8.3	178.8	-62.4	-15.6	0	0	0	115.1	N185	N185-N187 PolarHBondContact O-N 3.38Å
188	Q	53.1	Low	57.2	Low	123 Å²	123	98.5 Å²	98.5	58%	0.575	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	17.9	177.3	-56.9	-169.8	20.2	0	0	113.2	L186 D190 R191 L192	L186-Q188 PolarHBondContact O-N 3.02Å; Q188-D190 VanDerWaalsContact C-N 3.26Å; Q188-D190 PolarHBondContact O-N 3.31Å; Q188-R191 PolarHBondContact O-N 3.4Å; Q188-L192 HydrophobicContact CB-CD1 4.36Å
189	L	52.8	Low	57.4	Low	93 Å²	93	102 Å²	102	49%	0.487	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-56.9	-35.3	-172.1	-146.9	66.1	0	0	0	113.8	L186 R191 L197	L186-L189 HydrophobicContact CD2-CD1 3.86Å; L186-L189 PolarHBondContact O-N 3.49Å; L186-L189 VanDerWaalsContact O-N 3.14Å; L189-R191 PolarHBondContact O-N 3.49Å; L189-R191 VanDerWaalsContact O-N 3.09Å; L189-L197 HydrophobicContact CD1-CD1 4.12Å; L189-L197 HydrophobicContact CD1-CD2 4.36Å
190	D	54.9	Low	57.5	Low	172 Å²	172	103.9 Å²	103.9	92%	0.92	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-65.8	-6.3	176.5	-72.6	-18.4	0	0	0	114.9	Q188	Q188-D190 VanDerWaalsContact C-N 3.26Å; Q188-D190 PolarHBondContact O-N 3.31Å
191	R	55.2	Low	57.2	Low	220 Å²	220	104.6 Å²	104.6	83%	0.83	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-117.3	-8.1	-175.8	-67.8	-172.1	175.3	-169.1	-1.2	115	Q188 L189	Q188-R191 PolarHBondContact O-N 3.4Å; L189-R191 PolarHBondContact O-N 3.49Å; L189-R191 VanDerWaalsContact O-N 3.09Å
192	L	51.2	Low	57.5	Low	70 Å²	70	104.4 Å²	104.4	37%	0.366	53%	0.526	S	S	.	.			trans	-108.3	132.2	-172.1	-71.8	163.7	0	0	0	110.9	Q188 E196	Q188-L192 HydrophobicContact CB-CD1 4.36Å; L192-E196 HydrophobicContact CD2-CB 4.12Å
193	S	56.9	Low	58.1	Low	54 Å²	54	105 Å²	105	38%	0.378	54%	0.537	S	S	.	.			trans	-71.9	158.3	175.1	68.1	0	0	0	0	111.6	E195 E196 L197	S193-E195 PolarHBondContact O-N 3.18Å; S193-E195 VanDerWaalsContact O-N 3.13Å; S193-E196 VanDerWaalsContact CB-OE2 3.31Å; S193-E196 WeakPolarHBondContact CB-OE2 3.47Å; S193-E196 PolarHBondContact N-OE2 2.89Å; S193-E196 PolarHBondContact O-N 2.95Å; S193-E196 VanDerWaalsContact OG-CD 3.22Å; S193-E196 WeakPolarHBondContact OG-CG 3.39Å; S193-E196 PolarHBondContact OG-OE2 3.41Å; S193-L197 PolarHBondContact O-N 3.45Å
194	S	52.7	Low	58.5	Low	87 Å²	87	100.1 Å²	100.1	61%	0.608	51%	0.507	S	S	*	.	H	α-helix	trans	-53.4	-35.4	178.1	-167.6	0	0	0	0	112.7	Q198	S194-Q198 WeakPolarHBondContact O-CB 3.47Å; S194-Q198 VanDerWaalsContact O-CG 3.3Å; S194-Q198 WeakPolarHBondContact O-CG 3.24Å; S194-Q198 PolarHBondContact O-N 2.95Å
195	E	61.6	Low	58.8	Low	135 Å²	135	101.9 Å²	101.9	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-77.1	-18.8	179.4	-58.9	-177.3	-177.9	0	0	113.8	S193 R199	S193-E195 PolarHBondContact O-N 3.18Å; S193-E195 VanDerWaalsContact O-N 3.13Å; E195-R199 WeakPolarHBondContact O-CG 3.25Å; E195-R199 PolarHBondContact O-N 3.06Å; E195-R199 PolarHBondContact O-NE 3.41Å
196	E	62.1	Low	59.6	Low	75 Å²	75	102.5 Å²	102.5	35%	0.35	51%	0.513	S	S	.	.	H	α-helix	trans	-86.2	-42.9	174.4	-71.9	162.9	141.2	0	0	110.4	L192 S193 Q198 R199 E200	L192-E196 HydrophobicContact CD2-CB 4.12Å; S193-E196 VanDerWaalsContact CB-OE2 3.31Å; S193-E196 WeakPolarHBondContact CB-OE2 3.47Å; S193-E196 PolarHBondContact N-OE2 2.89Å; S193-E196 PolarHBondContact O-N 2.95Å; S193-E196 VanDerWaalsContact OG-CD 3.22Å; S193-E196 WeakPolarHBondContact OG-CG 3.39Å; S193-E196 PolarHBondContact OG-OE2 3.41Å; E196-Q198 VanDerWaalsContact C-N 3.31Å; E196-Q198 PolarHBondContact O-N 3.09Å; E196-R199 PolarHBondContact O-N 3.07Å; E196-R199 VanDerWaalsContact O-N 3.11Å; E196-E200 PolarHBondContact O-N 3.22Å
197	L	60.8	Low	60	Low	67 Å²	67	108 Å²	108	35%	0.351	53%	0.534	S	S	.	.	H	α-helix	trans	-58	-42.8	171.4	-175	64.5	0	0	0	111.5	L189 S193 E200 M201	L189-L197 HydrophobicContact CD1-CD1 4.12Å; L189-L197 HydrophobicContact CD1-CD2 4.36Å; S193-L197 PolarHBondContact O-N 3.45Å; L197-E200 PolarHBondContact O-N 2.9Å; L197-M201 VanDerWaalsContact O-CB 3.28Å; L197-M201 WeakPolarHBondContact O-CB 3.37Å; L197-M201 PolarHBondContact O-N 3.49Å
198	Q	62.4	Low	60.3	Low	108 Å²	108	104.7 Å²	104.7	51%	0.505	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-40.4	173.6	-78.2	178.2	-5.7	0	0	112.8	S194 E196 M201 D202	S194-Q198 WeakPolarHBondContact O-CB 3.47Å; S194-Q198 VanDerWaalsContact O-CG 3.3Å; S194-Q198 WeakPolarHBondContact O-CG 3.24Å; S194-Q198 PolarHBondContact O-N 2.95Å; E196-Q198 VanDerWaalsContact C-N 3.31Å; E196-Q198 PolarHBondContact O-N 3.09Å; Q198-M201 PolarHBondContact O-N 3.24Å; Q198-D202 WeakPolarHBondContact O-CB 3.37Å; Q198-D202 PolarHBondContact O-N 3.15Å
199	R	66.8	Low	60.8	Low	158 Å²	158	101.4 Å²	101.4	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-69.6	-36.9	178.8	-80.7	-179.6	-74.6	150.5	-9.8	113.2	E195 E196 G203	E195-R199 WeakPolarHBondContact O-CG 3.25Å; E195-R199 PolarHBondContact O-N 3.06Å; E195-R199 PolarHBondContact O-NE 3.41Å; E196-R199 PolarHBondContact O-N 3.07Å; E196-R199 VanDerWaalsContact O-N 3.11Å; R199-G203 PolarHBondContact O-N 3.18Å
200	E	63	Low	61.4	Low	116 Å²	116	101.2 Å²	101.2	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-44.6	170.4	-75.4	-127.6	123.6	0	0	111.5	E196 L197 G203 A204	E196-E200 PolarHBondContact O-N 3.22Å; L197-E200 PolarHBondContact O-N 2.9Å; E200-G203 PolarHBondContact O-N 3.24Å; E200-A204 WeakPolarHBondContact O-CB 3.45Å; E200-A204 PolarHBondContact O-N 3.48Å
201	M	58	Low	62.1	Low	85 Å²	85	96.2 Å²	96.2	42%	0.419	48%	0.481	S	S	.	.	H	α-helix	trans	-59.5	-49.9	178.3	-173.8	-176.9	71.7	0	0	111.8	L197 Q198 G203 A204 L205	L197-M201 VanDerWaalsContact O-CB 3.28Å; L197-M201 WeakPolarHBondContact O-CB 3.37Å; L197-M201 PolarHBondContact O-N 3.49Å; Q198-M201 PolarHBondContact O-N 3.24Å; M201-G203 VanDerWaalsContact C-N 3.32Å; M201-G203 PolarHBondContact O-N 3.18Å; M201-A204 PolarHBondContact O-N 3.1Å; M201-L205 HydrophobicContact CG-CD1 4.34Å; M201-L205 WeakPolarHBondContact O-CB 3.3Å; M201-L205 PolarHBondContact O-N 3.12Å
202	D	62.8	Low	62.7	Low	105 Å²	105	90.8 Å²	90.8	56%	0.561	47%	0.467	S	S	*	.	H	α-helix	trans	-62.3	-39.1	175	-85.6	-12	0	0	0	111.8	Q198 K206	Q198-D202 WeakPolarHBondContact O-CB 3.37Å; Q198-D202 PolarHBondContact O-N 3.15Å; D202-K206 WeakPolarHBondContact O-CB 3.4Å; D202-K206 PolarHBondContact O-N 2.97Å
203	G	71.2	Confident	63.5	Low	32 Å²	32	93.2 Å²	93.2	33%	0.33	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-41.6	175.3	0	0	0	0	0	112.9	R199 E200 M201 K207	R199-G203 PolarHBondContact O-N 3.18Å; E200-G203 PolarHBondContact O-N 3.24Å; M201-G203 VanDerWaalsContact C-N 3.32Å; M201-G203 PolarHBondContact O-N 3.18Å; G203-K207 WeakPolarHBondContact O-CG 3.45Å; G203-K207 PolarHBondContact O-N 3.38Å
204	A	63	Low	64.2	Low	21 Å²	21	95.1 Å²	95.1	17%	0.174	48%	0.484	C	S	.	.	H	α-helix	trans	-71	-46.3	176.3	0	0	0	0	0	111.8	L182 E200 M201 K206 K207 L208	L182-A204 HydrophobicContact CD2-CB 3.74Å; E200-A204 WeakPolarHBondContact O-CB 3.45Å; E200-A204 PolarHBondContact O-N 3.48Å; M201-A204 PolarHBondContact O-N 3.1Å; A204-K206 VanDerWaalsContact C-N 3.29Å; A204-K206 PolarHBondContact O-N 3.49Å; A204-K207 WeakPolarHBondContact O-CB 3.5Å; A204-K207 PolarHBondContact O-N 3.36Å; A204-L208 PolarHBondContact O-N 2.99Å
205	L	64.6	Low	65.2	Low	77 Å²	77	98.1 Å²	98.1	40%	0.403	49%	0.486	S	S	.	.	H	α-helix	trans	-57.6	-42.9	174.9	-118.3	98.7	0	0	0	111.4	L182 M201 K207 L208 V209	L182-L205 HydrophobicContact CD2-CD1 4.19Å; M201-L205 HydrophobicContact CG-CD1 4.34Å; M201-L205 WeakPolarHBondContact O-CB 3.3Å; M201-L205 PolarHBondContact O-N 3.12Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 2.84Å; L205-L208 PolarHBondContact O-N 3.13Å; L205-L208 VanDerWaalsContact O-N 3.09Å; L205-V209 WeakPolarHBondContact O-CB 3.44Å; L205-V209 WeakPolarHBondContact O-CG2 3.31Å; L205-V209 PolarHBondContact O-N 3.23Å
206	K	66.7	Low	66	Low	146 Å²	146	96.8 Å²	96.8	64%	0.635	48%	0.48	S	S	*	.	H	α-helix	trans	-66.6	-35	-180	-160.8	168.7	-168.4	170.9	0	112.1	D202 A204 L208 N210	D202-K206 WeakPolarHBondContact O-CB 3.4Å; D202-K206 PolarHBondContact O-N 2.97Å; A204-K206 VanDerWaalsContact C-N 3.29Å; A204-K206 PolarHBondContact O-N 3.49Å; K206-L208 VanDerWaalsContact C-N 3.35Å; K206-N210 VanDerWaalsContact O-CB 3.27Å; K206-N210 WeakPolarHBondContact O-CB 3.36Å; K206-N210 PolarHBondContact O-N 3.19Å; K206-N210 PolarHBondContact O-ND2 3.06Å; K206-N210 PolarHBondContact O-OD1 3.28Å
207	K	65.1	Low	66.7	Low	170 Å²	170	99.2 Å²	99.2	74%	0.739	49%	0.491	S	S	*	.	H	α-helix	trans	-65.2	-35.4	169.7	-74.1	172.5	-177.7	173.9	0	112.5	G203 A204 L205 P211	G203-K207 WeakPolarHBondContact O-CG 3.45Å; G203-K207 PolarHBondContact O-N 3.38Å; A204-K207 WeakPolarHBondContact O-CB 3.5Å; A204-K207 PolarHBondContact O-N 3.36Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 2.84Å; K207-P211 WeakPolarHBondContact O-CD 3.2Å
208	L	60.9	Low	67.7	Low	84 Å²	84	100.6 Å²	100.6	44%	0.44	50%	0.498	S	S	.	.	H	α-helix	trans	-77.9	-37.3	179.4	-159.5	76.5	0	0	0	112.9	A204 L205 K206 P211	A204-L208 PolarHBondContact O-N 2.99Å; L205-L208 PolarHBondContact O-N 3.13Å; L205-L208 VanDerWaalsContact O-N 3.09Å; K206-L208 VanDerWaalsContact C-N 3.35Å; L208-P211 WeakPolarHBondContact O-CD 3.34Å; L208-P211 WeakPolarHBondContact O-CG 3.38Å
209	V	64.2	Low	68.6	Low	55 Å²	55	99.6 Å²	99.6	33%	0.333	50%	0.5	S	S	.	.	H	α-helix	trans	-81.8	-31	-177.4	172.4	0	0	0	0	112.9	L205 I212 K213	L205-V209 WeakPolarHBondContact O-CB 3.44Å; L205-V209 WeakPolarHBondContact O-CG2 3.31Å; L205-V209 PolarHBondContact O-N 3.23Å; V209-I212 WeakPolarHBondContact O-CB 3.32Å; V209-I212 PolarHBondContact O-N 2.65Å; V209-K213 HydrophobicContact CG1-CD 4.08Å; V209-K213 HydrophobicContact CG1-CG 4.16Å; V209-K213 PolarHBondContact O-N 3.2Å
210	N	65.2	Low	69.3	Low	89 Å²	89	97 Å²	97	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-53.4	-51.8	176.2	-82.4	-4.9	0	0	0	114.2	K206 I212 K213 V214	K206-N210 VanDerWaalsContact O-CB 3.27Å; K206-N210 WeakPolarHBondContact O-CB 3.36Å; K206-N210 PolarHBondContact O-N 3.19Å; K206-N210 PolarHBondContact O-ND2 3.06Å; K206-N210 PolarHBondContact O-OD1 3.28Å; N210-I212 PolarHBondContact O-N 3.08Å; N210-K213 PolarHBondContact O-N 2.95Å; N210-V214 WeakPolarHBondContact O-CG2 3.31Å; N210-V214 PolarHBondContact O-N 3.26Å
211	P	69.8	Low	70.2	Confident	67 Å²	67	97.2 Å²	97.2	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-23.5	179	26.8	-35.5	0	0	0	113.2	K207 L208 K215	K207-P211 WeakPolarHBondContact O-CD 3.2Å; L208-P211 WeakPolarHBondContact O-CD 3.34Å; L208-P211 WeakPolarHBondContact O-CG 3.38Å; P211-K215 WeakPolarHBondContact O-CB 3.48Å; P211-K215 VanDerWaalsContact O-CG 3.29Å; P211-K215 WeakPolarHBondContact O-CG 3.48Å; P211-K215 PolarHBondContact O-N 2.71Å; P211-K215 VanDerWaalsContact O-N 3.13Å
212	I	67	Low	71.5	Confident	105 Å²	105	97.3 Å²	97.3	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-68.9	-50.8	171.8	-60.5	174.6	0	0	0	109.4	V209 N210 V214 K215 E216	V209-I212 WeakPolarHBondContact O-CB 3.32Å; V209-I212 PolarHBondContact O-N 2.65Å; N210-I212 PolarHBondContact O-N 3.08Å; I212-V214 VanDerWaalsContact C-N 3.34Å; I212-V214 PolarHBondContact O-N 2.79Å; I212-K215 PolarHBondContact O-N 2.84Å; I212-E216 WeakPolarHBondContact O-CB 3.28Å; I212-E216 PolarHBondContact O-N 3.24Å
213	K	68.1	Low	72.4	Confident	121 Å²	121	98.3 Å²	98.3	53%	0.526	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-38.2	178.1	-71.6	-174.6	174.5	-176.1	0	113.3	V209 N210 E216 Q217	V209-K213 HydrophobicContact CG1-CD 4.08Å; V209-K213 HydrophobicContact CG1-CG 4.16Å; V209-K213 PolarHBondContact O-N 3.2Å; N210-K213 PolarHBondContact O-N 2.95Å; K213-E216 PolarHBondContact O-N 3.06Å; K213-Q217 WeakPolarHBondContact O-CB 3.43Å; K213-Q217 WeakPolarHBondContact O-CG 3.46Å; K213-Q217 PolarHBondContact O-N 3.1Å
214	V	73.1	Confident	73.1	Confident	95 Å²	95	100.8 Å²	100.8	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-66.4	-40.6	175.4	172.5	0	0	0	0	111.3	N210 I212 L218	N210-V214 WeakPolarHBondContact O-CG2 3.31Å; N210-V214 PolarHBondContact O-N 3.26Å; I212-V214 VanDerWaalsContact C-N 3.34Å; I212-V214 PolarHBondContact O-N 2.79Å; V214-L218 WeakPolarHBondContact O-CB 3.14Å; V214-L218 PolarHBondContact O-N 3.03Å
215	K	73	Confident	74.1	Confident	150 Å²	150	105.3 Å²	105.3	65%	0.652	53%	0.525	S	S	*	.	H	α-helix	trans	-64.7	-41.3	173	-77	177.1	178.2	-175.9	0	112.1	P211 I212 L218 V219	P211-K215 WeakPolarHBondContact O-CB 3.48Å; P211-K215 VanDerWaalsContact O-CG 3.29Å; P211-K215 WeakPolarHBondContact O-CG 3.48Å; P211-K215 PolarHBondContact O-N 2.71Å; P211-K215 VanDerWaalsContact O-N 3.13Å; I212-K215 PolarHBondContact O-N 2.84Å; K215-L218 PolarHBondContact O-N 2.86Å; K215-V219 WeakPolarHBondContact O-CG2 3.47Å; K215-V219 PolarHBondContact O-N 3.03Å
216	E	77.9	Confident	75	Confident	107 Å²	107	106 Å²	106	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-44.5	177.5	-171.7	178	-168.1	0	0	111.7	I212 K213 V219 Q220	I212-E216 WeakPolarHBondContact O-CB 3.28Å; I212-E216 PolarHBondContact O-N 3.24Å; K213-E216 PolarHBondContact O-N 3.06Å; E216-V219 PolarHBondContact O-N 3.28Å; E216-Q220 WeakPolarHBondContact O-CG 3.41Å; E216-Q220 PolarHBondContact O-N 3.34Å
217	Q	76.8	Confident	75.9	Confident	125 Å²	125	102.9 Å²	102.9	58%	0.584	52%	0.521	S	S	*	.	H	α-helix	trans	-63.5	-39.2	173.2	-74.1	-176.8	-43.3	0	0	112.6	K213 Q220 Q221	K213-Q217 WeakPolarHBondContact O-CB 3.43Å; K213-Q217 WeakPolarHBondContact O-CG 3.46Å; K213-Q217 PolarHBondContact O-N 3.1Å; Q217-Q220 PolarHBondContact O-N 2.94Å; Q217-Q221 WeakPolarHBondContact O-CG 3.43Å; Q217-Q221 PolarHBondContact O-N 2.88Å
218	L	81.6	Confident	76.7	Confident	96 Å²	96	99.2 Å²	99.2	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.3	-171	72.3	0	0	0	111.7	V214 K215 Q221 L222	V214-L218 WeakPolarHBondContact O-CB 3.14Å; V214-L218 PolarHBondContact O-N 3.03Å; K215-L218 PolarHBondContact O-N 2.86Å; L218-Q221 PolarHBondContact O-N 3.39Å; L218-L222 HydrophobicContact CG-CD1 4.27Å; L218-L222 WeakPolarHBondContact O-CG 3.45Å; L218-L222 PolarHBondContact O-N 3.23Å
219	V	81.6	Confident	77.9	Confident	88 Å²	88	100.3 Å²	100.3	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-43.5	174.2	168.5	0	0	0	0	110.8	K215 E216 Q221 L222 Q223	K215-V219 WeakPolarHBondContact O-CG2 3.47Å; K215-V219 PolarHBondContact O-N 3.03Å; E216-V219 PolarHBondContact O-N 3.28Å; V219-Q221 VanDerWaalsContact C-N 3.35Å; V219-Q221 PolarHBondContact O-N 2.69Å; V219-L222 PolarHBondContact O-N 2.94Å; V219-Q223 VanDerWaalsContact O-CB 3.25Å; V219-Q223 WeakPolarHBondContact O-CB 3.44Å; V219-Q223 PolarHBondContact O-N 3.4Å
220	Q	81.7	Confident	78.8	Confident	103 Å²	103	103.4 Å²	103.4	48%	0.481	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-39.5	174.7	-71.9	174.4	9.9	0	0	112.2	E216 Q217 T224	E216-Q220 WeakPolarHBondContact O-CG 3.41Å; E216-Q220 PolarHBondContact O-N 3.34Å; Q217-Q220 PolarHBondContact O-N 2.94Å; Q220-T224 WeakPolarHBondContact O-CB 3.48Å; Q220-T224 PolarHBondContact O-N 2.89Å; Q220-T224 PolarHBondContact O-OG1 3.16Å
221	Q	82.4	Confident	79.4	Confident	121 Å²	121	107.8 Å²	107.8	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-47.5	173.9	-78.1	-174.4	-35.1	0	0	112.2	Q217 L218 V219 T224 Q225	Q217-Q221 WeakPolarHBondContact O-CG 3.43Å; Q217-Q221 PolarHBondContact O-N 2.88Å; L218-Q221 PolarHBondContact O-N 3.39Å; V219-Q221 VanDerWaalsContact C-N 3.35Å; V219-Q221 PolarHBondContact O-N 2.69Å; Q221-T224 PolarHBondContact O-N 2.99Å; Q221-Q225 WeakPolarHBondContact O-CG 3.15Å; Q221-Q225 PolarHBondContact O-N 3.09Å
222	L	85	Confident	80	Confident	87 Å²	87	110 Å²	110	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-63.7	-41.5	177.9	-72	168.3	0	0	0	111.8	L218 V219 T224 Q225 I226	L218-L222 HydrophobicContact CG-CD1 4.27Å; L218-L222 WeakPolarHBondContact O-CG 3.45Å; L218-L222 PolarHBondContact O-N 3.23Å; V219-L222 PolarHBondContact O-N 2.94Å; L222-T224 VanDerWaalsContact C-N 3.33Å; L222-T224 PolarHBondContact O-N 3.47Å; L222-Q225 PolarHBondContact O-N 3.49Å; L222-I226 VanDerWaalsContact O-CG1 3.32Å; L222-I226 WeakPolarHBondContact O-CG1 3.46Å; L222-I226 PolarHBondContact O-N 2.78Å
223	Q	82.4	Confident	80.5	Confident	125 Å²	125	108.2 Å²	108.2	58%	0.584	53%	0.532	S	S	*	.	H	α-helix	trans	-64.3	-37.7	176	-168.6	173.2	17.6	0	0	111.8	V219 I226 V227	V219-Q223 VanDerWaalsContact O-CB 3.25Å; V219-Q223 WeakPolarHBondContact O-CB 3.44Å; V219-Q223 PolarHBondContact O-N 3.4Å; Q223-I226 PolarHBondContact O-N 3.48Å; Q223-V227 WeakPolarHBondContact O-CG2 3.44Å; Q223-V227 PolarHBondContact O-N 2.94Å; Q223-V227 VanDerWaalsContact O-N 3.14Å
224	T	85.1	Confident	80.9	Confident	85 Å²	85	111.1 Å²	111.1	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-65.3	-43	173.1	-54.9	0	0	0	0	111.3	Q220 Q221 L222 I226 V227 D228	Q220-T224 WeakPolarHBondContact O-CB 3.48Å; Q220-T224 PolarHBondContact O-N 2.89Å; Q220-T224 PolarHBondContact O-OG1 3.16Å; Q221-T224 PolarHBondContact O-N 2.99Å; L222-T224 VanDerWaalsContact C-N 3.33Å; L222-T224 PolarHBondContact O-N 3.47Å; T224-I226 PolarHBondContact O-N 2.8Å; T224-V227 PolarHBondContact O-N 3.33Å; T224-D228 PolarHBondContact O-N 3.04Å
225	Q	84.8	Confident	81.1	Confident	116 Å²	116	114 Å²	114	54%	0.542	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.4	-73.8	176.8	3.4	0	0	112.5	Q221 L222 D228 L229	Q221-Q225 WeakPolarHBondContact O-CG 3.15Å; Q221-Q225 PolarHBondContact O-N 3.09Å; L222-Q225 PolarHBondContact O-N 3.49Å; Q225-D228 PolarHBondContact O-N 2.82Å; Q225-L229 VanDerWaalsContact O-CB 3.31Å; Q225-L229 WeakPolarHBondContact O-CB 3.25Å; Q225-L229 VanDerWaalsContact O-CG 3.23Å; Q225-L229 WeakPolarHBondContact O-CG 3.34Å; Q225-L229 PolarHBondContact O-N 3.06Å
226	I	83.9	Confident	81.1	Confident	91 Å²	91	112 Å²	112	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-61	-48.2	174.3	-70.1	163.1	0	0	0	110.2	L222 Q223 T224 D228 L229 E230	L222-I226 VanDerWaalsContact O-CG1 3.32Å; L222-I226 WeakPolarHBondContact O-CG1 3.46Å; L222-I226 PolarHBondContact O-N 2.78Å; Q223-I226 PolarHBondContact O-N 3.48Å; T224-I226 PolarHBondContact O-N 2.8Å; I226-D228 PolarHBondContact O-N 3.35Å; I226-L229 PolarHBondContact O-N 3.47Å; I226-E230 HydrophobicContact CG2-CG 4.31Å; I226-E230 WeakPolarHBondContact O-CB 3.32Å; I226-E230 WeakPolarHBondContact O-CG 3.29Å; I226-E230 PolarHBondContact O-N 3.49Å
227	V	83.8	Confident	80.5	Confident	81 Å²	81	114 Å²	114	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-62.8	-41.2	179.6	171.3	0	0	0	0	112.4	Q223 T224 R231	Q223-V227 WeakPolarHBondContact O-CG2 3.44Å; Q223-V227 PolarHBondContact O-N 2.94Å; Q223-V227 VanDerWaalsContact O-N 3.14Å; T224-V227 PolarHBondContact O-N 3.33Å; V227-R231 VanDerWaalsContact O-CB 3.27Å; V227-R231 WeakPolarHBondContact O-CB 3.27Å; V227-R231 PolarHBondContact O-N 2.64Å
228	D	82.9	Confident	79.5	Confident	92 Å²	92	111 Å²	111	49%	0.492	55%	0.554	S	S	.	*	H	α-helix	trans	-71	-31.2	175.6	-92.2	-17	0	0	0	112.6	T224 Q225 I226 R231 F232	T224-D228 PolarHBondContact O-N 3.04Å; Q225-D228 PolarHBondContact O-N 2.82Å; I226-D228 PolarHBondContact O-N 3.35Å; D228-R231 PolarHBondContact O-N 2.97Å; D228-F232 WeakPolarHBondContact O-CB 3.5Å; D228-F232 PolarHBondContact O-N 3.29Å
229	L	85.6	Confident	77.9	Confident	107 Å²	107	109.3 Å²	109.3	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-69.6	-43.8	172.2	-76.2	170	0	0	0	112.1	Q225 I226 R231 F232 V233	Q225-L229 VanDerWaalsContact O-CB 3.31Å; Q225-L229 WeakPolarHBondContact O-CB 3.25Å; Q225-L229 VanDerWaalsContact O-CG 3.23Å; Q225-L229 WeakPolarHBondContact O-CG 3.34Å; Q225-L229 PolarHBondContact O-N 3.06Å; I226-L229 PolarHBondContact O-N 3.47Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.18Å; L229-F232 PolarHBondContact O-N 3.32Å; L229-V233 WeakPolarHBondContact O-CB 3.17Å; L229-V233 WeakPolarHBondContact O-CG2 3.47Å; L229-V233 PolarHBondContact O-N 3.1Å
230	E	84.3	Confident	76.1	Confident	120 Å²	120	112.2 Å²	112.2	56%	0.561	57%	0.573	S	S	*	*	H	α-helix	trans	-57.1	-43.3	172.3	-73.9	171.9	166.2	0	0	110.7	I226 V233 Y234	I226-E230 HydrophobicContact CG2-CG 4.31Å; I226-E230 WeakPolarHBondContact O-CB 3.32Å; I226-E230 WeakPolarHBondContact O-CG 3.29Å; I226-E230 PolarHBondContact O-N 3.49Å; E230-V233 PolarHBondContact O-N 2.89Å; E230-Y234 WeakPolarHBondContact O-CB 3.25Å; E230-Y234 PolarHBondContact O-N 3.5Å
231	R	76.8	Confident	74.4	Confident	181 Å²	181	116.8 Å²	116.8	68%	0.683	59%	0.594	S	S	*	*	H	α-helix	trans	-66.3	-37.2	176.5	-164.4	-179.2	-161.8	177.3	7.3	113	V227 D228 L229 F235	V227-R231 VanDerWaalsContact O-CB 3.27Å; V227-R231 WeakPolarHBondContact O-CB 3.27Å; V227-R231 PolarHBondContact O-N 2.64Å; D228-R231 PolarHBondContact O-N 2.97Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.18Å; R231-F235 WeakPolarHBondContact O-CB 3.44Å; R231-F235 PolarHBondContact O-N 2.76Å
232	F	83.3	Confident	72.5	Confident	115 Å²	115	115 Å²	115	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-70.4	-39.4	174.6	-179.1	-107	0	0	0	112.1	D228 L229 F235 L236	D228-F232 WeakPolarHBondContact O-CB 3.5Å; D228-F232 PolarHBondContact O-N 3.29Å; L229-F232 PolarHBondContact O-N 3.32Å; F232-F235 WeakPolarHBondContact O-CB 3.44Å; F232-F235 PolarHBondContact O-N 2.79Å; F232-L236 HydrophobicContact CD1-CD1 4.06Å; F232-L236 HydrophobicContact CE1-CD1 3.51Å; F232-L236 HydrophobicContact CE1-CG 4.2Å; F232-L236 HydrophobicContact CZ-CD1 3.83Å; F232-L236 HydrophobicContact CZ-CD2 4.39Å; F232-L236 HydrophobicContact CZ-CG 4.17Å; F232-L236 PolarHBondContact O-N 3.49Å
233	V	77.3	Confident	70.3	Confident	66 Å²	66	114.7 Å²	114.7	40%	0.4	63%	0.626	S	S	.	*	H	α-helix	trans	-62.4	-44.2	172.5	168.9	0	0	0	0	110.5	L229 E230 F235 L236 Q237	L229-V233 WeakPolarHBondContact O-CB 3.17Å; L229-V233 WeakPolarHBondContact O-CG2 3.47Å; L229-V233 PolarHBondContact O-N 3.1Å; E230-V233 PolarHBondContact O-N 2.89Å; V233-F235 VanDerWaalsContact C-N 3.31Å; V233-F235 PolarHBondContact O-N 2.75Å; V233-L236 PolarHBondContact O-N 3.29Å; V233-Q237 HydrophobicContact CG1-CG 4.26Å; V233-Q237 WeakPolarHBondContact O-CB 3.43Å; V233-Q237 VanDerWaalsContact O-CG 3.31Å; V233-Q237 WeakPolarHBondContact O-CG 3.33Å; V233-Q237 PolarHBondContact O-N 2.77Å
234	Y	75.9	Confident	68	Low	183 Å²	183	112.3 Å²	112.3	72%	0.718	64%	0.635	S	S	*	*	H	α-helix	trans	-62	-38.2	174.6	-159.3	-78.6	0	0	0	112.1	E230 Q237 G238	E230-Y234 WeakPolarHBondContact O-CB 3.25Å; E230-Y234 PolarHBondContact O-N 3.5Å; Y234-Q237 PolarHBondContact O-N 3.23Å; Y234-G238 PolarHBondContact O-N 3.16Å
235	F	76.7	Confident	65.8	Low	156 Å²	156	114.2 Å²	114.2	68%	0.684	65%	0.652	S	S	*	*	H	α-helix	trans	-64.9	-40	175	176.5	-100.3	0	0	0	112.8	R231 F232 V233	R231-F235 WeakPolarHBondContact O-CB 3.44Å; R231-F235 PolarHBondContact O-N 2.76Å; F232-F235 WeakPolarHBondContact O-CB 3.44Å; F232-F235 PolarHBondContact O-N 2.79Å; V233-F235 VanDerWaalsContact C-N 3.31Å; V233-F235 PolarHBondContact O-N 2.75Å
236	L	73.9	Confident	63.7	Low	106 Å²	106	114 Å²	114	56%	0.555	66%	0.663	S	S	*	*	H	α-helix	trans	-70.7	-41.7	174.6	-70.6	178.5	0	0	0	112.4	F232 V233 G239	F232-L236 HydrophobicContact CD1-CD1 4.06Å; F232-L236 HydrophobicContact CE1-CD1 3.51Å; F232-L236 HydrophobicContact CE1-CG 4.2Å; F232-L236 HydrophobicContact CZ-CD1 3.83Å; F232-L236 HydrophobicContact CZ-CD2 4.39Å; F232-L236 HydrophobicContact CZ-CG 4.17Å; F232-L236 PolarHBondContact O-N 3.49Å; V233-L236 PolarHBondContact O-N 3.29Å; L236-G239 PolarHBondContact O-N 2.94Å
237	Q	64.6	Low	61.5	Low	150 Å²	150	114.4 Å²	114.4	70%	0.701	67%	0.674	S	S	*	*	H	α-helix	trans	-71.6	-33.5	-178.8	-71.8	175.9	-8.2	0	0	112.6	V233 Y234 G239	V233-Q237 HydrophobicContact CG1-CG 4.26Å; V233-Q237 WeakPolarHBondContact O-CB 3.43Å; V233-Q237 VanDerWaalsContact O-CG 3.31Å; V233-Q237 WeakPolarHBondContact O-CG 3.33Å; V233-Q237 PolarHBondContact O-N 2.77Å; Y234-Q237 PolarHBondContact O-N 3.23Å; Q237-G239 PolarHBondContact O-N 3Å
238	G	56.3	Low	59.4	Low	61 Å²	61	119.3 Å²	119.3	63%	0.629	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	2.4	172.1	0	0	0	0	0	114.9	Y234 N240	Y234-G238 PolarHBondContact O-N 3.16Å; G238-N240 PolarHBondContact O-N 2.65Å
239	G	47.2	Very low	57.3	Low	61 Å²	61	121.6 Å²	121.6	63%	0.629	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	0.1	-170.4	0	0	0	0	0	116.8	L236 Q237	L236-G239 PolarHBondContact O-N 2.94Å; Q237-G239 PolarHBondContact O-N 3Å
240	N	44.4	Very low	54.9	Low	150 Å²	150	120.2 Å²	120.2	80%	0.802	71%	0.71	S	S	*	*			trans	-124.3	19.7	-162.6	-161	65.4	0	0	0	116.4	G238	G238-N240 PolarHBondContact O-N 2.65Å
241	E	46.5	Very low	52.4	Low	198 Å²	198	125.8 Å²	125.8	93%	0.925	73%	0.726	S	S	*	*			trans	-111.2	91.9	168.3	-68.2	-160.8	159.9	0	0	111.3
242	G	42.5	Very low	50.4	Low	84 Å²	84	122.5 Å²	122.5	87%	0.866	73%	0.731	S	S	*	*			trans	-92.6	121.6	172.3	0	0	0	0	0	111.4
243	G	37.7	Very low	48.2	Very low	80 Å²	80	122.4 Å²	122.4	83%	0.825	74%	0.739	S	S	*	*			trans	-170.8	25	-170.1	0	0	0	0	0	120.4
244	G	35	Very low	46.3	Very low	76 Å²	76	126 Å²	126	78%	0.784	76%	0.761	S	S	*	*			trans	84.3	127.6	154.7	0	0	0	0	0	120.7
245	S	37.7	Very low	44.2	Very low	124 Å²	124	121.3 Å²	121.3	87%	0.867	76%	0.76	S	S	*	*			trans	92.3	138.1	149.6	-149.4	0	0	0	0	120.7
246	S	40.5	Very low	42.1	Very low	112 Å²	112	119.4 Å²	119.4	78%	0.783	77%	0.766	S	S	*	*			trans	53.6	87.6	166.9	-144	0	0	0	0	117.6
247	S	37.5	Very low	40.3	Very low	99 Å²	99	119 Å²	119	69%	0.692	78%	0.778	S	S	*	*			cis	80.2	78.6	40.3	-158.8	0	0	0	0	116.8
248	K	41.2	Very low	38.9	Very low	185 Å²	185	116 Å²	116	80%	0.804	77%	0.774	S	S	*	*				168.3	116.8	125.1	-88.5	153.1	-168.8	174.8	0	111.2
249	V	37.6	Very low	37.9	Very low	139 Å²	139	123.2 Å²	123.2	84%	0.842	78%	0.782	S	S	*	*				74.5	128.7	85.5	165.8	0	0	0	0	113.3
250	A	35.9	Very low	37.5	Very low	79 Å²	79	126.8 Å²	126.8	65%	0.653	79%	0.787	S	S	*	*			cis	-168	161.4	-16.7	0	0	0	0	0	112.4
251	R	31.7	Very low	37.3	Very low	236 Å²	236	125.8 Å²	125.8	89%	0.891	79%	0.786	S	S	*	*			trans	23.3	122.8	148.4	-58.5	172.6	-174.8	147.9	-0.2	121.3
252	S	35.9	Very low	36.9	Very low	113 Å²	113	123.8 Å²	123.8	79%	0.79	78%	0.78	S	S	*	*				-155.8	149.4	116.1	-135.4	0	0	0	0	107.7
253	V	36.2	Very low	36.7	Very low	113 Å²	113	127.4 Å²	127.4	69%	0.685	77%	0.774	S	S	*	*			cis	75	113	6.1	-64	0	0	0	0	120.7
254	V	36.4	Very low	36.5	Very low	141 Å²	141	131.8 Å²	131.8	86%	0.855	77%	0.771	S	S	*	*			trans	44.1	145.7	153.9	-93.6	0	0	0	0	125.3
255	A	33.4	Very low	36.4	Very low	85 Å²	85	132.7 Å²	132.7	70%	0.702	76%	0.764	S	S	*	*			trans	83.8	125.9	140.2	0	0	0	0	0	122.3
256	S	32.4	Very low	36.2	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	76%	0.761	S	S	*	*				59	111.4	129.5	-57.6	0	0	0	0	122.5
257	A	35.4	Very low	36	Very low	97 Å²	97	132.1 Å²	132.1	80%	0.802	76%	0.76	S	S	*	*				71.5	112.2	123.1	0	0	0	0	0	121.8
258	S	34.6	Very low	35.7	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	77%	0.768	S	S	*	*			trans	80.3	116.1	133.4	-135.9	0	0	0	0	121
259	R	36.4	Very low	35.3	Very low	212 Å²	212	129.3 Å²	129.3	80%	0.8	76%	0.764	S	S	*	*			trans	89.6	149.8	132.3	-100.4	177.6	-71.1	-179	-2.3	121.3
260	N	38.7	Very low	35.4	Very low	136 Å²	136	133.4 Å²	133.4	73%	0.727	77%	0.765	S	S	*	*			trans	70.4	113.5	168.6	-54.7	-12.8	0	0	0	115.2
261	V	39.9	Very low	35.7	Very low	129 Å²	129	135.1 Å²	135.1	78%	0.782	77%	0.772	S	S	*	*				74.2	105.7	53.2	178.4	0	0	0	0	112.5
262	I	37.6	Very low	36.5	Very low	155 Å²	155	127.9 Å²	127.9	80%	0.795	76%	0.758	S	S	*	*			trans	-168.3	123	135.3	-104.5	156.8	0	0	0	110.4
263	Q	39.2	Very low	36.8	Very low	160 Å²	160	129.5 Å²	129.5	75%	0.748	75%	0.75	S	S	*	*				24.4	151	127.6	-75.2	-172.4	24	0	0	120.5
264	K	33.7	Very low	37.7	Very low	173 Å²	173	126.5 Å²	126.5	75%	0.752	74%	0.743	S	S	*	*			cis	-177.3	144.3	-8	-158	178	-174.2	177.7	0	104.4
265	S	33.2	Very low	38.6	Very low	94 Å²	94	122.5 Å²	122.5	66%	0.657	73%	0.725	S	S	*	*				156.2	157.4	82.7	55.5	0	0	0	0	110.3
266	S	32.7	Very low	39.7	Very low	114 Å²	114	122.5 Å²	122.5	80%	0.797	71%	0.712	S	S	*	*			trans	63.7	140.9	163.7	71.8	0	0	0	0	118.8
267	S	35.4	Very low	41.1	Very low	110 Å²	110	121.8 Å²	121.8	77%	0.769	70%	0.699	S	S	*	*			cis	-159.2	155.1	-17.7	54.9	0	0	0	0	113.2
268	S	31.7	Very low	42.1	Very low	121 Å²	121	121.1 Å²	121.1	85%	0.846	69%	0.688	S	S	*	*			trans	70.8	160.1	154.3	-147	0	0	0	0	120.5
269	S	33.9	Very low	43.1	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	69%	0.688	S	S	*	*	S	Bend	trans	53.8	72.9	169.2	-154.1	0	0	0	0	119.1
270	R	38.9	Very low	44.4	Very low	225 Å²	225	117.2 Å²	117.2	85%	0.849	67%	0.671	S	S	*	*			trans	-163.2	11.5	147.5	-110.8	157.5	-168	177	3.9	115.9	S272 F273	R270-S272 PolarHBondContact O-N 3.04Å; R270-S272 VanDerWaalsContact O-N 3.1Å; R270-F273 PolarHBondContact O-N 3.11Å
271	S	43.3	Very low	45.6	Very low	115 Å²	115	113.4 Å²	113.4	80%	0.804	66%	0.655	S	S	*	*	H	α-helix	trans	-62	-17.8	-173.4	43	0	0	0	0	116
272	S	46.6	Very low	46.8	Very low	84 Å²	84	109.3 Å²	109.3	59%	0.587	64%	0.635	S	S	*	*	H	α-helix	trans	-77.8	-33.1	178.8	-172.8	0	0	0	0	113.3	R270 A275 L276	R270-S272 PolarHBondContact O-N 3.04Å; R270-S272 VanDerWaalsContact O-N 3.1Å; S272-A275 PolarHBondContact O-N 3.36Å; S272-L276 WeakPolarHBondContact O-CG 3.45Å; S272-L276 PolarHBondContact O-N 3.27Å; S272-L276 VanDerWaalsContact O-N 3.12Å
273	F	43.4	Very low	47.9	Very low	146 Å²	146	108 Å²	108	64%	0.64	63%	0.627	S	S	*	*	H	α-helix	trans	-74.3	-36.2	-171.6	-148.3	-97	0	0	0	113	R270 L277	R270-F273 PolarHBondContact O-N 3.11Å; F273-L277 HydrophobicContact CD1-CD1 3.76Å; F273-L277 HydrophobicContact CD1-CG 4.29Å; F273-L277 HydrophobicContact CE1-CD1 3.9Å; F273-L277 HydrophobicContact CE1-CG 4.33Å; F273-L277 PolarHBondContact O-N 2.93Å
274	G	54	Low	49	Very low	51 Å²	51	104.4 Å²	104.4	53%	0.526	61%	0.612	S	S	.	*	H	α-helix	trans	-69.5	-35.9	175.8	0	0	0	0	0	113.2	S278	G274-S278 WeakPolarHBondContact O-CB 3.4Å; G274-S278 PolarHBondContact O-N 3.4Å
275	A	56.6	Low	50.3	Low	57 Å²	57	101.8 Å²	101.8	47%	0.471	60%	0.603	S	S	.	*	H	α-helix	trans	-64.7	-46.8	173.6	0	0	0	0	0	111	S272 L277 S278 Q279	S272-A275 PolarHBondContact O-N 3.36Å; A275-L277 PolarHBondContact O-N 2.89Å; A275-S278 WeakPolarHBondContact O-CB 3.21Å; A275-S278 PolarHBondContact O-N 3.02Å; A275-Q279 WeakPolarHBondContact O-CB 3.31Å; A275-Q279 PolarHBondContact O-N 2.97Å
276	L	56.8	Low	51.8	Low	85 Å²	85	102.1 Å²	102.1	45%	0.445	60%	0.596	S	S	.	*	H	α-helix	trans	-62.3	-42.1	176.1	-72.7	171.1	0	0	0	112.4	S272 S278 Q279 I280	S272-L276 WeakPolarHBondContact O-CG 3.45Å; S272-L276 PolarHBondContact O-N 3.27Å; S272-L276 VanDerWaalsContact O-N 3.12Å; L276-S278 PolarHBondContact O-N 2.89Å; L276-Q279 PolarHBondContact O-N 2.91Å; L276-I280 VanDerWaalsContact O-CB 3.28Å; L276-I280 WeakPolarHBondContact O-CB 3.33Å; L276-I280 WeakPolarHBondContact O-CD1 3.49Å; L276-I280 WeakPolarHBondContact O-CG1 3.37Å; L276-I280 PolarHBondContact O-N 3.09Å
277	L	61.1	Low	53.2	Low	100 Å²	100	103.9 Å²	103.9	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-36.6	175.5	-79	170.4	0	0	0	113	F273 A275 S281	F273-L277 HydrophobicContact CD1-CD1 3.76Å; F273-L277 HydrophobicContact CD1-CG 4.29Å; F273-L277 HydrophobicContact CE1-CD1 3.9Å; F273-L277 HydrophobicContact CE1-CG 4.33Å; F273-L277 PolarHBondContact O-N 2.93Å; A275-L277 PolarHBondContact O-N 2.89Å; L277-S281 VanDerWaalsContact O-CB 3.28Å; L277-S281 WeakPolarHBondContact O-CB 3.28Å; L277-S281 PolarHBondContact O-N 2.86Å
278	S	55.9	Low	54.1	Low	83 Å²	83	104.5 Å²	104.5	58%	0.58	58%	0.575	S	S	*	*	H	α-helix	trans	-63.6	-45	171.8	-176.7	0	0	0	0	111.6	G274 A275 L276 S281 A282	G274-S278 WeakPolarHBondContact O-CB 3.4Å; G274-S278 PolarHBondContact O-N 3.4Å; A275-S278 WeakPolarHBondContact O-CB 3.21Å; A275-S278 PolarHBondContact O-N 3.02Å; L276-S278 PolarHBondContact O-N 2.89Å; S278-S281 WeakPolarHBondContact O-CB 3.49Å; S278-S281 PolarHBondContact O-N 2.98Å; S278-A282 PolarHBondContact O-N 3.25Å
279	Q	56.9	Low	55.4	Low	130 Å²	130	103.9 Å²	103.9	61%	0.607	56%	0.562	S	S	*	*	H	α-helix	trans	-71.3	-34	-178.6	-159.3	165.8	12.5	0	0	112.5	A275 L276 A282 M283	A275-Q279 WeakPolarHBondContact O-CB 3.31Å; A275-Q279 PolarHBondContact O-N 2.97Å; L276-Q279 PolarHBondContact O-N 2.91Å; Q279-A282 PolarHBondContact O-N 2.77Å; Q279-M283 WeakPolarHBondContact O-CB 3.26Å; Q279-M283 WeakPolarHBondContact O-CG 3.34Å; Q279-M283 PolarHBondContact O-N 3.4Å
280	I	63.7	Low	56.7	Low	88 Å²	88	103 Å²	103	45%	0.451	56%	0.555	S	S	.	*	H	α-helix	trans	-68.5	-41.4	169.9	-70.8	164.2	0	0	0	110.4	L276 A282 M283 I284	L276-I280 VanDerWaalsContact O-CB 3.28Å; L276-I280 WeakPolarHBondContact O-CB 3.33Å; L276-I280 WeakPolarHBondContact O-CD1 3.49Å; L276-I280 WeakPolarHBondContact O-CG1 3.37Å; L276-I280 PolarHBondContact O-N 3.09Å; I280-A282 VanDerWaalsContact C-N 3.34Å; I280-A282 PolarHBondContact O-N 2.94Å; I280-M283 PolarHBondContact O-N 3.37Å; I280-I284 HydrophobicContact CG2-CD1 3.66Å; I280-I284 HydrophobicContact CG2-CG1 4.27Å; I280-I284 WeakPolarHBondContact O-CB 3.19Å; I280-I284 VanDerWaalsContact O-CG1 3.25Å; I280-I284 WeakPolarHBondContact O-CG1 3.3Å; I280-I284 PolarHBondContact O-N 3.44Å
281	S	63.8	Low	57.4	Low	57 Å²	57	97.8 Å²	97.8	40%	0.399	54%	0.541	S	S	.	.	H	α-helix	trans	-59.9	-44.2	173.3	-173	0	0	0	0	111.4	L277 S278 I284 Q285	L277-S281 VanDerWaalsContact O-CB 3.28Å; L277-S281 WeakPolarHBondContact O-CB 3.28Å; L277-S281 PolarHBondContact O-N 2.86Å; S278-S281 WeakPolarHBondContact O-CB 3.49Å; S278-S281 PolarHBondContact O-N 2.98Å; S281-I284 PolarHBondContact O-N 3.2Å; S281-Q285 WeakPolarHBondContact O-CB 3.22Å; S281-Q285 WeakPolarHBondContact O-CG 3.41Å; S281-Q285 PolarHBondContact O-N 3.22Å
282	A	64.1	Low	57.7	Low	43 Å²	43	99.8 Å²	99.8	36%	0.355	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-42.5	174	0	0	0	0	0	112.6	S278 Q279 I280 Q285 I286	S278-A282 PolarHBondContact O-N 3.25Å; Q279-A282 PolarHBondContact O-N 2.77Å; I280-A282 VanDerWaalsContact C-N 3.34Å; I280-A282 PolarHBondContact O-N 2.94Å; A282-Q285 PolarHBondContact O-N 2.88Å; A282-I286 WeakPolarHBondContact O-CB 3.13Å; A282-I286 WeakPolarHBondContact O-CD1 3.37Å; A282-I286 VanDerWaalsContact O-CG1 3.23Å; A282-I286 WeakPolarHBondContact O-CG1 3.39Å; A282-I286 PolarHBondContact O-N 2.56Å
283	M	60.7	Low	57.2	Low	126 Å²	126	98.5 Å²	98.5	62%	0.621	54%	0.535	S	S	*	.	H	α-helix	trans	-64.9	-38.4	175	-70.9	-114.5	107.6	0	0	112.4	Q279 I280 I286 Y287	Q279-M283 WeakPolarHBondContact O-CB 3.26Å; Q279-M283 WeakPolarHBondContact O-CG 3.34Å; Q279-M283 PolarHBondContact O-N 3.4Å; I280-M283 PolarHBondContact O-N 3.37Å; M283-I286 PolarHBondContact O-N 2.7Å; M283-Y287 WeakPolarHBondContact O-CB 3.44Å; M283-Y287 PolarHBondContact O-N 3.06Å
284	I	63.4	Low	57	Low	85 Å²	85	95.1 Å²	95.1	44%	0.436	53%	0.529	S	S	.	.	H	α-helix	trans	-66	-43.2	174.3	-73.6	171	0	0	0	110.1	I280 S281 Y287 F288	I280-I284 HydrophobicContact CG2-CD1 3.66Å; I280-I284 HydrophobicContact CG2-CG1 4.27Å; I280-I284 WeakPolarHBondContact O-CB 3.19Å; I280-I284 VanDerWaalsContact O-CG1 3.25Å; I280-I284 WeakPolarHBondContact O-CG1 3.3Å; I280-I284 PolarHBondContact O-N 3.44Å; S281-I284 PolarHBondContact O-N 3.2Å; I284-Y287 PolarHBondContact O-N 3.31Å; I284-F288 HydrophobicContact CG2-CD2 3.65Å; I284-F288 HydrophobicContact CG2-CE2 3.74Å; I284-F288 WeakPolarHBondContact O-CD2 3.45Å; I284-F288 PolarHBondContact O-N 2.76Å
285	Q	60.7	Low	56.4	Low	119 Å²	119	103.6 Å²	103.6	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-62.1	-42.1	173.3	-74.5	178.9	2.4	0	0	111.8	S281 A282 Y287 F288 L289	S281-Q285 WeakPolarHBondContact O-CB 3.22Å; S281-Q285 WeakPolarHBondContact O-CG 3.41Å; S281-Q285 PolarHBondContact O-N 3.22Å; A282-Q285 PolarHBondContact O-N 2.88Å; Q285-Y287 VanDerWaalsContact C-N 3.32Å; Q285-Y287 PolarHBondContact O-N 3.15Å; Q285-F288 PolarHBondContact O-N 2.87Å; Q285-L289 VanDerWaalsContact O-CB 3.24Å; Q285-L289 WeakPolarHBondContact O-CB 3.26Å; Q285-L289 WeakPolarHBondContact O-CD1 3.06Å; Q285-L289 WeakPolarHBondContact O-CG 3.3Å; Q285-L289 PolarHBondContact O-N 3.4Å
286	I	63.7	Low	55.3	Low	101 Å²	101	107 Å²	107	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-37.4	173.9	-70.2	162.6	0	0	0	111.5	A282 M283 S290	A282-I286 WeakPolarHBondContact O-CB 3.13Å; A282-I286 WeakPolarHBondContact O-CD1 3.37Å; A282-I286 VanDerWaalsContact O-CG1 3.23Å; A282-I286 WeakPolarHBondContact O-CG1 3.39Å; A282-I286 PolarHBondContact O-N 2.56Å; M283-I286 PolarHBondContact O-N 2.7Å; I286-S290 WeakPolarHBondContact O-CB 3.37Å; I286-S290 PolarHBondContact O-N 3.35Å; I286-S290 PolarHBondContact O-OG 3.34Å
287	Y	62.1	Low	54.6	Low	151 Å²	151	108.9 Å²	108.9	59%	0.592	59%	0.587	S	S	*	*	H	α-helix	trans	-68	-46.9	175.6	-170.3	-96.6	0	0	0	111.8	M283 I284 Q285 L289 S290 Q291	M283-Y287 WeakPolarHBondContact O-CB 3.44Å; M283-Y287 PolarHBondContact O-N 3.06Å; I284-Y287 PolarHBondContact O-N 3.31Å; Q285-Y287 VanDerWaalsContact C-N 3.32Å; Q285-Y287 PolarHBondContact O-N 3.15Å; Y287-L289 PolarHBondContact O-N 2.99Å; Y287-S290 WeakPolarHBondContact CA-OG 3.23Å; Y287-S290 PolarHBondContact O-N 3.26Å; Y287-S290 PolarHBondContact O-OG 3.5Å; Y287-S290 VanDerWaalsContact O-OG 3.05Å; Y287-Q291 HydrophobicContact CD1-CG 4.32Å; Y287-Q291 HydrophobicContact CE1-CG 3.93Å; Y287-Q291 HydrophobicContact CE2-CG 4.41Å; Y287-Q291 PolarHBondContact O-N 3.31Å
288	F	54	Low	53.4	Low	123 Å²	123	109 Å²	109	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-61.2	-42.2	173	-87.4	-74.6	0	0	0	112.1	I284 Q285 S290 Q291 F292	I284-F288 HydrophobicContact CG2-CD2 3.65Å; I284-F288 HydrophobicContact CG2-CE2 3.74Å; I284-F288 WeakPolarHBondContact O-CD2 3.45Å; I284-F288 PolarHBondContact O-N 2.76Å; Q285-F288 PolarHBondContact O-N 2.87Å; F288-S290 PolarHBondContact O-N 3.43Å; F288-Q291 PolarHBondContact O-N 3.38Å; F288-F292 HydrophobicContact CD1-CD2 4.12Å; F288-F292 WeakPolarHBondContact O-CA 3.13Å; F288-F292 WeakPolarHBondContact O-CB 3.43Å; F288-F292 PolarHBondContact O-N 3.01Å
289	L	60.1	Low	52.7	Low	108 Å²	108	113.4 Å²	113.4	57%	0.565	61%	0.608	S	S	*	*	H	α-helix	trans	-67.4	-20.5	176.6	-73.5	166.1	0	0	0	113.5	Q285 Y287	Q285-L289 VanDerWaalsContact O-CB 3.24Å; Q285-L289 WeakPolarHBondContact O-CB 3.26Å; Q285-L289 WeakPolarHBondContact O-CD1 3.06Å; Q285-L289 WeakPolarHBondContact O-CG 3.3Å; Q285-L289 PolarHBondContact O-N 3.4Å; Y287-L289 PolarHBondContact O-N 2.99Å
290	S	61.8	Low	51.6	Low	85 Å²	85	115.3 Å²	115.3	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-97.4	-17.8	176.8	54.8	0	0	0	0	114.5	I286 Y287 F288	I286-S290 WeakPolarHBondContact O-CB 3.37Å; I286-S290 PolarHBondContact O-N 3.35Å; I286-S290 PolarHBondContact O-OG 3.34Å; Y287-S290 WeakPolarHBondContact CA-OG 3.23Å; Y287-S290 PolarHBondContact O-N 3.26Å; Y287-S290 PolarHBondContact O-OG 3.5Å; Y287-S290 VanDerWaalsContact O-OG 3.05Å; F288-S290 PolarHBondContact O-N 3.43Å
291	Q	53.4	Low	50.4	Low	117 Å²	117	119.4 Å²	119.4	55%	0.547	63%	0.631	S	S	.	*	H	α-helix	trans	-99	-33.7	173.2	-70.3	-71.2	-9.2	0	0	113.2	Y287 F288	Y287-Q291 HydrophobicContact CD1-CG 4.32Å; Y287-Q291 HydrophobicContact CE1-CG 3.93Å; Y287-Q291 HydrophobicContact CE2-CG 4.41Å; Y287-Q291 PolarHBondContact O-N 3.31Å; F288-Q291 PolarHBondContact O-N 3.38Å
292	F	48.2	Very low	49.4	Very low	157 Å²	157	126.3 Å²	126.3	69%	0.689	65%	0.649	S	S	*	*	S	Bend	trans	-123.5	71.8	-177.5	-68.7	-84.1	0	0	0	110.3	F288 C294	F288-F292 HydrophobicContact CD1-CD2 4.12Å; F288-F292 WeakPolarHBondContact O-CA 3.13Å; F288-F292 WeakPolarHBondContact O-CB 3.43Å; F288-F292 PolarHBondContact O-N 3.01Å; F292-C294 PolarHBondContact O-N 3.49Å
293	G	37.3	Very low	48.2	Very low	56 Å²	56	132.3 Å²	132.3	58%	0.577	68%	0.675	S	S	*	*			trans	-69.9	87.4	-174.2	0	0	0	0	0	114.6
294	C	38.2	Very low	47.4	Very low	76 Å²	76	130.3 Å²	130.3	51%	0.514	67%	0.67	S	S	.	*			trans	-137.3	119.6	160.5	-79.2	0	0	0	0	109.3	F292	F292-C294 PolarHBondContact O-N 3.49Å
295	Y	41.2	Very low	46.4	Very low	228 Å²	228	134.8 Å²	134.8	89%	0.894	69%	0.694	S	S	*	*				-178.5	138.4	126.6	-88.6	-55.8	0	0	0	109.8
296	S	34.2	Very low	45.7	Very low	130 Å²	130	136.7 Å²	136.7	91%	0.909	70%	0.7	S	S	*	*			trans	-74.8	126.3	-167.7	-50.3	0	0	0	0	113.2
297	S	42.9	Very low	44.6	Very low	124 Å²	124	141.5 Å²	141.5	87%	0.867	72%	0.721	S	S	*	*			trans	-142.7	154.9	152.8	-166.3	0	0	0	0	110.2
298	S	35	Very low	43.9	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	72%	0.718	S	S	*	*			trans	-88.6	171.1	-172.6	-166.1	0	0	0	0	112.6
299	Q	40.9	Very low	43.5	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	73%	0.734	S	S	*	*			trans	73.5	113.7	167.9	-62.2	-177.3	-40.7	0	0	118.7
300	F	35	Very low	43	Very low	171 Å²	171	143.2 Å²	143.2	75%	0.75	75%	0.75	S	S	*	*			trans	63.6	108.2	135.3	-115.7	-89.1	0	0	0	119.6	R302	F300-R302 HydrophobicContact CD1-CG 4.37Å; F300-R302 HydrophobicContact CE1-CG 4.2Å
301	H	37.3	Very low	42.4	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.806	75%	0.749	S	S	*	*			trans	-138.1	141.4	142.6	-127.8	55.2	0	0	0	113.8	T304	H301-T304 PolarHBondContact CD2-OG1 3.48Å
302	R	42.8	Very low	42.8	Very low	201 Å²	201	140.5 Å²	140.5	76%	0.758	74%	0.743	S	S	*	*			trans	-86.1	159.6	-179.6	-61.7	163	78.4	118.9	-4.8	109.1	F300 T304	F300-R302 HydrophobicContact CD1-CG 4.37Å; F300-R302 HydrophobicContact CE1-CG 4.2Å; R302-T304 PolarHBondContact O-N 3.01Å; R302-T304 PolarHBondContact O-OG1 2.94Å
303	N	38.5	Very low	44.2	Very low	170 Å²	170	137.6 Å²	137.6	91%	0.909	73%	0.731	S	S	*	*			trans	-44.2	101.7	-179.3	-67.4	2.3	0	0	0	112.1
304	T	43.9	Very low	46.4	Very low	84 Å²	84	138.5 Å²	138.5	52%	0.515	72%	0.717	S	S	.	*			trans	-93.7	106	178.9	-52.2	0	0	0	0	107.6	H301 R302 K306	H301-T304 PolarHBondContact CD2-OG1 3.48Å; R302-T304 PolarHBondContact O-N 3.01Å; R302-T304 PolarHBondContact O-OG1 2.94Å; T304-K306 PolarHBondContact O-N 3.43Å
305	L	44	Very low	48.7	Very low	178 Å²	178	136 Å²	136	93%	0.932	70%	0.704	S	S	*	*			trans	-55.7	105.1	175.3	-78.7	154.7	0	0	0	109.7
306	K	44.7	Very low	51	Low	160 Å²	160	129 Å²	129	70%	0.696	68%	0.682	S	S	*	*			trans	-108.4	118.6	-179.8	-86.5	-169.6	171.8	-176.4	0	111.5	T304 T308	T304-K306 PolarHBondContact O-N 3.43Å; K306-T308 VanDerWaalsContact C-N 3.27Å; K306-T308 HydrophobicContact CB-CG2 4.39Å; K306-T308 PolarHBondContact O-N 3.12Å
307	Q	41.7	Very low	53.6	Low	202 Å²	202	124.2 Å²	124.2	94%	0.944	65%	0.646	S	S	*	*			trans	-77.7	75.5	168.1	-63.6	-172.7	6.6	0	0	110.1
308	T	46.6	Very low	55.9	Low	88 Å²	88	121.4 Å²	121.4	54%	0.54	62%	0.616	S	S	.	*			trans	-123	91.2	177.1	48.7	0	0	0	0	110.7	K306 K310	K306-T308 VanDerWaalsContact C-N 3.27Å; K306-T308 HydrophobicContact CB-CG2 4.39Å; K306-T308 PolarHBondContact O-N 3.12Å; T308-K310 PolarHBondContact O-N 2.92Å
309	S	47.1	Very low	58.6	Low	126 Å²	126	118.8 Å²	118.8	88%	0.881	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	7.9	-165.3	54.3	0	0	0	0	117.3
310	K	48.5	Very low	61	Low	204 Å²	204	114.4 Å²	114.4	89%	0.887	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.2	5.2	-172.6	-71.9	-165.7	174.2	-174.6	0	116.6	T308	T308-K310 PolarHBondContact O-N 2.92Å
311	C	49.7	Very low	63.8	Low	87 Å²	87	106.2 Å²	106.2	59%	0.588	55%	0.551	S	S	*	*			trans	-146.1	121.2	167.6	-166.1	0	0	0	0	109.8
312	S	62.3	Low	66.4	Low	58 Å²	58	101.9 Å²	101.9	41%	0.406	53%	0.53	S	S	.	.			trans	-70.8	129.4	171.6	-173.8	0	0	0	0	108.5	D316	S312-D316 WeakPolarHBondContact OG-CB 3.39Å
313	H	77	Confident	68.7	Low	96 Å²	96	98.6 Å²	98.6	44%	0.444	53%	0.526	S	S	.	.			trans	-68.4	144.8	-180	-178.6	-116.1	0	0	0	108.9	G315 D316 L317	H313-G315 PolarHBondContact ND1-N 3.03Å; H313-G315 PolarHBondContact O-N 3.47Å; H313-D316 WeakPolarHBondContact CB-OD2 3.47Å; H313-D316 PolarHBondContact N-OD2 3.05Å; H313-D316 WeakPolarHBondContact O-CA 3.26Å; H313-D316 VanDerWaalsContact O-CB 3.31Å; H313-D316 WeakPolarHBondContact O-CB 3.01Å; H313-D316 PolarHBondContact O-N 3.29Å; H313-L317 PolarHBondContact O-N 2.79Å
314	W	83.5	Confident	71.3	Confident	74 Å²	74	90.9 Å²	90.9	28%	0.28	49%	0.485	S	S	.	.	H	α-helix	trans	-58.4	-20.7	177.5	55.1	-100.8	0	0	0	113.1	R318 H369 Y528 V532	W314-R318 VanDerWaalsContact O-CB 3.24Å; W314-R318 WeakPolarHBondContact O-CB 3.45Å; W314-R318 PolarHBondContact O-N 2.8Å; W314-H369 AromaticContact CD1-CE1 3.87Å; W314-H369 AromaticContact CD1-NE2 3.77Å; W314-Y528 HydrophobicContact CB-CD2 3.87Å; W314-Y528 HydrophobicContact CB-CG 4.24Å; W314-Y528 HydrophobicContact CD2-CD2 4.03Å; W314-Y528 AromaticContact CE3-CD2 3.78Å; W314-Y528 HydrophobicContact CE3-CD2 3.78Å; W314-Y528 AromaticContact CE3-CE2 3.99Å; W314-Y528 HydrophobicContact CE3-CE2 3.99Å; W314-Y528 HydrophobicContact CG-CD2 4.07Å; W314-V532 HydrophobicContact CE3-CG2 4.31Å; W314-V532 HydrophobicContact CH2-CG2 4.34Å; W314-V532 HydrophobicContact CZ3-CG2 4.15Å
315	G	86	Confident	73.6	Confident	23 Å²	23	86.9 Å²	86.9	24%	0.237	46%	0.46	C	S	.	.	H	α-helix	trans	-64.8	-38.7	169.5	0	0	0	0	0	113.2	H313 R318 A319	H313-G315 PolarHBondContact ND1-N 3.03Å; H313-G315 PolarHBondContact O-N 3.47Å; G315-R318 PolarHBondContact O-N 3.46Å; G315-A319 WeakPolarHBondContact O-CB 3.29Å; G315-A319 PolarHBondContact O-N 2.92Å
316	D	89.3	Confident	75.9	Confident	83 Å²	83	80.4 Å²	80.4	44%	0.444	43%	0.426	S	S	.	.	H	α-helix	trans	-68.3	-47.6	175.5	-46.8	-34.4	0	0	0	109.4	S312 H313 R318 A319 T320	S312-D316 WeakPolarHBondContact OG-CB 3.39Å; H313-D316 WeakPolarHBondContact CB-OD2 3.47Å; H313-D316 PolarHBondContact N-OD2 3.05Å; H313-D316 WeakPolarHBondContact O-CA 3.26Å; H313-D316 VanDerWaalsContact O-CB 3.31Å; H313-D316 WeakPolarHBondContact O-CB 3.01Å; H313-D316 PolarHBondContact O-N 3.29Å; D316-R318 VanDerWaalsContact C-N 3.31Å; D316-R318 PolarHBondContact O-N 3.35Å; D316-A319 CarbonylContact O-C 3.57Å; D316-A319 WeakPolarHBondContact O-CA 3.21Å; D316-A319 WeakPolarHBondContact O-CB 3.5Å; D316-A319 PolarHBondContact O-N 3.1Å; D316-A319 VanDerWaalsContact O-N 3.08Å; D316-T320 PolarHBondContact O-N 2.88Å; D316-T320 PolarHBondContact O-OG1 3.39Å; D316-T320 VanDerWaalsContact O-OG1 3.09Å
317	L	89.5	Confident	78.1	Confident	29 Å²	29	77 Å²	77	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-59.4	-39.9	175.8	-60.1	177	0	0	0	112	H313 T320 L321 D365 L366 H369	H313-L317 PolarHBondContact O-N 2.79Å; L317-T320 PolarHBondContact O-N 3.45Å; L317-L321 PolarHBondContact O-N 3.33Å; L317-D365 HydrophobicContact CD2-CB 4.37Å; L317-L366 HydrophobicContact CB-CB 4.29Å; L317-L366 HydrophobicContact CB-CD1 3.75Å; L317-H369 HydrophobicContact CD1-CB 4Å
318	R	89.8	Confident	80.4	Confident	64 Å²	64	67.4 Å²	67.4	24%	0.242	37%	0.368	C	S	.	.	H	α-helix	trans	-65	-40.9	174	-175.5	-175.5	-178.7	176.9	6.3	111.2	W314 G315 D316 L321 Q322 L366 E536	W314-R318 VanDerWaalsContact O-CB 3.24Å; W314-R318 WeakPolarHBondContact O-CB 3.45Å; W314-R318 PolarHBondContact O-N 2.8Å; G315-R318 PolarHBondContact O-N 3.46Å; D316-R318 VanDerWaalsContact C-N 3.31Å; D316-R318 PolarHBondContact O-N 3.35Å; R318-L321 PolarHBondContact O-N 2.98Å; R318-Q322 WeakPolarHBondContact O-CB 3.41Å; R318-Q322 PolarHBondContact O-N 2.98Å; R318-L366 HydrophobicContact CB-CD1 4.39Å; R318-E536 IonicContact CZ-OE2 2.68Å; R318-E536 IonicContact NH1-OE2 2.72Å; R318-E536 IonicContact NH2-OE2 3.61Å; R318-E536 PolarHBondContact NH2-OE2 3.41Å
319	A	91.7	Very high	82.3	Confident	49 Å²	49	63.9 Å²	63.9	41%	0.405	35%	0.346	S	S	.	.	H	α-helix	trans	-65.7	-43	175.6	0	0	0	0	0	111.6	G315 D316 L321 Q322 M323	G315-A319 WeakPolarHBondContact O-CB 3.29Å; G315-A319 PolarHBondContact O-N 2.92Å; D316-A319 CarbonylContact O-C 3.57Å; D316-A319 WeakPolarHBondContact O-CA 3.21Å; D316-A319 WeakPolarHBondContact O-CB 3.5Å; D316-A319 PolarHBondContact O-N 3.1Å; D316-A319 VanDerWaalsContact O-N 3.08Å; A319-L321 PolarHBondContact O-N 2.85Å; A319-Q322 PolarHBondContact O-N 2.67Å; A319-M323 WeakPolarHBondContact O-CB 3.12Å; A319-M323 VanDerWaalsContact O-CG 3.3Å; A319-M323 WeakPolarHBondContact O-CG 3.47Å; A319-M323 PolarHBondContact O-N 2.91Å
320	T	92.2	Very high	84.3	Confident	81 Å²	81	61.4 Å²	61.4	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-59.9	-43.7	173.3	-55.8	0	0	0	0	111.7	D316 L317 M323 S324	D316-T320 PolarHBondContact O-N 2.88Å; D316-T320 PolarHBondContact O-OG1 3.39Å; D316-T320 VanDerWaalsContact O-OG1 3.09Å; L317-T320 PolarHBondContact O-N 3.45Å; T320-M323 PolarHBondContact O-N 3.38Å; T320-S324 WeakPolarHBondContact O-CB 3.44Å; T320-S324 PolarHBondContact O-N 3.25Å; T320-S324 PolarHBondContact O-OG 2.79Å
321	L	92.8	Very high	86.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-48.4	173.8	177.9	59.5	0	0	0	111.4	L317 R318 A319 M323 S324 I325 L359 S362 L363 L366 T537	L317-L321 PolarHBondContact O-N 3.33Å; R318-L321 PolarHBondContact O-N 2.98Å; A319-L321 PolarHBondContact O-N 2.85Å; L321-M323 PolarHBondContact O-N 3.38Å; L321-S324 PolarHBondContact O-N 3.05Å; L321-S324 PolarHBondContact O-OG 3.26Å; L321-I325 HydrophobicContact CD1-CD1 3.86Å; L321-I325 HydrophobicContact CD1-CG1 4.11Å; L321-I325 HydrophobicContact CD2-CD1 4.5Å; L321-I325 HydrophobicContact CG-CD1 3.83Å; L321-I325 HydrophobicContact CG-CG1 4.48Å; L321-I325 WeakPolarHBondContact O-CG1 3.37Å; L321-I325 PolarHBondContact O-N 2.93Å; L321-L359 HydrophobicContact CD1-CD1 4.07Å; L321-S362 WeakPolarHBondContact CD1-OG 3.34Å; L321-L363 HydrophobicContact CD1-CB 4.07Å; L321-L363 HydrophobicContact CD1-CD1 4.44Å; L321-L363 HydrophobicContact CD2-CD1 4.04Å; L321-L366 HydrophobicContact CB-CD2 4.34Å; L321-L366 HydrophobicContact CD2-CD2 3.46Å; L321-L366 VanDerWaalsContact CD2-CD2 3.46Å; L321-T537 HydrophobicContact CD2-CG2 3.73Å
322	Q	92.8	Very high	87.8	Confident	82 Å²	82	48.4 Å²	48.4	38%	0.383	26%	0.258	S	S	.	.	H	α-helix	trans	-58.4	-48.6	178	-178.7	174.1	-26.2	0	0	111.7	R318 A319 S324 I325 D326 L540	R318-Q322 WeakPolarHBondContact O-CB 3.41Å; R318-Q322 PolarHBondContact O-N 2.98Å; A319-Q322 PolarHBondContact O-N 2.67Å; Q322-S324 VanDerWaalsContact C-N 3.31Å; Q322-S324 PolarHBondContact O-N 3.12Å; Q322-I325 WeakPolarHBondContact O-CB 3.28Å; Q322-I325 PolarHBondContact O-N 2.9Å; Q322-I325 VanDerWaalsContact O-N 3.08Å; Q322-D326 WeakPolarHBondContact CG-OD2 3.24Å; Q322-D326 PolarHBondContact O-N 2.87Å; Q322-L540 HydrophobicContact CG-CD2 4.46Å
323	M	92.1	Very high	88.9	Confident	133 Å²	133	50.8 Å²	50.8	66%	0.655	26%	0.263	S	S	*	.	H	α-helix	trans	-58.7	-40.6	176.4	-70.8	-60.5	-62.5	0	0	112.2	A319 T320 L321 D326 E327	A319-M323 WeakPolarHBondContact O-CB 3.12Å; A319-M323 VanDerWaalsContact O-CG 3.3Å; A319-M323 WeakPolarHBondContact O-CG 3.47Å; A319-M323 PolarHBondContact O-N 2.91Å; T320-M323 PolarHBondContact O-N 3.38Å; L321-M323 PolarHBondContact O-N 3.38Å; M323-D326 PolarHBondContact O-N 2.83Å; M323-E327 VanDerWaalsContact O-CB 3.31Å; M323-E327 WeakPolarHBondContact O-CB 3.28Å; M323-E327 PolarHBondContact O-N 2.78Å
324	S	92.7	Very high	89.3	Confident	7 Å²	7	56 Å²	56	5%	0.049	28%	0.279	C	S	.	.	H	α-helix	trans	-69.9	-29.2	175.9	70.8	0	0	0	0	113.5	T320 L321 Q322 F328 S362	T320-S324 WeakPolarHBondContact O-CB 3.44Å; T320-S324 PolarHBondContact O-N 3.25Å; T320-S324 PolarHBondContact O-OG 2.79Å; L321-S324 PolarHBondContact O-N 3.05Å; L321-S324 PolarHBondContact O-OG 3.26Å; Q322-S324 VanDerWaalsContact C-N 3.31Å; Q322-S324 PolarHBondContact O-N 3.12Å; S324-F328 WeakPolarHBondContact O-CB 3.18Å; S324-F328 PolarHBondContact O-N 3.48Å; S324-S362 WeakPolarHBondContact OG-CB 3.38Å; S324-S362 PolarHBondContact OG-OG 3.03Å
325	I	92.1	Very high	89	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.5	-43.5	172.6	-72.3	168.3	0	0	0	110.2	L321 Q322 F328 V329 L359 L540 L541 L544	L321-I325 HydrophobicContact CD1-CD1 3.86Å; L321-I325 HydrophobicContact CD1-CG1 4.11Å; L321-I325 HydrophobicContact CD2-CD1 4.5Å; L321-I325 HydrophobicContact CG-CD1 3.83Å; L321-I325 HydrophobicContact CG-CG1 4.48Å; L321-I325 WeakPolarHBondContact O-CG1 3.37Å; L321-I325 PolarHBondContact O-N 2.93Å; Q322-I325 WeakPolarHBondContact O-CB 3.28Å; Q322-I325 PolarHBondContact O-N 2.9Å; Q322-I325 VanDerWaalsContact O-N 3.08Å; I325-F328 PolarHBondContact O-N 3.26Å; I325-V329 WeakPolarHBondContact O-CB 3.36Å; I325-V329 VanDerWaalsContact O-CG2 3.26Å; I325-V329 WeakPolarHBondContact O-CG2 3.25Å; I325-V329 PolarHBondContact O-N 3.27Å; I325-L359 HydrophobicContact CG1-CD1 3.74Å; I325-L540 HydrophobicContact CD1-CB 3.85Å; I325-L541 HydrophobicContact CD1-CD2 3.73Å; I325-L541 HydrophobicContact CD1-CG 4.31Å; I325-L541 HydrophobicContact CG1-CD2 4.31Å; I325-L544 HydrophobicContact CG2-CD2 4.07Å
326	D	91.6	Very high	88.3	Confident	42 Å²	42	60.3 Å²	60.3	23%	0.225	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-43.3	176.5	-76	-50.6	0	0	0	111.7	Q322 M323 V329 N330 R543	Q322-D326 WeakPolarHBondContact CG-OD2 3.24Å; Q322-D326 PolarHBondContact O-N 2.87Å; M323-D326 PolarHBondContact O-N 2.83Å; D326-V329 PolarHBondContact O-N 3.02Å; D326-N330 WeakPolarHBondContact O-CB 3.33Å; D326-N330 PolarHBondContact O-N 3.47Å; D326-N330 PolarHBondContact O-ND2 3.46Å; D326-R543 IonicContact OD1-CZ 3.03Å; D326-R543 IonicContact OD1-NH1 3.29Å; D326-R543 PolarHBondContact OD1-NH1 2.98Å; D326-R543 IonicContact OD1-NH2 2.71Å; D326-R543 PolarHBondContact OD1-NH2 2.71Å; D326-R543 IonicContact OD2-NH1 3.17Å
327	E	90.8	Very high	87.2	Confident	90 Å²	90	56.8 Å²	56.8	42%	0.421	29%	0.286	S	S	.	.	H	α-helix	trans	-56	-51.5	169.4	-178	-167.2	-141.8	0	0	111.4	M323 V329 N330 V331 T358	M323-E327 VanDerWaalsContact O-CB 3.31Å; M323-E327 WeakPolarHBondContact O-CB 3.28Å; M323-E327 PolarHBondContact O-N 2.78Å; E327-V329 PolarHBondContact O-N 3.21Å; E327-N330 WeakPolarHBondContact O-CB 3.17Å; E327-N330 PolarHBondContact O-N 3.5Å; E327-N330 VanDerWaalsContact O-N 3.14Å; E327-V331 WeakPolarHBondContact O-CG2 3.38Å; E327-V331 PolarHBondContact O-N 2.89Å; E327-T358 VanDerWaalsContact OE2-CB 3.27Å; E327-T358 WeakPolarHBondContact OE2-CB 3.46Å; E327-T358 VanDerWaalsContact OE2-CG2 3.3Å; E327-T358 WeakPolarHBondContact OE2-CG2 3.46Å; E327-T358 PolarHBondContact OE2-OG1 2.93Å
328	F	89.7	Confident	86	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-38.2	-177.5	179.5	-120.4	0	0	0	112.8	S324 I325 V331 C332 V351 S354 V355 L359 L544 Y549	S324-F328 WeakPolarHBondContact O-CB 3.18Å; S324-F328 PolarHBondContact O-N 3.48Å; I325-F328 PolarHBondContact O-N 3.26Å; F328-V331 PolarHBondContact O-N 2.9Å; F328-C332 PolarHBondContact O-N 2.85Å; F328-C332 PolarHBondContact O-SG 3.47Å; F328-V351 HydrophobicContact CE2-CG1 3.63Å; F328-V351 HydrophobicContact CZ-CG1 4.02Å; F328-S354 WeakPolarHBondContact CD2-OG 3.43Å; F328-V355 HydrophobicContact CD2-CG2 4.24Å; F328-V355 HydrophobicContact CE1-CG2 4.35Å; F328-V355 HydrophobicContact CE2-CG2 3.35Å; F328-V355 HydrophobicContact CZ-CG2 3.42Å; F328-V355 VanDerWaalsContact CZ-CG2 3.42Å; F328-L359 HydrophobicContact CD1-CD2 4.01Å; F328-L359 HydrophobicContact CE1-CD2 4.14Å; F328-L544 HydrophobicContact CD1-CD1 4.21Å; F328-L544 HydrophobicContact CD1-CD2 3.64Å; F328-L544 HydrophobicContact CE1-CD1 4.3Å; F328-L544 HydrophobicContact CE1-CD2 4.06Å; F328-Y549 AromaticContact CE1-CE1 3.94Å; F328-Y549 HydrophobicContact CE1-CE1 3.94Å; F328-Y549 AromaticContact CE1-CZ 3.93Å; F328-Y549 WeakPolarHBondContact CE1-OH 3.29Å; F328-Y549 HydrophobicContact CZ-CD1 4.41Å; F328-Y549 AromaticContact CZ-CE1 3.56Å; F328-Y549 HydrophobicContact CZ-CE1 3.56Å
329	V	88.1	Confident	84.7	Confident	13 Å²	13	60.3 Å²	60.3	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-63.2	-43.4	172.4	168.4	0	0	0	0	110.8	I325 D326 E327 V331 C332 Q333 L544 F547	I325-V329 WeakPolarHBondContact O-CB 3.36Å; I325-V329 VanDerWaalsContact O-CG2 3.26Å; I325-V329 WeakPolarHBondContact O-CG2 3.25Å; I325-V329 PolarHBondContact O-N 3.27Å; D326-V329 PolarHBondContact O-N 3.02Å; E327-V329 PolarHBondContact O-N 3.21Å; V329-V331 VanDerWaalsContact C-N 3.33Å; V329-V331 PolarHBondContact O-N 2.83Å; V329-C332 PolarHBondContact O-N 2.84Å; V329-Q333 WeakPolarHBondContact O-CG 3.47Å; V329-Q333 PolarHBondContact O-N 2.84Å; V329-L544 HydrophobicContact CG2-CD2 3.87Å; V329-F547 HydrophobicContact CG1-CZ 4.36Å; V329-F547 HydrophobicContact CG2-CE2 4.36Å
330	N	89.1	Confident	83.1	Confident	75 Å²	75	62.1 Å²	62.1	40%	0.401	32%	0.321	S	S	.	.	H	α-helix	trans	-62.6	-38.2	175.2	-70.9	-38.2	0	0	0	112.1	D326 E327 R334	D326-N330 WeakPolarHBondContact O-CB 3.33Å; D326-N330 PolarHBondContact O-N 3.47Å; D326-N330 PolarHBondContact O-ND2 3.46Å; E327-N330 WeakPolarHBondContact O-CB 3.17Å; E327-N330 PolarHBondContact O-N 3.5Å; E327-N330 VanDerWaalsContact O-N 3.14Å; N330-R334 WeakPolarHBondContact O-CB 3.46Å; N330-R334 VanDerWaalsContact O-CG 3.24Å; N330-R334 WeakPolarHBondContact O-CG 3.34Å; N330-R334 PolarHBondContact O-N 3.35Å
331	V	87.2	Confident	81.3	Confident	17 Å²	17	64.4 Å²	64.4	10%	0.103	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-44.2	174	172.5	0	0	0	0	111.2	E327 F328 V329 Q333 R334 C335 E350 V351	E327-V331 WeakPolarHBondContact O-CG2 3.38Å; E327-V331 PolarHBondContact O-N 2.89Å; F328-V331 PolarHBondContact O-N 2.9Å; V329-V331 VanDerWaalsContact C-N 3.33Å; V329-V331 PolarHBondContact O-N 2.83Å; V331-Q333 VanDerWaalsContact C-N 3.31Å; V331-Q333 PolarHBondContact O-N 3.37Å; V331-R334 PolarHBondContact O-N 2.89Å; V331-C335 WeakPolarHBondContact O-CB 3.46Å; V331-C335 PolarHBondContact O-N 3.26Å; V331-C335 PolarHBondContact O-SG 3.39Å; V331-E350 HydrophobicContact CG1-CB 4.2Å; V331-E350 HydrophobicContact CG1-CG 4.01Å; V331-V351 HydrophobicContact CG1-CG2 4.04Å
332	C	84.6	Confident	79.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-62.1	-38.2	177.5	-67.3	0	0	0	0	112.4	F328 V329 N336 V337 F547	F328-C332 PolarHBondContact O-N 2.85Å; F328-C332 PolarHBondContact O-SG 3.47Å; V329-C332 PolarHBondContact O-N 2.84Å; C332-N336 PolarHBondContact O-N 2.97Å; C332-V337 HydrophobicContact CB-CB 4.27Å; C332-V337 HydrophobicContact CB-CG2 4.04Å; C332-V337 WeakPolarHBondContact O-CG2 3.35Å; C332-V337 PolarHBondContact O-N 2.81Å; C332-V337 VanDerWaalsContact O-N 3.08Å; C332-F547 HydrophobicContact CB-CD1 4Å; C332-F547 HydrophobicContact CB-CD2 4.44Å; C332-F547 HydrophobicContact CB-CE1 3.85Å; C332-F547 HydrophobicContact CB-CE2 4.31Å; C332-F547 HydrophobicContact CB-CG 4.29Å; C332-F547 HydrophobicContact CB-CZ 4.01Å
333	Q	84.2	Confident	77.3	Confident	109 Å²	109	68.3 Å²	68.3	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-48.6	173.9	-72.8	174.1	-11.8	0	0	111.9	V329 V331 C335 N336 F547	V329-Q333 WeakPolarHBondContact O-CG 3.47Å; V329-Q333 PolarHBondContact O-N 2.84Å; V331-Q333 VanDerWaalsContact C-N 3.31Å; V331-Q333 PolarHBondContact O-N 3.37Å; Q333-C335 PolarHBondContact O-N 2.79Å; Q333-N336 PolarHBondContact O-N 3.48Å; Q333-N336 VanDerWaalsContact O-N 3.12Å; Q333-N336 PolarHBondContact O-OD1 3.34Å; Q333-F547 HydrophobicContact CG-CZ 4.44Å
334	R	84.8	Confident	75.3	Confident	205 Å²	205	71 Å²	71	77%	0.774	38%	0.376	S	S	*	.	H	α-helix	trans	-60.1	-31.4	177.1	-73.4	169.8	-175.8	176.6	2.1	113.3	N330 V331	N330-R334 WeakPolarHBondContact O-CB 3.46Å; N330-R334 VanDerWaalsContact O-CG 3.24Å; N330-R334 WeakPolarHBondContact O-CG 3.34Å; N330-R334 PolarHBondContact O-N 3.35Å; V331-R334 PolarHBondContact O-N 2.89Å
335	C	78.5	Confident	73.5	Confident	41 Å²	41	74.4 Å²	74.4	28%	0.277	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.5	179.9	-60.3	0	0	0	0	113.9	V331 Q333 V337 P348 V351	V331-C335 WeakPolarHBondContact O-CB 3.46Å; V331-C335 PolarHBondContact O-N 3.26Å; V331-C335 PolarHBondContact O-SG 3.39Å; Q333-C335 PolarHBondContact O-N 2.79Å; C335-V337 HydrophobicContact CB-CG2 4.13Å; C335-V337 PolarHBondContact O-N 3.31Å; C335-P348 HydrophobicContact CB-CB 4.34Å; C335-P348 HydrophobicContact CB-CG 3.76Å; C335-V351 HydrophobicContact CB-CG2 4.17Å
336	N	70.2	Confident	72.2	Confident	146 Å²	146	80.2 Å²	80.2	78%	0.781	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	42.6	-176.3	-71.8	-27.7	0	0	0	113.6	C332 Q333	C332-N336 PolarHBondContact O-N 2.97Å; Q333-N336 PolarHBondContact O-N 3.48Å; Q333-N336 VanDerWaalsContact O-N 3.12Å; Q333-N336 PolarHBondContact O-OD1 3.34Å
337	V	67.3	Low	71.1	Confident	10 Å²	10	78.9 Å²	78.9	6%	0.061	42%	0.424	C	S	.	.			trans	-60	127.8	-178.7	176.5	0	0	0	0	110.1	C332 C335 L339 V351 F547 Y548	C332-V337 HydrophobicContact CB-CB 4.27Å; C332-V337 HydrophobicContact CB-CG2 4.04Å; C332-V337 WeakPolarHBondContact O-CG2 3.35Å; C332-V337 PolarHBondContact O-N 2.81Å; C332-V337 VanDerWaalsContact O-N 3.08Å; C335-V337 HydrophobicContact CB-CG2 4.13Å; C335-V337 PolarHBondContact O-N 3.31Å; V337-L339 PolarHBondContact O-N 3.41Å; V337-V351 HydrophobicContact CG2-CG2 3.75Å; V337-F547 HydrophobicContact CB-CD1 4.32Å; V337-F547 HydrophobicContact CG1-CB 4.06Å; V337-F547 HydrophobicContact CG1-CD1 4.46Å; V337-Y548 WeakPolarHBondContact CG1-O 3.34Å
338	P	64.6	Low	70.4	Confident	48 Å²	48	77.1 Å²	77.1	31%	0.312	42%	0.42	S	S	.	.			trans	-52.8	127.5	-173.9	-31	36.4	0	0	0	114.7	S340 Y548	P338-S340 VanDerWaalsContact CB-O 3.25Å; P338-S340 WeakPolarHBondContact CB-O 3.46Å; P338-Y548 PolarHBondContact O-N 3.48Å
339	L	61.6	Low	70	Confident	119 Å²	119	86.3 Å²	86.3	62%	0.623	46%	0.455	S	S	*	.	S	Bend	trans	-85.1	-19.8	167.1	-63.8	175.1	0	0	0	111.6	V337 R546 F547 Y548	V337-L339 PolarHBondContact O-N 3.41Å; L339-R546 WeakPolarHBondContact CD2-O 3.43Å; L339-F547 HydrophobicContact CD2-CD1 3.68Å; L339-F547 HydrophobicContact CD2-CE1 3.97Å; L339-F547 HydrophobicContact CD2-CG 4.35Å; L339-Y548 WeakPolarHBondContact O-CD2 3.42Å; L339-Y548 WeakPolarHBondContact O-CE2 3.46Å
340	S	57.4	Low	69.8	Low	86 Å²	86	90 Å²	90	60%	0.601	47%	0.471	S	S	*	.	S	Bend	trans	-95.9	167.1	169.4	49.7	0	0	0	0	111.9	P338 Y548	P338-S340 VanDerWaalsContact CB-O 3.25Å; P338-S340 WeakPolarHBondContact CB-O 3.46Å; S340-Y548 WeakPolarHBondContact O-CD2 3.43Å
341	L	56.1	Low	69.6	Low	129 Å²	129	86.4 Å²	86.4	68%	0.675	45%	0.452	S	S	*	.			trans	-44.4	144.2	-176.7	-104.6	68.8	0	0	0	112.9	S343 Y548	L341-S343 PolarHBondContact O-N 3.18Å; L341-S343 VanDerWaalsContact O-N 3.1Å; L341-Y548 HydrophobicContact CD1-CE1 4.47Å; L341-Y548 HydrophobicContact CD1-CE2 4.46Å
342	P	55	Low	69.6	Low	72 Å²	72	86.8 Å²	86.8	47%	0.468	45%	0.453	S	S	.	.			trans	-67.6	111.1	179.4	28.8	-33.5	0	0	0	110.6
343	S	45.7	Very low	69.7	Low	93 Å²	93	91.7 Å²	91.7	65%	0.65	47%	0.472	S	S	*	.			trans	-61.7	158.8	147.2	-56.3	0	0	0	0	109	L341 S345	L341-S343 PolarHBondContact O-N 3.18Å; L341-S343 VanDerWaalsContact O-N 3.1Å; S343-S345 PolarHBondContact O-N 2.93Å
344	E	50.9	Low	70	Confident	189 Å²	189	87 Å²	87	88%	0.883	45%	0.451	S	S	*	.	S	Bend	trans	-72.2	23	-168.7	-52.6	-165.8	117.8	0	0	115.6	D346	E344-D346 PolarHBondContact O-N 3.17Å
345	S	54.8	Low	70.2	Confident	79 Å²	79	77.2 Å²	77.2	55%	0.552	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-70.4	119.6	172.3	51.8	0	0	0	0	111.2	S343 T347	S343-S345 PolarHBondContact O-N 2.93Å; S345-T347 PolarHBondContact O-N 2.8Å
346	D	63.7	Low	70.6	Confident	121 Å²	121	77.4 Å²	77.4	65%	0.647	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-48.2	130.8	171.8	-149.4	9.8	0	0	0	110.3	E344	E344-D346 PolarHBondContact O-N 3.17Å
347	T	68.9	Low	71.6	Confident	14 Å²	14	79.6 Å²	79.6	9%	0.086	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-62.8	133	-174.9	44.7	0	0	0	0	111	S345 R349 S550	S345-T347 PolarHBondContact O-N 2.8Å; T347-R349 PolarHBondContact O-N 2.93Å; T347-S550 WeakPolarHBondContact CB-O 3.49Å; T347-S550 VanDerWaalsContact CG2-O 3.24Å; T347-S550 WeakPolarHBondContact CG2-O 3.3Å; T347-S550 PolarHBondContact OG1-O 3.14Å
348	P	76.6	Confident	72.7	Confident	53 Å²	53	81.1 Å²	81.1	34%	0.344	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-58	129.7	-173.5	16.1	-26.9	0	0	0	110.4	C335 E350 V351 L352	C335-P348 HydrophobicContact CB-CB 4.34Å; C335-P348 HydrophobicContact CB-CG 3.76Å; P348-E350 PolarHBondContact O-N 2.99Å; P348-V351 HydrophobicContact CG-CG2 3.88Å; P348-V351 WeakPolarHBondContact O-CB 3.49Å; P348-V351 PolarHBondContact O-N 3.45Å; P348-L352 PolarHBondContact O-N 2.98Å
349	R	81.4	Confident	74	Confident	193 Å²	193	78.8 Å²	78.8	73%	0.728	40%	0.401	S	S	*	.	H	α-helix	trans	-54.9	-20.6	-170.5	-65.1	-178.9	178.1	-175.8	-0.6	113.9	T347 R353	T347-R349 PolarHBondContact O-N 2.93Å; R349-R353 WeakPolarHBondContact O-CB 3.41Å; R349-R353 WeakPolarHBondContact O-CG 3.17Å; R349-R353 PolarHBondContact O-N 3.2Å; R349-R353 PolarHBondContact O-NE 3.25Å
350	E	83.9	Confident	75.5	Confident	90 Å²	90	73.1 Å²	73.1	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-47.6	172.5	-148.4	56.9	-123.4	0	0	112.7	V331 P348 R353 S354	V331-E350 HydrophobicContact CG1-CB 4.2Å; V331-E350 HydrophobicContact CG1-CG 4.01Å; P348-E350 PolarHBondContact O-N 2.99Å; E350-R353 PolarHBondContact O-N 3.05Å; E350-R353 IonicContact OE1-CZ 3.78Å; E350-R353 IonicContact OE1-NH1 3.41Å; E350-R353 PolarHBondContact OE1-NH1 2.94Å; E350-R353 IonicContact OE2-CZ 2.92Å; E350-R353 IonicContact OE2-NH1 2.99Å; E350-R353 PolarHBondContact OE2-NH1 2.84Å; E350-R353 IonicContact OE2-NH2 3.22Å; E350-R353 PolarHBondContact OE2-NH2 3.01Å; E350-S354 WeakPolarHBondContact O-CB 3.24Å; E350-S354 PolarHBondContact O-N 2.85Å
351	V	85	Confident	77.2	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-47.5	176.3	175.9	0	0	0	0	109.5	F328 V331 C335 V337 P348 R353 S354 V355 Y549 L551	F328-V351 HydrophobicContact CE2-CG1 3.63Å; F328-V351 HydrophobicContact CZ-CG1 4.02Å; V331-V351 HydrophobicContact CG1-CG2 4.04Å; C335-V351 HydrophobicContact CB-CG2 4.17Å; V337-V351 HydrophobicContact CG2-CG2 3.75Å; P348-V351 HydrophobicContact CG-CG2 3.88Å; P348-V351 WeakPolarHBondContact O-CB 3.49Å; P348-V351 PolarHBondContact O-N 3.45Å; V351-R353 PolarHBondContact O-N 3.27Å; V351-S354 PolarHBondContact O-N 2.85Å; V351-V355 WeakPolarHBondContact O-CG2 3.2Å; V351-V355 PolarHBondContact O-N 2.91Å; V351-Y549 HydrophobicContact CG1-CD1 4.45Å; V351-L551 HydrophobicContact CG1-CD2 4.43Å
352	L	86.3	Confident	78.9	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.131	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-39.9	176.9	179.6	59	0	0	0	112.8	P348 R356 L551 P552 L555	P348-L352 PolarHBondContact O-N 2.98Å; L352-R356 HydrophobicContact CD1-CG 4.21Å; L352-R356 WeakPolarHBondContact O-CG 3.48Å; L352-R356 PolarHBondContact O-N 3.05Å; L352-R356 VanDerWaalsContact O-N 3.12Å; L352-L551 HydrophobicContact CB-CD2 4.21Å; L352-L551 HydrophobicContact CD1-CD2 3.89Å; L352-P552 HydrophobicContact CD1-CG 4.1Å; L352-P552 HydrophobicContact CD2-CG 3.71Å; L352-L555 HydrophobicContact CD1-CD2 4.31Å; L352-L555 HydrophobicContact CD2-CD2 4.06Å; L352-L555 HydrophobicContact CG-CD2 4.42Å
353	R	87.4	Confident	80.7	Confident	103 Å²	103	61 Å²	61	39%	0.389	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-43	175.2	-81.9	-174.3	-84.6	99.6	-1.1	111.6	R349 E350 V351 R356 R357	R349-R353 WeakPolarHBondContact O-CB 3.41Å; R349-R353 WeakPolarHBondContact O-CG 3.17Å; R349-R353 PolarHBondContact O-N 3.2Å; R349-R353 PolarHBondContact O-NE 3.25Å; E350-R353 PolarHBondContact O-N 3.05Å; E350-R353 IonicContact OE1-CZ 3.78Å; E350-R353 IonicContact OE1-NH1 3.41Å; E350-R353 PolarHBondContact OE1-NH1 2.94Å; E350-R353 IonicContact OE2-CZ 2.92Å; E350-R353 IonicContact OE2-NH1 2.99Å; E350-R353 PolarHBondContact OE2-NH1 2.84Å; E350-R353 IonicContact OE2-NH2 3.22Å; E350-R353 PolarHBondContact OE2-NH2 3.01Å; V351-R353 PolarHBondContact O-N 3.27Å; R353-R356 PolarHBondContact O-N 3.33Å; R353-R357 WeakPolarHBondContact O-CB 3.42Å; R353-R357 WeakPolarHBondContact O-CG 3.42Å; R353-R357 PolarHBondContact O-N 3.45Å
354	S	89.1	Confident	82.9	Confident	10 Å²	10	59.7 Å²	59.7	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-47.7	175.8	-179.4	0	0	0	0	111.8	F328 E350 V351 R356 R357 T358 L359	F328-S354 WeakPolarHBondContact CD2-OG 3.43Å; E350-S354 WeakPolarHBondContact O-CB 3.24Å; E350-S354 PolarHBondContact O-N 2.85Å; V351-S354 PolarHBondContact O-N 2.85Å; S354-R356 VanDerWaalsContact C-N 3.35Å; S354-R356 PolarHBondContact O-N 2.97Å; S354-R357 PolarHBondContact O-N 3.14Å; S354-T358 PolarHBondContact O-N 3.3Å; S354-T358 PolarHBondContact O-OG1 3.26Å; S354-T358 PolarHBondContact OG-OG1 3.43Å; S354-L359 PolarHBondContact O-N 3.25Å
355	V	89.1	Confident	84.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-52.8	-51.4	173.9	173.7	0	0	0	0	111.1	F328 V351 C360 L500 L551	F328-V355 HydrophobicContact CD2-CG2 4.24Å; F328-V355 HydrophobicContact CE1-CG2 4.35Å; F328-V355 HydrophobicContact CE2-CG2 3.35Å; F328-V355 HydrophobicContact CZ-CG2 3.42Å; F328-V355 VanDerWaalsContact CZ-CG2 3.42Å; V351-V355 WeakPolarHBondContact O-CG2 3.2Å; V351-V355 PolarHBondContact O-N 2.91Å; V355-C360 VanDerWaalsContact O-CB 3.29Å; V355-C360 WeakPolarHBondContact O-CB 3.23Å; V355-C360 PolarHBondContact O-N 3.08Å; V355-C360 PolarHBondContact O-SG 2.8Å; V355-L500 HydrophobicContact CG1-CD1 3.94Å; V355-L500 HydrophobicContact CG2-CD1 3.92Å; V355-L551 HydrophobicContact CG1-CD1 4.48Å; V355-L551 HydrophobicContact CG2-CD1 4.03Å; V355-L551 HydrophobicContact CG2-CD2 4.29Å
356	R	88.1	Confident	86.5	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	23%	0.225	C	C	.	.	I	π-helix	trans	-82.2	-20.9	-171	-65.7	-176.4	70.9	96.2	-2.9	114.6	L352 R353 S354 K493	L352-R356 HydrophobicContact CD1-CG 4.21Å; L352-R356 WeakPolarHBondContact O-CG 3.48Å; L352-R356 PolarHBondContact O-N 3.05Å; L352-R356 VanDerWaalsContact O-N 3.12Å; R353-R356 PolarHBondContact O-N 3.33Å; S354-R356 VanDerWaalsContact C-N 3.35Å; S354-R356 PolarHBondContact O-N 2.97Å; R356-K493 WeakPolarHBondContact O-CE 3.44Å
357	R	90.8	Very high	87.8	Confident	191 Å²	191	43.7 Å²	43.7	72%	0.721	19%	0.194	S	C	*	.	I	π-helix	trans	-107.3	-28.7	-177.1	-66.6	-174.2	170.3	-172.6	-3.4	115.3	R353 S354 P361	R353-R357 WeakPolarHBondContact O-CB 3.42Å; R353-R357 WeakPolarHBondContact O-CG 3.42Å; R353-R357 PolarHBondContact O-N 3.45Å; S354-R357 PolarHBondContact O-N 3.14Å; R357-P361 WeakPolarHBondContact O-CG 3.49Å
358	T	90.6	Very high	88.7	Confident	42 Å²	42	45.2 Å²	45.2	26%	0.258	21%	0.205	S	C	.	.	I	π-helix	trans	-115.3	-55	179.5	66.8	0	0	0	0	112	E327 S354 S362	E327-T358 VanDerWaalsContact OE2-CB 3.27Å; E327-T358 WeakPolarHBondContact OE2-CB 3.46Å; E327-T358 VanDerWaalsContact OE2-CG2 3.3Å; E327-T358 WeakPolarHBondContact OE2-CG2 3.46Å; E327-T358 PolarHBondContact OE2-OG1 2.93Å; S354-T358 PolarHBondContact O-N 3.3Å; S354-T358 PolarHBondContact O-OG1 3.26Å; S354-T358 PolarHBondContact OG-OG1 3.43Å; T358-S362 WeakPolarHBondContact O-CB 3.13Å; T358-S362 PolarHBondContact O-N 2.82Å; T358-S362 PolarHBondContact O-OG 2.88Å
359	L	91.9	Very high	89.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-66.7	-45.4	-177.2	-177	65.4	0	0	0	114.1	L321 I325 F328 S354 S362 L363 L500 L541 L544	L321-L359 HydrophobicContact CD1-CD1 4.07Å; I325-L359 HydrophobicContact CG1-CD1 3.74Å; F328-L359 HydrophobicContact CD1-CD2 4.01Å; F328-L359 HydrophobicContact CE1-CD2 4.14Å; S354-L359 PolarHBondContact O-N 3.25Å; L359-S362 PolarHBondContact O-OG 3.28Å; L359-S362 VanDerWaalsContact O-OG 3.13Å; L359-L363 WeakPolarHBondContact O-CB 3.5Å; L359-L363 PolarHBondContact O-N 3.46Å; L359-L500 HydrophobicContact CD2-CD1 4.24Å; L359-L541 HydrophobicContact CD1-CD2 4.4Å; L359-L544 HydrophobicContact CD1-CD1 4.28Å; L359-L544 HydrophobicContact CD2-CD1 3.78Å
360	C	92.7	Very high	89.3	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67	-45.3	-179.4	-71.3	0	0	0	0	112.6	V355 R364 K493	V355-C360 VanDerWaalsContact O-CB 3.29Å; V355-C360 WeakPolarHBondContact O-CB 3.23Å; V355-C360 PolarHBondContact O-N 3.08Å; V355-C360 PolarHBondContact O-SG 2.8Å; C360-R364 WeakPolarHBondContact O-CB 3.47Å; C360-R364 PolarHBondContact O-N 2.9Å; C360-K493 HydrophobicContact CB-CD 4.44Å; C360-K493 HydrophobicContact CB-CG 3.71Å
361	P	92.3	Very high	89.4	Confident	25 Å²	25	32 Å²	32	16%	0.162	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-47.2	173.4	-27.4	39.2	0	0	0	113.4	R357 L363 R364 D365	R357-P361 WeakPolarHBondContact O-CG 3.49Å; P361-L363 VanDerWaalsContact C-N 3.32Å; P361-L363 PolarHBondContact O-N 3.28Å; P361-R364 WeakPolarHBondContact O-CB 3.42Å; P361-R364 PolarHBondContact O-N 3.32Å; P361-D365 WeakPolarHBondContact O-CB 3.39Å; P361-D365 PolarHBondContact O-N 2.86Å
362	S	92.6	Very high	89.4	Confident	8 Å²	8	35.2 Å²	35.2	6%	0.056	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-38.7	-178.8	67.1	0	0	0	0	112.8	L321 S324 T358 L359 L366	L321-S362 WeakPolarHBondContact CD1-OG 3.34Å; S324-S362 WeakPolarHBondContact OG-CB 3.38Å; S324-S362 PolarHBondContact OG-OG 3.03Å; T358-S362 WeakPolarHBondContact O-CB 3.13Å; T358-S362 PolarHBondContact O-N 2.82Å; T358-S362 PolarHBondContact O-OG 2.88Å; L359-S362 PolarHBondContact O-OG 3.28Å; L359-S362 VanDerWaalsContact O-OG 3.13Å; S362-L366 WeakPolarHBondContact O-CB 3.42Å; S362-L366 PolarHBondContact O-N 3.02Å; S362-L366 VanDerWaalsContact O-N 3.15Å
363	L	92.9	Very high	89	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69	-42.9	174.6	-177.5	62.1	0	0	0	111.8	L321 L359 P361 L367 F492 V496 L505 L509 T537 L541	L321-L363 HydrophobicContact CD1-CB 4.07Å; L321-L363 HydrophobicContact CD1-CD1 4.44Å; L321-L363 HydrophobicContact CD2-CD1 4.04Å; L359-L363 WeakPolarHBondContact O-CB 3.5Å; L359-L363 PolarHBondContact O-N 3.46Å; P361-L363 VanDerWaalsContact C-N 3.32Å; P361-L363 PolarHBondContact O-N 3.28Å; L363-L367 HydrophobicContact CD1-CD1 3.78Å; L363-L367 HydrophobicContact CD1-CG 4.17Å; L363-L367 HydrophobicContact CG-CD1 3.86Å; L363-L367 WeakPolarHBondContact O-CB 3.14Å; L363-L367 WeakPolarHBondContact O-CG 3.44Å; L363-L367 PolarHBondContact O-N 2.7Å; L363-F492 HydrophobicContact CD2-CZ 4.34Å; L363-F492 HydrophobicContact CG-CZ 4.32Å; L363-V496 HydrophobicContact CD2-CG2 4.22Å; L363-L505 HydrophobicContact CD2-CD1 4.46Å; L363-L509 HydrophobicContact CD1-CD1 4.42Å; L363-L509 HydrophobicContact CD2-CD1 4.22Å; L363-T537 HydrophobicContact CD1-CG2 4.12Å; L363-L541 HydrophobicContact CD1-CD1 4.02Å
364	R	91.7	Very high	88.3	Confident	64 Å²	64	36 Å²	36	24%	0.242	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-49	174.5	175.9	-161.5	66.6	-169.2	5.6	110.6	C360 P361 L367 S368 H399 V400 D489 F492	C360-R364 WeakPolarHBondContact O-CB 3.47Å; C360-R364 PolarHBondContact O-N 2.9Å; P361-R364 WeakPolarHBondContact O-CB 3.42Å; P361-R364 PolarHBondContact O-N 3.32Å; R364-L367 CarbonylContact O-C 3.56Å; R364-L367 PolarHBondContact O-N 3.25Å; R364-S368 VanDerWaalsContact O-CB 3.3Å; R364-S368 WeakPolarHBondContact O-CB 3.47Å; R364-S368 PolarHBondContact O-N 3.25Å; R364-S368 PolarHBondContact O-OG 3.17Å; R364-H399 WeakPolarHBondContact CD-NE2 3.45Å; R364-H399 WeakPolarHBondContact CG-NE2 3.23Å; R364-V400 HydrophobicContact CG-CG2 4.1Å; R364-V400 VanDerWaalsContact O-CG2 3.32Å; R364-V400 WeakPolarHBondContact O-CG2 3.25Å; R364-D489 IonicContact NH1-OD1 3.61Å; R364-D489 PolarHBondContact NH1-OD1 3.23Å; R364-F492 HydrophobicContact CB-CD1 4.27Å; R364-F492 HydrophobicContact CB-CE1 3.84Å
365	D	90.7	Very high	87.3	Confident	54 Å²	54	35.6 Å²	35.6	29%	0.289	18%	0.179	S	C	.	.	H	α-helix	trans	-67.5	-43.5	-171.8	-63.2	-15.8	0	0	0	110.3	L317 P361 L367 S368 H369	L317-D365 HydrophobicContact CD2-CB 4.37Å; P361-D365 WeakPolarHBondContact O-CB 3.39Å; P361-D365 PolarHBondContact O-N 2.86Å; D365-L367 PolarHBondContact O-N 3.45Å; D365-S368 PolarHBondContact O-N 2.9Å; D365-S368 PolarHBondContact O-OG 3.16Å; D365-H369 PolarHBondContact O-N 2.94Å
366	L	90.8	Very high	86.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-43.3	171.7	-177.6	65.4	0	0	0	113	L317 R318 L321 S362 S368 H369 Y528 T537	L317-L366 HydrophobicContact CB-CB 4.29Å; L317-L366 HydrophobicContact CB-CD1 3.75Å; R318-L366 HydrophobicContact CB-CD1 4.39Å; L321-L366 HydrophobicContact CB-CD2 4.34Å; L321-L366 HydrophobicContact CD2-CD2 3.46Å; L321-L366 VanDerWaalsContact CD2-CD2 3.46Å; S362-L366 WeakPolarHBondContact O-CB 3.42Å; S362-L366 PolarHBondContact O-N 3.02Å; S362-L366 VanDerWaalsContact O-N 3.15Å; L366-S368 VanDerWaalsContact C-N 3.32Å; L366-H369 PolarHBondContact O-N 3.47Å; L366-Y528 HydrophobicContact CD1-CD1 3.62Å; L366-Y528 HydrophobicContact CD1-CD2 4.05Å; L366-Y528 HydrophobicContact CD1-CE1 3.9Å; L366-Y528 HydrophobicContact CD1-CE2 4.29Å; L366-Y528 HydrophobicContact CD1-CG 3.71Å; L366-Y528 HydrophobicContact CD2-CD1 4.18Å; L366-Y528 HydrophobicContact CD2-CE1 3.76Å; L366-Y528 HydrophobicContact CG-CD1 3.74Å; L366-Y528 HydrophobicContact CG-CE1 3.86Å; L366-Y528 HydrophobicContact CG-CG 4.34Å; L366-T537 HydrophobicContact CD2-CG2 4.44Å
367	L	90.2	Very high	85.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-75.7	-18.4	179.6	-66.5	173.8	0	0	0	113.2	L363 R364 D365 V400 F492 L509 F513 Y523 I529 I534	L363-L367 HydrophobicContact CD1-CD1 3.78Å; L363-L367 HydrophobicContact CD1-CG 4.17Å; L363-L367 HydrophobicContact CG-CD1 3.86Å; L363-L367 WeakPolarHBondContact O-CB 3.14Å; L363-L367 WeakPolarHBondContact O-CG 3.44Å; L363-L367 PolarHBondContact O-N 2.7Å; R364-L367 CarbonylContact O-C 3.56Å; R364-L367 PolarHBondContact O-N 3.25Å; D365-L367 PolarHBondContact O-N 3.45Å; L367-V400 HydrophobicContact CB-CB 4.45Å; L367-V400 HydrophobicContact CB-CG1 3.71Å; L367-V400 HydrophobicContact CB-CG2 3.8Å; L367-V400 HydrophobicContact CD1-CG1 3.92Å; L367-V400 HydrophobicContact CG-CG1 4.48Å; L367-F492 HydrophobicContact CD1-CZ 4.3Å; L367-L509 HydrophobicContact CD1-CD2 4.11Å; L367-F513 HydrophobicContact CD1-CE2 3.91Å; L367-F513 HydrophobicContact CD1-CZ 4.1Å; L367-F513 HydrophobicContact CD2-CD2 4.31Å; L367-F513 HydrophobicContact CD2-CE2 3.85Å; L367-F513 HydrophobicContact CD2-CZ 4.02Å; L367-F513 HydrophobicContact CG-CE2 4.45Å; L367-F513 HydrophobicContact CG-CZ 4.45Å; L367-Y523 VanDerWaalsContact O-CE1 3.27Å; L367-Y523 WeakPolarHBondContact O-CE1 3.41Å; L367-Y523 PolarHBondContact O-OH 3.17Å; L367-I529 HydrophobicContact CB-CD1 4.45Å; L367-I529 HydrophobicContact CD2-CD1 3.53Å; L367-I529 HydrophobicContact CD2-CG1 4.16Å; L367-I534 HydrophobicContact CD2-CD1 3.62Å
368	S	89.1	Confident	83.7	Confident	46 Å²	46	37.3 Å²	37.3	32%	0.322	20%	0.196	S	C	.	.	H	α-helix	trans	-80.8	-16.6	175.8	74.5	0	0	0	0	113.6	R364 D365 L366 G370 L371	R364-S368 VanDerWaalsContact O-CB 3.3Å; R364-S368 WeakPolarHBondContact O-CB 3.47Å; R364-S368 PolarHBondContact O-N 3.25Å; R364-S368 PolarHBondContact O-OG 3.17Å; D365-S368 PolarHBondContact O-N 2.9Å; D365-S368 PolarHBondContact O-OG 3.16Å; L366-S368 VanDerWaalsContact C-N 3.32Å; S368-G370 PolarHBondContact O-N 2.9Å; S368-L371 VanDerWaalsContact O-CB 3.25Å; S368-L371 WeakPolarHBondContact O-CB 3.42Å; S368-L371 PolarHBondContact O-N 3.39Å
369	H	87.9	Confident	82.5	Confident	24 Å²	24	37.4 Å²	37.4	11%	0.111	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	103.7	-176.4	175.6	-65.1	0	0	0	111.8	W314 L317 D365 L366 W526 S527 Y528	W314-H369 AromaticContact CD1-CE1 3.87Å; W314-H369 AromaticContact CD1-NE2 3.77Å; L317-H369 HydrophobicContact CD1-CB 4Å; D365-H369 PolarHBondContact O-N 2.94Å; L366-H369 PolarHBondContact O-N 3.47Å; H369-W526 AromaticContact CE1-CE3 3.68Å; H369-W526 AromaticContact CE1-CZ3 3.69Å; H369-W526 AromaticContact ND1-CZ3 3.88Å; H369-S527 WeakPolarHBondContact O-CA 3.21Å; H369-S527 WeakPolarHBondContact O-CB 3.43Å; H369-Y528 PolarHBondContact ND1-N 3.35Å; H369-Y528 PolarHBondContact O-N 2.93Å
370	G	83.1	Confident	81.2	Confident	7 Å²	7	47.2 Å²	47.2	7%	0.072	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	20.6	-178.2	0	0	0	0	0	114.4	S368 Y523 A524 W526	S368-G370 PolarHBondContact O-N 2.9Å; G370-Y523 WeakPolarHBondContact O-CA 3.35Å; G370-A524 PolarHBondContact O-N 3.48Å; G370-W526 VanDerWaalsContact CA-CH2 3.49Å
371	L	86	Confident	79.7	Confident	28 Å²	28	52.7 Å²	52.7	15%	0.147	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-73	137.8	169.9	-173	67.4	0	0	0	110.6	S368 A375 V398 V403 C522 Y523	S368-L371 VanDerWaalsContact O-CB 3.25Å; S368-L371 WeakPolarHBondContact O-CB 3.42Å; S368-L371 PolarHBondContact O-N 3.39Å; L371-A375 HydrophobicContact CD1-CB 4.13Å; L371-V398 HydrophobicContact CD2-CB 4.03Å; L371-V398 HydrophobicContact CD2-CG1 3.64Å; L371-V398 HydrophobicContact CG-CB 4.35Å; L371-V398 HydrophobicContact CG-CG1 3.76Å; L371-V403 HydrophobicContact CD1-CG2 3.35Å; L371-C522 HydrophobicContact CD1-CB 4.22Å; L371-Y523 HydrophobicContact CB-CE1 4.16Å; L371-Y523 HydrophobicContact CD1-CE1 4.02Å; L371-Y523 HydrophobicContact CD1-CE2 4.04Å
372	L	84.4	Confident	78.3	Confident	67 Å²	67	51.7 Å²	51.7	35%	0.351	25%	0.251	S	S	.	.			trans	-103.9	146.8	-175.3	-63.1	171.3	0	0	0	112	S374 A375 V398 C522 A524	L372-S374 WeakPolarHBondContact CB-OG 3.34Å; L372-S374 PolarHBondContact O-N 2.85Å; L372-A375 WeakPolarHBondContact O-CB 3.36Å; L372-A375 PolarHBondContact O-N 3.44Å; L372-V398 WeakPolarHBondContact O-CG1 3.34Å; L372-C522 WeakPolarHBondContact CB-O 3.38Å; L372-C522 PolarHBondContact N-O 2.9Å; L372-A524 HydrophobicContact CD2-CB 4.19Å
373	D	78.4	Confident	76.8	Confident	104 Å²	104	52.1 Å²	52.1	56%	0.556	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-57.6	-19.5	173.4	-82.5	-80.1	0	0	0	114.1	A375 K376 V398	D373-A375 PolarHBondContact O-N 3.39Å; D373-A375 VanDerWaalsContact O-N 3.16Å; D373-K376 WeakPolarHBondContact O-CB 3.46Å; D373-K376 PolarHBondContact O-N 3.19Å; D373-K376 VanDerWaalsContact OD1-CE 3.31Å; D373-K376 WeakPolarHBondContact OD1-CE 3.4Å; D373-K376 IonicContact OD1-NZ 3.08Å; D373-K376 PolarHBondContact OD1-NZ 2.63Å; D373-V398 HydrophobicContact CB-CG2 4.24Å; D373-V398 WeakPolarHBondContact OD1-CG2 3.39Å
374	S	72	Confident	75.3	Confident	39 Å²	39	56 Å²	56	27%	0.273	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-56.5	-25.5	169.6	46.2	0	0	0	0	113.5	L372 K376 K377 E521	L372-S374 WeakPolarHBondContact CB-OG 3.34Å; L372-S374 PolarHBondContact O-N 2.85Å; S374-K376 PolarHBondContact O-N 2.78Å; S374-K377 VanDerWaalsContact O-CB 3.3Å; S374-K377 WeakPolarHBondContact O-CB 3.45Å; S374-K377 VanDerWaalsContact O-CG 3.28Å; S374-K377 WeakPolarHBondContact O-CG 3.43Å; S374-K377 PolarHBondContact O-N 2.95Å; S374-K377 VanDerWaalsContact O-N 3.1Å; S374-E521 WeakPolarHBondContact CB-O 3.48Å; S374-E521 PolarHBondContact OG-O 3.01Å
375	A	68	Low	74.1	Confident	3 Å²	3	56.6 Å²	56.6	3%	0.025	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-66.4	-14.3	174.5	0	0	0	0	0	113.8	L371 L372 D373 K377 V398 N402 C522	L371-A375 HydrophobicContact CD1-CB 4.13Å; L372-A375 WeakPolarHBondContact O-CB 3.36Å; L372-A375 PolarHBondContact O-N 3.44Å; D373-A375 PolarHBondContact O-N 3.39Å; D373-A375 VanDerWaalsContact O-N 3.16Å; A375-K377 VanDerWaalsContact C-N 3.27Å; A375-V398 HydrophobicContact CB-CG1 3.87Å; A375-N402 HydrophobicContact CB-CB 4.5Å; A375-N402 WeakPolarHBondContact O-CB 3.3Å; A375-C522 HydrophobicContact CB-CB 3.95Å
376	K	69	Low	73	Confident	59 Å²	59	55.6 Å²	55.6	26%	0.257	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-73.7	-15.2	171.2	-69.1	170.7	168.2	166.8	0	113.2	D373 S374 R379 E395 Q396 V398	D373-K376 WeakPolarHBondContact O-CB 3.46Å; D373-K376 PolarHBondContact O-N 3.19Å; D373-K376 VanDerWaalsContact OD1-CE 3.31Å; D373-K376 WeakPolarHBondContact OD1-CE 3.4Å; D373-K376 IonicContact OD1-NZ 3.08Å; D373-K376 PolarHBondContact OD1-NZ 2.63Å; S374-K376 PolarHBondContact O-N 2.78Å; K376-R379 PolarHBondContact O-N 2.87Å; K376-E395 IonicContact NZ-OE2 2.72Å; K376-E395 PolarHBondContact NZ-OE2 3.44Å; K376-Q396 WeakPolarHBondContact CE-O 3.23Å; K376-V398 HydrophobicContact CD-CG2 4.46Å; K376-V398 HydrophobicContact CG-CG1 4.49Å; K376-V398 HydrophobicContact CG-CG2 4.47Å
377	K	61.2	Low	71.6	Confident	144 Å²	144	56.5 Å²	56.5	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	144.5	-178	-70.2	177.9	178.5	-177.2	0	110.9	S374 A375 R379	S374-K377 VanDerWaalsContact O-CB 3.3Å; S374-K377 WeakPolarHBondContact O-CB 3.45Å; S374-K377 VanDerWaalsContact O-CG 3.28Å; S374-K377 WeakPolarHBondContact O-CG 3.43Å; S374-K377 PolarHBondContact O-N 2.95Å; S374-K377 VanDerWaalsContact O-N 3.1Å; A375-K377 VanDerWaalsContact C-N 3.27Å; K377-R379 PolarHBondContact O-N 3.35Å
378	D	63.1	Low	70	Confident	70 Å²	70	66.4 Å²	66.4	37%	0.374	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	4.3	178.7	-54.2	-10.9	0	0	0	117.1	R380 L381 R406 L409	D378-R380 PolarHBondContact O-N 3.27Å; D378-R380 VanDerWaalsContact O-N 3.13Å; D378-L381 HydrophobicContact CB-CD1 4.09Å; D378-L381 HydrophobicContact CB-CG 4.49Å; D378-L381 WeakPolarHBondContact O-CB 3.26Å; D378-L381 PolarHBondContact O-N 2.93Å; D378-R406 IonicContact OD2-CZ 3.3Å; D378-R406 IonicContact OD2-NH1 3Å; D378-R406 PolarHBondContact OD2-NH1 3.4Å; D378-L409 HydrophobicContact CB-CD1 3.81Å
379	R	65.5	Low	68.3	Low	44 Å²	44	70.5 Å²	70.5	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-53.6	-35.1	173.6	-163.4	-168.3	-171.7	-157.8	8	113	K376 K377 L381 L382 I383 N488	K376-R379 PolarHBondContact O-N 2.87Å; K377-R379 PolarHBondContact O-N 3.35Å; R379-L381 VanDerWaalsContact C-N 3.31Å; R379-L381 PolarHBondContact O-N 2.99Å; R379-L382 PolarHBondContact O-N 2.89Å; R379-I383 HydrophobicContact CG-CD1 3.95Å; R379-I383 HydrophobicContact CG-CG1 4.45Å; R379-I383 WeakPolarHBondContact O-CG1 3.46Å; R379-I383 PolarHBondContact O-N 3.19Å; R379-N488 PolarHBondContact NH2-ND2 3.49Å; R379-N488 PolarHBondContact NH2-OD1 2.86Å
380	R	62.8	Low	66.5	Low	205 Å²	205	75.7 Å²	75.7	77%	0.774	37%	0.365	S	S	*	.	H	α-helix	trans	-58.3	-39	176.2	-67.3	-173.3	-178.7	-179.5	-1.3	112.6	D378 L382 I383 S384	D378-R380 PolarHBondContact O-N 3.27Å; D378-R380 VanDerWaalsContact O-N 3.13Å; R380-L382 VanDerWaalsContact C-N 3.31Å; R380-L382 PolarHBondContact O-N 3.2Å; R380-I383 PolarHBondContact O-N 3.45Å; R380-S384 WeakPolarHBondContact O-CB 3.43Å; R380-S384 PolarHBondContact O-N 3.03Å
381	L	61.9	Low	64.8	Low	115 Å²	115	80.5 Å²	80.5	60%	0.602	39%	0.39	S	S	*	.	H	α-helix	trans	-66.5	-32.1	179.9	-59.6	-179.2	0	0	0	112.4	D378 R379	D378-L381 HydrophobicContact CB-CD1 4.09Å; D378-L381 HydrophobicContact CB-CG 4.49Å; D378-L381 WeakPolarHBondContact O-CB 3.26Å; D378-L381 PolarHBondContact O-N 2.93Å; R379-L381 VanDerWaalsContact C-N 3.31Å; R379-L381 PolarHBondContact O-N 2.99Å
382	L	62.7	Low	63	Low	5 Å²	5	86.8 Å²	86.8	3%	0.026	42%	0.423	C	S	.	.	H	α-helix	trans	-76.9	-41.8	173.5	-69.5	175.5	0	0	0	112.1	R379 R380 R385 Y386 E405 Y408 L409 L478	R379-L382 PolarHBondContact O-N 2.89Å; R380-L382 VanDerWaalsContact C-N 3.31Å; R380-L382 PolarHBondContact O-N 3.2Å; L382-R385 WeakPolarHBondContact O-CB 3.28Å; L382-R385 PolarHBondContact O-N 3.05Å; L382-Y386 WeakPolarHBondContact O-CD2 3.37Å; L382-E405 HydrophobicContact CD1-CB 3.62Å; L382-E405 HydrophobicContact CD1-CG 3.89Å; L382-Y408 HydrophobicContact CD2-CD1 3.86Å; L382-Y408 HydrophobicContact CD2-CE1 3.59Å; L382-L409 HydrophobicContact CD1-CD1 4.06Å; L382-L409 HydrophobicContact CD1-CG 4.1Å; L382-L409 HydrophobicContact CD2-CD2 3.62Å; L382-L409 HydrophobicContact CD2-CG 4Å; L382-L409 HydrophobicContact CG-CD1 4.07Å; L382-L409 HydrophobicContact CG-CD2 3.96Å; L382-L409 HydrophobicContact CG-CG 4.04Å; L382-L478 HydrophobicContact CD2-CD1 4.47Å
383	I	61.3	Low	61.5	Low	16 Å²	16	86.7 Å²	86.7	8%	0.082	42%	0.42	C	S	.	.	H	α-helix	trans	-62.7	-45.8	-179	-69.7	170.6	0	0	0	110.9	R379 R380 R385 Y386 C387 F393 V482	R379-I383 HydrophobicContact CG-CD1 3.95Å; R379-I383 HydrophobicContact CG-CG1 4.45Å; R379-I383 WeakPolarHBondContact O-CG1 3.46Å; R379-I383 PolarHBondContact O-N 3.19Å; R380-I383 PolarHBondContact O-N 3.45Å; I383-R385 PolarHBondContact O-N 3.3Å; I383-R385 VanDerWaalsContact O-N 3.12Å; I383-Y386 PolarHBondContact O-N 3.36Å; I383-C387 HydrophobicContact CG2-CB 4.14Å; I383-C387 PolarHBondContact O-N 3.06Å; I383-F393 HydrophobicContact CD1-CD1 4.36Å; I383-F393 HydrophobicContact CD1-CD2 4.47Å; I383-F393 HydrophobicContact CD1-CE1 4.42Å; I383-F393 HydrophobicContact CD1-CG 4.37Å; I383-F393 HydrophobicContact CG2-CD2 4.41Å; I383-F393 HydrophobicContact CG2-CE1 4.43Å; I383-F393 HydrophobicContact CG2-CE2 3.62Å; I383-F393 HydrophobicContact CG2-CZ 3.61Å; I383-V482 HydrophobicContact CG1-CG1 4.33Å
384	S	62.3	Low	60.5	Low	82 Å²	82	90 Å²	90	57%	0.573	43%	0.432	S	S	*	.	H	α-helix	trans	-54.8	-30.9	178	-178.8	0	0	0	0	113.5	R380 Y386	R380-S384 WeakPolarHBondContact O-CB 3.43Å; R380-S384 PolarHBondContact O-N 3.03Å; S384-Y386 PolarHBondContact O-N 3.29Å
385	R	66.1	Low	59.9	Low	77 Å²	77	96 Å²	96	29%	0.291	46%	0.456	S	S	.	.	H	α-helix	trans	-70.2	-27.4	177.2	-165.5	178.7	-174.7	-124.1	3.4	113.7	L382 I383 Y408 N414 D418 D475	L382-R385 WeakPolarHBondContact O-CB 3.28Å; L382-R385 PolarHBondContact O-N 3.05Å; I383-R385 PolarHBondContact O-N 3.3Å; I383-R385 VanDerWaalsContact O-N 3.12Å; R385-Y408 PolarHBondContact NH1-OH 2.92Å; R385-N414 PolarHBondContact NH2-O 3.17Å; R385-D418 IonicContact CZ-OD1 3.74Å; R385-D418 IonicContact CZ-OD2 3.48Å; R385-D418 IonicContact NE-OD1 3.29Å; R385-D418 IonicContact NE-OD2 2.65Å; R385-D418 IonicContact NH2-OD1 3.75Å; R385-D418 PolarHBondContact NH2-OD1 3.45Å; R385-D418 IonicContact NH2-OD2 3.2Å; R385-D418 PolarHBondContact NH2-OD2 2.9Å; R385-D475 IonicContact NH1-OD1 2.7Å; R385-D475 PolarHBondContact NH1-OD1 2.81Å
386	Y	67.2	Low	59.7	Low	33 Å²	33	98.6 Å²	98.6	13%	0.129	47%	0.468	C	S	.	.	H	α-helix	trans	-116.3	-15.1	-174.2	-54.2	-67.5	0	0	0	114.3	L382 I383 S384 Y408 D475 L478 V482	L382-Y386 WeakPolarHBondContact O-CD2 3.37Å; I383-Y386 PolarHBondContact O-N 3.36Å; S384-Y386 PolarHBondContact O-N 3.29Å; Y386-Y408 PolarHBondContact OH-OH 3.22Å; Y386-D475 PolarHBondContact OH-OD1 3.38Å; Y386-L478 HydrophobicContact CD2-CB 4.24Å; Y386-L478 HydrophobicContact CE2-CB 3.58Å; Y386-L478 HydrophobicContact CE2-CD1 4.23Å; Y386-L478 HydrophobicContact CE2-CG 4.44Å; Y386-V482 HydrophobicContact CD2-CB 4.16Å; Y386-V482 HydrophobicContact CD2-CG1 4.2Å; Y386-V482 HydrophobicContact CD2-CG2 4.4Å; Y386-V482 HydrophobicContact CG-CB 4.39Å
387	C	61.9	Low	59.8	Low	19 Å²	19	100.8 Å²	100.8	13%	0.128	49%	0.488	C	S	.	.			trans	-132.1	128.3	-179.5	-66.9	0	0	0	0	110.7	I383 H389 V482	I383-C387 HydrophobicContact CG2-CB 4.14Å; I383-C387 PolarHBondContact O-N 3.06Å; C387-H389 VanDerWaalsContact C-N 3.3Å; C387-H389 PolarHBondContact O-N 3.27Å; C387-V482 PolarHBondContact SG-O 3.16Å; C387-V482 VanDerWaalsContact SG-O 3.36Å
388	K	56.5	Low	60.6	Low	208 Å²	208	95.5 Å²	95.5	90%	0.904	47%	0.468	S	S	*	.	S	Bend	trans	-87.2	16.4	-179.7	-62.5	-173	176.9	-176.5	0	114.7
389	H	53.1	Low	61.8	Low	131 Å²	131	93.2 Å²	93.2	61%	0.606	46%	0.455	S	S	*	.			trans	-131.5	122	-177.2	-63.1	-45	0	0	0	109.8	C387 D391	C387-H389 VanDerWaalsContact C-N 3.3Å; C387-H389 PolarHBondContact O-N 3.27Å; H389-D391 VanDerWaalsContact C-N 3.28Å; H389-D391 PolarHBondContact O-N 3.24Å
390	D	49.2	Very low	62.9	Low	133 Å²	133	91.1 Å²	91.1	71%	0.711	45%	0.447	S	S	*	.			trans	-99.3	38.5	-172.9	-133.2	-15.4	0	0	0	110.6
391	D	48	Very low	64.2	Low	109 Å²	109	81.3 Å²	81.3	58%	0.583	41%	0.41	S	S	*	.			trans	-118.7	127.3	-170.3	-61.8	-77.1	0	0	0	112.3	H389 R485	H389-D391 VanDerWaalsContact C-N 3.28Å; H389-D391 PolarHBondContact O-N 3.24Å; D391-R485 PolarHBondContact O-NH1 2.86Å; D391-R485 PolarHBondContact O-NH2 3.33Å; D391-R485 VanDerWaalsContact O-NH2 3.16Å
392	D	49.3	Very low	65.3	Low	159 Å²	159	76 Å²	76	85%	0.85	38%	0.382	S	S	*	.			trans	31.8	82.9	168.6	-69.6	-19.8	0	0	0	116.4
393	F	53	Low	66.5	Low	65 Å²	65	75.8 Å²	75.8	29%	0.285	38%	0.381	S	S	.	.			trans	-97.3	108.4	157.7	-72.2	-91	0	0	0	109.1	I383 R485	I383-F393 HydrophobicContact CD1-CD1 4.36Å; I383-F393 HydrophobicContact CD1-CD2 4.47Å; I383-F393 HydrophobicContact CD1-CE1 4.42Å; I383-F393 HydrophobicContact CD1-CG 4.37Å; I383-F393 HydrophobicContact CG2-CD2 4.41Å; I383-F393 HydrophobicContact CG2-CE1 4.43Å; I383-F393 HydrophobicContact CG2-CE2 3.62Å; I383-F393 HydrophobicContact CG2-CZ 3.61Å; F393-R485 HydrophobicContact CE1-CG 4.03Å; F393-R485 HydrophobicContact CZ-CG 4.38Å
394	E	56.7	Low	67.8	Low	174 Å²	174	75.1 Å²	75.1	81%	0.813	38%	0.377	S	S	*	.			trans	-50.4	142.4	172.8	-69.7	-161.6	145.6	0	0	111.8	Q396	E394-Q396 VanDerWaalsContact C-N 3.25Å; E394-Q396 PolarHBondContact O-N 3.02Å
395	E	59.3	Low	68.9	Low	166 Å²	166	71.6 Å²	71.6	78%	0.776	35%	0.352	S	S	*	.			trans	-69.1	79.7	-180	-72.5	-147.3	177.1	0	0	112	K376	K376-E395 IonicContact NZ-OE2 2.72Å; K376-E395 PolarHBondContact NZ-OE2 3.44Å
396	Q	63.9	Low	69.8	Low	56 Å²	56	69.8 Å²	69.8	26%	0.262	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-54.3	137.2	171.2	-70.8	175.8	0.3	0	0	109.8	K376 E394 N488	K376-Q396 WeakPolarHBondContact CE-O 3.23Å; E394-Q396 VanDerWaalsContact C-N 3.25Å; E394-Q396 PolarHBondContact O-N 3.02Å; Q396-N488 PolarHBondContact OE1-OD1 3.2Å
397	P	70.9	Confident	70.7	Confident	106 Å²	106	68.3 Å²	68.3	69%	0.688	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-59.3	151.5	178.9	25.8	-35	0	0	0	110.5	H399	P397-H399 PolarHBondContact O-N 2.85Å
398	V	79.2	Confident	71.8	Confident	33 Å²	33	67.4 Å²	67.4	20%	0.2	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-56	124.4	-177.1	-154	0	0	0	0	109.6	L371 L372 D373 A375 K376	L371-V398 HydrophobicContact CD2-CB 4.03Å; L371-V398 HydrophobicContact CD2-CG1 3.64Å; L371-V398 HydrophobicContact CG-CB 4.35Å; L371-V398 HydrophobicContact CG-CG1 3.76Å; L372-V398 WeakPolarHBondContact O-CG1 3.34Å; D373-V398 HydrophobicContact CB-CG2 4.24Å; D373-V398 WeakPolarHBondContact OD1-CG2 3.39Å; A375-V398 HydrophobicContact CB-CG1 3.87Å; K376-V398 HydrophobicContact CD-CG2 4.46Å; K376-V398 HydrophobicContact CG-CG1 4.49Å; K376-V398 HydrophobicContact CG-CG2 4.47Å
399	H	86.6	Confident	73.1	Confident	21 Å²	21	58.8 Å²	58.8	10%	0.097	30%	0.297	C	S	.	.			trans	-120.4	151.3	-173.4	-163.5	-105.3	0	0	0	110.8	R364 P397 W401 N402 N488 D489 F492	R364-H399 WeakPolarHBondContact CD-NE2 3.45Å; R364-H399 WeakPolarHBondContact CG-NE2 3.23Å; P397-H399 PolarHBondContact O-N 2.85Å; H399-W401 WeakPolarHBondContact ND1-CB 3.45Å; H399-W401 PolarHBondContact ND1-N 2.94Å; H399-W401 PolarHBondContact O-N 3.48Å; H399-N402 WeakPolarHBondContact CB-OD1 3.38Å; H399-N402 PolarHBondContact N-OD1 2.77Å; H399-N402 WeakPolarHBondContact O-CB 3.38Å; H399-N402 PolarHBondContact O-N 3.41Å; H399-N402 PolarHBondContact O-OD1 3.04Å; H399-N488 HydrophobicContact CB-CB 3.59Å; H399-N488 PolarHBondContact CE1-O 2.86Å; H399-N488 VanDerWaalsContact CE1-O 3.3Å; H399-N488 PolarHBondContact ND1-O 3.06Å; H399-D489 VanDerWaalsContact CE1-CA 3.49Å; H399-D489 WeakPolarHBondContact CE1-CA 3.41Å; H399-F492 AromaticContact CE1-CG 3.97Å
400	V	89.1	Confident	74.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.4	-26.3	175.4	-174.3	0	0	0	0	111.8	R364 L367 N402 V403 F492 F513	R364-V400 HydrophobicContact CG-CG2 4.1Å; R364-V400 VanDerWaalsContact O-CG2 3.32Å; R364-V400 WeakPolarHBondContact O-CG2 3.25Å; L367-V400 HydrophobicContact CB-CB 4.45Å; L367-V400 HydrophobicContact CB-CG1 3.71Å; L367-V400 HydrophobicContact CB-CG2 3.8Å; L367-V400 HydrophobicContact CD1-CG1 3.92Å; L367-V400 HydrophobicContact CG-CG1 4.48Å; V400-N402 VanDerWaalsContact C-N 3.34Å; V400-N402 PolarHBondContact O-N 3.05Å; V400-V403 WeakPolarHBondContact O-CB 3.35Å; V400-V403 PolarHBondContact O-N 2.99Å; V400-F492 HydrophobicContact CB-CD2 4.36Å; V400-F492 HydrophobicContact CB-CE2 4.11Å; V400-F492 HydrophobicContact CB-CZ 4.5Å; V400-F492 HydrophobicContact CG1-CD2 4.3Å; V400-F492 HydrophobicContact CG1-CE2 3.67Å; V400-F492 HydrophobicContact CG1-CZ 4.15Å; V400-F513 HydrophobicContact CG1-CZ 4.08Å
401	W	89.4	Confident	76	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-35.4	172.4	-174.2	-109.6	0	0	0	113.9	H399 V403 V404 E405 I474 I477 L478 N488 M491 F492 F495	H399-W401 WeakPolarHBondContact ND1-CB 3.45Å; H399-W401 PolarHBondContact ND1-N 2.94Å; H399-W401 PolarHBondContact O-N 3.48Å; W401-V403 PolarHBondContact O-N 3.5Å; W401-V404 HydrophobicContact CD2-CB 4.49Å; W401-V404 HydrophobicContact CE3-CB 3.92Å; W401-V404 HydrophobicContact CE3-CG1 4.13Å; W401-V404 HydrophobicContact CE3-CG2 4.24Å; W401-V404 HydrophobicContact CH2-CG1 4.15Å; W401-V404 HydrophobicContact CZ3-CB 4.03Å; W401-V404 HydrophobicContact CZ3-CG1 3.69Å; W401-V404 HydrophobicContact CZ3-CG2 4.48Å; W401-V404 CarbonylContact O-C 3.59Å; W401-V404 WeakPolarHBondContact O-CA 3.43Å; W401-V404 WeakPolarHBondContact O-CB 3.33Å; W401-V404 PolarHBondContact O-N 3.3Å; W401-E405 HydrophobicContact CG-CG 4.5Å; W401-E405 VanDerWaalsContact NE1-CD 3.33Å; W401-E405 PolarHBondContact NE1-OE1 2.92Å; W401-E405 PolarHBondContact O-N 2.94Å; W401-I474 HydrophobicContact CH2-CG2 4.14Å; W401-I474 HydrophobicContact CZ2-CG2 4.41Å; W401-I477 HydrophobicContact CH2-CB 4.33Å; W401-I477 HydrophobicContact CH2-CG2 3.78Å; W401-I477 HydrophobicContact CZ2-CG2 3.89Å; W401-L478 HydrophobicContact CZ2-CD2 3.83Å; W401-L478 HydrophobicContact CZ2-CG 4.23Å; W401-N488 HydrophobicContact CB-CB 4.06Å; W401-N488 WeakPolarHBondContact CB-O 3.33Å; W401-N488 HydrophobicContact CG-CB 4.5Å; W401-M491 HydrophobicContact CD2-CB 3.72Å; W401-M491 VanDerWaalsContact CE2-CB 3.5Å; W401-M491 HydrophobicContact CE3-CB 4.31Å; W401-M491 HydrophobicContact CG-CB 4.05Å; W401-M491 HydrophobicContact CH2-CB 4.47Å; W401-M491 HydrophobicContact CZ2-CB 3.9Å; W401-M491 HydrophobicContact CZ2-SD 4.31Å; W401-F492 HydrophobicContact CB-CB 4.34Å; W401-F492 HydrophobicContact CE3-CB 4.42Å; W401-F495 HydrophobicContact CE3-CB 4.32Å; W401-F495 HydrophobicContact CH2-CB 4.32Å; W401-F495 HydrophobicContact CZ3-CB 3.55Å; W401-F495 HydrophobicContact CZ3-CD2 4.03Å; W401-F495 AromaticContact CZ3-CG 3.8Å; W401-F495 HydrophobicContact CZ3-CG 3.8Å
402	N	86.5	Confident	77.3	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-26.4	179.3	-54.9	114.7	0	0	0	111.7	A375 H399 V400 E405 R406 N488	A375-N402 HydrophobicContact CB-CB 4.5Å; A375-N402 WeakPolarHBondContact O-CB 3.3Å; H399-N402 WeakPolarHBondContact CB-OD1 3.38Å; H399-N402 PolarHBondContact N-OD1 2.77Å; H399-N402 WeakPolarHBondContact O-CB 3.38Å; H399-N402 PolarHBondContact O-N 3.41Å; H399-N402 PolarHBondContact O-OD1 3.04Å; V400-N402 VanDerWaalsContact C-N 3.34Å; V400-N402 PolarHBondContact O-N 3.05Å; N402-E405 PolarHBondContact ND2-OE2 3.03Å; N402-R406 VanDerWaalsContact O-CB 3.26Å; N402-R406 WeakPolarHBondContact O-CB 3.44Å; N402-R406 PolarHBondContact O-N 2.8Å; N402-N488 PolarHBondContact ND2-ND2 3.45Å; N402-N488 PolarHBondContact OD1-ND2 3.13Å
403	V	87.5	Confident	78.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-38	169.8	-168.6	0	0	0	0	111.6	L371 V400 W401 R406 F407 V512 F513 V518 C522 Y523	L371-V403 HydrophobicContact CD1-CG2 3.35Å; V400-V403 WeakPolarHBondContact O-CB 3.35Å; V400-V403 PolarHBondContact O-N 2.99Å; W401-V403 PolarHBondContact O-N 3.5Å; V403-R406 PolarHBondContact O-N 2.98Å; V403-F407 WeakPolarHBondContact O-CB 3.44Å; V403-F407 PolarHBondContact O-N 3.5Å; V403-V512 HydrophobicContact CG1-CG1 4.15Å; V403-F513 HydrophobicContact CG1-CD1 4.46Å; V403-F513 HydrophobicContact CG1-CE1 3.83Å; V403-V518 HydrophobicContact CG1-CG1 3.23Å; V403-C522 HydrophobicContact CG2-CB 4.27Å; V403-Y523 HydrophobicContact CG1-CE2 4.01Å; V403-Y523 HydrophobicContact CG2-CE2 3.94Å
404	V	88.8	Confident	78.9	Confident	2 Å²	2	43 Å²	43	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-71.3	-41.1	177.1	-176.4	0	0	0	0	110.7	W401 F407 Y408 I474 F495	W401-V404 HydrophobicContact CD2-CB 4.49Å; W401-V404 HydrophobicContact CE3-CB 3.92Å; W401-V404 HydrophobicContact CE3-CG1 4.13Å; W401-V404 HydrophobicContact CE3-CG2 4.24Å; W401-V404 HydrophobicContact CH2-CG1 4.15Å; W401-V404 HydrophobicContact CZ3-CB 4.03Å; W401-V404 HydrophobicContact CZ3-CG1 3.69Å; W401-V404 HydrophobicContact CZ3-CG2 4.48Å; W401-V404 CarbonylContact O-C 3.59Å; W401-V404 WeakPolarHBondContact O-CA 3.43Å; W401-V404 WeakPolarHBondContact O-CB 3.33Å; W401-V404 PolarHBondContact O-N 3.3Å; V404-F407 PolarHBondContact O-N 2.81Å; V404-Y408 WeakPolarHBondContact O-CB 3.43Å; V404-Y408 PolarHBondContact O-N 2.8Å; V404-I474 HydrophobicContact CG1-CD1 3.49Å; V404-I474 VanDerWaalsContact CG1-CD1 3.49Å; V404-I474 HydrophobicContact CG1-CG1 3.76Å; V404-I474 HydrophobicContact CG1-CG2 4.4Å; V404-F495 HydrophobicContact CG1-CE2 4.34Å; V404-F495 HydrophobicContact CG1-CZ 4.48Å
405	E	85.8	Confident	79.4	Confident	9 Å²	9	41.4 Å²	41.4	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-57.7	-46.7	169.4	-72.4	175.6	157.1	0	0	111.4	L382 W401 N402 Y408 L409 L478	L382-E405 HydrophobicContact CD1-CB 3.62Å; L382-E405 HydrophobicContact CD1-CG 3.89Å; W401-E405 HydrophobicContact CG-CG 4.5Å; W401-E405 VanDerWaalsContact NE1-CD 3.33Å; W401-E405 PolarHBondContact NE1-OE1 2.92Å; W401-E405 PolarHBondContact O-N 2.94Å; N402-E405 PolarHBondContact ND2-OE2 3.03Å; E405-Y408 PolarHBondContact O-N 3.3Å; E405-L409 PolarHBondContact O-N 2.67Å; E405-L478 HydrophobicContact CG-CD2 4.25Å
406	R	83.5	Confident	79.7	Confident	38 Å²	38	35.7 Å²	35.7	14%	0.143	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-42.8	178.7	-173.5	59.1	-177.7	172.3	-1.9	112.3	D378 N402 V403 L409 L410 E521	D378-R406 IonicContact OD2-CZ 3.3Å; D378-R406 IonicContact OD2-NH1 3Å; D378-R406 PolarHBondContact OD2-NH1 3.4Å; N402-R406 VanDerWaalsContact O-CB 3.26Å; N402-R406 WeakPolarHBondContact O-CB 3.44Å; N402-R406 PolarHBondContact O-N 2.8Å; V403-R406 PolarHBondContact O-N 2.98Å; R406-L409 PolarHBondContact O-N 3.03Å; R406-L410 HydrophobicContact CG-CD1 3.97Å; R406-L410 WeakPolarHBondContact O-CB 3.49Å; R406-L410 WeakPolarHBondContact O-CG 3.4Å; R406-L410 PolarHBondContact O-N 3.3Å; R406-E521 IonicContact CZ-OE1 3.34Å; R406-E521 IonicContact CZ-OE2 2.87Å; R406-E521 VanDerWaalsContact CZ-OE2 3.29Å; R406-E521 IonicContact NE-OE1 2.72Å; R406-E521 IonicContact NE-OE2 2.84Å; R406-E521 PolarHBondContact NE-OE2 3.36Å; R406-E521 VanDerWaalsContact NH2-CD 3.3Å; R406-E521 IonicContact NH2-OE1 2.72Å; R406-E521 PolarHBondContact NH2-OE1 3.18Å; R406-E521 IonicContact NH2-OE2 3.27Å; R406-E521 PolarHBondContact NH2-OE2 3.25Å; R406-E521 VanDerWaalsContact NH2-OE2 3.08Å
407	F	86.4	Confident	79.8	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.013	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-43.1	172.6	175.6	-89.3	0	0	0	112	V403 V404 L409 L410 K411 L470 L471 M511 V512 C515 V518	V403-F407 WeakPolarHBondContact O-CB 3.44Å; V403-F407 PolarHBondContact O-N 3.5Å; V404-F407 PolarHBondContact O-N 2.81Å; F407-L409 PolarHBondContact O-N 3.17Å; F407-L410 PolarHBondContact O-N 3.21Å; F407-K411 HydrophobicContact CD1-CG 4.38Å; F407-K411 HydrophobicContact CD2-CG 4.38Å; F407-K411 HydrophobicContact CE1-CG 3.95Å; F407-K411 HydrophobicContact CE2-CG 3.97Å; F407-K411 HydrophobicContact CZ-CG 3.73Å; F407-K411 WeakPolarHBondContact O-CG 3.11Å; F407-K411 PolarHBondContact O-N 2.97Å; F407-L470 HydrophobicContact CD1-CD2 4.41Å; F407-L470 HydrophobicContact CE1-CD2 3.68Å; F407-L470 HydrophobicContact CZ-CD2 4.24Å; F407-L471 HydrophobicContact CD1-CD2 4.39Å; F407-L471 HydrophobicContact CE1-CD2 4.16Å; F407-M511 VanDerWaalsContact CE2-O 3.3Å; F407-M511 WeakPolarHBondContact CE2-O 3.48Å; F407-M511 HydrophobicContact CZ-CG 4.16Å; F407-V512 HydrophobicContact CB-CG1 4.05Å; F407-V512 HydrophobicContact CB-CG2 4.43Å; F407-V512 HydrophobicContact CD1-CG2 4.01Å; F407-V512 HydrophobicContact CD2-CB 4.37Å; F407-V512 HydrophobicContact CD2-CG1 4.44Å; F407-V512 HydrophobicContact CD2-CG2 4.33Å; F407-V512 HydrophobicContact CE1-CG2 4.36Å; F407-V512 HydrophobicContact CG-CB 4.39Å; F407-V512 HydrophobicContact CG-CG1 4.28Å; F407-V512 HydrophobicContact CG-CG2 3.99Å; F407-C515 HydrophobicContact CD2-CB 3.91Å; F407-C515 HydrophobicContact CE2-CB 4Å; F407-V518 HydrophobicContact CB-CG2 4.06Å; F407-V518 HydrophobicContact CD2-CG2 4.19Å
408	Y	85.6	Confident	79.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-42.7	177.4	166.2	-80.8	0	0	0	111.8	L382 R385 Y386 V404 E405 K411 H412 G413 N414 L471 I474 D475 L478	L382-Y408 HydrophobicContact CD2-CD1 3.86Å; L382-Y408 HydrophobicContact CD2-CE1 3.59Å; R385-Y408 PolarHBondContact NH1-OH 2.92Å; Y386-Y408 PolarHBondContact OH-OH 3.22Å; V404-Y408 WeakPolarHBondContact O-CB 3.43Å; V404-Y408 PolarHBondContact O-N 2.8Å; E405-Y408 PolarHBondContact O-N 3.3Å; Y408-K411 PolarHBondContact O-N 3.49Å; Y408-H412 PolarHBondContact O-N 2.69Å; Y408-G413 PolarHBondContact O-N 2.99Å; Y408-G413 PolarHBondContact OH-O 3.15Å; Y408-N414 PolarHBondContact OH-N 3.39Å; Y408-L471 HydrophobicContact CD2-CD2 3.93Å; Y408-L471 HydrophobicContact CG-CD2 4.37Å; Y408-I474 HydrophobicContact CD2-CB 4Å; Y408-I474 HydrophobicContact CD2-CG2 3.63Å; Y408-I474 HydrophobicContact CE2-CG2 4.38Å; Y408-I474 HydrophobicContact CG-CG2 3.94Å; Y408-D475 HydrophobicContact CE2-CB 3.97Å; Y408-D475 PolarHBondContact OH-OD1 3.35Å; Y408-L478 HydrophobicContact CD1-CD1 4.24Å; Y408-L478 HydrophobicContact CE1-CD1 4.12Å; Y408-L478 HydrophobicContact CE2-CD1 4.44Å; Y408-L478 HydrophobicContact CG-CD1 4.48Å
409	L	82.9	Confident	78.9	Confident	26 Å²	26	32.7 Å²	32.7	14%	0.136	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-48.9	173.1	-75.2	171.4	0	0	0	112.2	D378 L382 E405 R406 F407 K411 H412	D378-L409 HydrophobicContact CB-CD1 3.81Å; L382-L409 HydrophobicContact CD1-CD1 4.06Å; L382-L409 HydrophobicContact CD1-CG 4.1Å; L382-L409 HydrophobicContact CD2-CD2 3.62Å; L382-L409 HydrophobicContact CD2-CG 4Å; L382-L409 HydrophobicContact CG-CD1 4.07Å; L382-L409 HydrophobicContact CG-CD2 3.96Å; L382-L409 HydrophobicContact CG-CG 4.04Å; E405-L409 PolarHBondContact O-N 2.67Å; R406-L409 PolarHBondContact O-N 3.03Å; F407-L409 PolarHBondContact O-N 3.17Å; L409-K411 PolarHBondContact O-N 2.88Å; L409-H412 PolarHBondContact O-N 3.22Å
410	L	83.1	Confident	77.3	Confident	34 Å²	34	36.1 Å²	36.1	18%	0.178	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-20.1	179.4	-77.3	166.1	0	0	0	113.9	R406 F407 Q517 V518	R406-L410 HydrophobicContact CG-CD1 3.97Å; R406-L410 WeakPolarHBondContact O-CB 3.49Å; R406-L410 WeakPolarHBondContact O-CG 3.4Å; R406-L410 PolarHBondContact O-N 3.3Å; F407-L410 PolarHBondContact O-N 3.21Å; L410-Q517 HydrophobicContact CD1-CB 4.17Å; L410-V518 HydrophobicContact CD1-CG2 3.53Å
411	K	81	Confident	75.9	Confident	76 Å²	76	38.9 Å²	38.9	33%	0.33	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	15.2	172.5	-58.4	-53.2	174.4	-153.7	0	113.7	F407 Y408 L409 G413 L471 C515	F407-K411 HydrophobicContact CD1-CG 4.38Å; F407-K411 HydrophobicContact CD2-CG 4.38Å; F407-K411 HydrophobicContact CE1-CG 3.95Å; F407-K411 HydrophobicContact CE2-CG 3.97Å; F407-K411 HydrophobicContact CZ-CG 3.73Å; F407-K411 WeakPolarHBondContact O-CG 3.11Å; F407-K411 PolarHBondContact O-N 2.97Å; Y408-K411 PolarHBondContact O-N 3.49Å; L409-K411 PolarHBondContact O-N 2.88Å; K411-G413 PolarHBondContact O-N 3.23Å; K411-L471 HydrophobicContact CB-CD1 3.88Å; K411-L471 HydrophobicContact CB-CD2 4.1Å; K411-C515 PolarHBondContact NZ-SG 3.43Å; K411-C515 VanDerWaalsContact NZ-SG 3.39Å
412	H	75.5	Confident	74.7	Confident	104 Å²	104	39.6 Å²	39.6	48%	0.481	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	39.7	178.8	-52.1	-35.3	0	0	0	113	Y408 L409 N414 K415 L416	Y408-H412 PolarHBondContact O-N 2.69Å; L409-H412 PolarHBondContact O-N 3.22Å; H412-N414 PolarHBondContact O-N 3.05Å; H412-N414 VanDerWaalsContact O-N 3.15Å; H412-K415 HydrophobicContact CB-CB 4.16Å; H412-K415 HydrophobicContact CB-CD 4.14Å; H412-K415 HydrophobicContact CB-CG 4.19Å; H412-K415 PolarHBondContact O-N 2.84Å; H412-L416 PolarHBondContact O-N 3.17Å
413	G	66.7	Low	73.6	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-56.1	-30.1	179	0	0	0	0	0	113	Y408 K411 L416 A417	Y408-G413 PolarHBondContact O-N 2.99Å; Y408-G413 PolarHBondContact OH-O 3.15Å; K411-G413 PolarHBondContact O-N 3.23Å; G413-L416 PolarHBondContact O-N 2.81Å; G413-A417 WeakPolarHBondContact O-CB 3.32Å; G413-A417 PolarHBondContact O-N 2.74Å
414	N	69.1	Low	72.1	Confident	50 Å²	50	47.5 Å²	47.5	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-59.7	169.9	58.6	-17.7	0	0	0	111.7	R385 Y408 H412 L416 A417 D418	R385-N414 PolarHBondContact NH2-O 3.17Å; Y408-N414 PolarHBondContact OH-N 3.39Å; H412-N414 PolarHBondContact O-N 3.05Å; H412-N414 VanDerWaalsContact O-N 3.15Å; N414-L416 PolarHBondContact O-N 2.94Å; N414-L416 VanDerWaalsContact O-N 3.1Å; N414-A417 CarbonylContact O-C 3.53Å; N414-A417 WeakPolarHBondContact O-CA 3.36Å; N414-A417 PolarHBondContact O-N 3.26Å; N414-D418 PolarHBondContact O-N 3.29Å
415	K	67.8	Low	70.8	Confident	141 Å²	141	48.6 Å²	48.6	61%	0.613	26%	0.256	S	S	*	.	H	α-helix	trans	-55.4	-33	177.9	-59.7	-172.4	-179.7	-176.7	0	112.6	H412 A419	H412-K415 HydrophobicContact CB-CB 4.16Å; H412-K415 HydrophobicContact CB-CD 4.14Å; H412-K415 HydrophobicContact CB-CG 4.19Å; H412-K415 PolarHBondContact O-N 2.84Å; K415-A419 PolarHBondContact O-N 2.94Å
416	L	65.6	Low	69.7	Low	45 Å²	45	52.1 Å²	52.1	24%	0.236	28%	0.275	C	S	.	.	H	α-helix	trans	-73.1	-29.8	176.5	179.3	64.6	0	0	0	113.2	H412 G413 N414 A419 R422 Q468 L471	H412-L416 PolarHBondContact O-N 3.17Å; G413-L416 PolarHBondContact O-N 2.81Å; N414-L416 PolarHBondContact O-N 2.94Å; N414-L416 VanDerWaalsContact O-N 3.1Å; L416-A419 WeakPolarHBondContact O-CB 3.3Å; L416-R422 WeakPolarHBondContact O-CD 3.18Å; L416-Q468 HydrophobicContact CD1-CG 4.06Å; L416-Q468 HydrophobicContact CD2-CG 3.84Å; L416-Q468 HydrophobicContact CG-CG 4.41Å; L416-L471 HydrophobicContact CD2-CB 3.86Å; L416-L471 HydrophobicContact CD2-CD1 3.63Å; L416-L471 HydrophobicContact CD2-CG 4.4Å
417	A	64.2	Low	68.7	Low	17 Å²	17	53.9 Å²	53.9	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-86.1	-30.7	175.4	0	0	0	0	0	112.6	G413 N414 A419 D475	G413-A417 WeakPolarHBondContact O-CB 3.32Å; G413-A417 PolarHBondContact O-N 2.74Å; N414-A417 CarbonylContact O-C 3.53Å; N414-A417 WeakPolarHBondContact O-CA 3.36Å; N414-A417 PolarHBondContact O-N 3.26Å; A417-A419 PolarHBondContact O-N 3.01Å; A417-D475 HydrophobicContact CB-CB 4.48Å; A417-D475 VanDerWaalsContact CB-CG 3.45Å; A417-D475 WeakPolarHBondContact CB-OD1 3.44Å
418	D	65	Low	67.4	Low	95 Å²	95	60.7 Å²	60.7	51%	0.508	33%	0.327	S	S	.	.	S	Bend	trans	-73.5	-7.4	170.9	-61.1	-44.1	0	0	0	112.9	R385 N414	R385-D418 IonicContact CZ-OD1 3.74Å; R385-D418 IonicContact CZ-OD2 3.48Å; R385-D418 IonicContact NE-OD1 3.29Å; R385-D418 IonicContact NE-OD2 2.65Å; R385-D418 IonicContact NH2-OD1 3.75Å; R385-D418 PolarHBondContact NH2-OD1 3.45Å; R385-D418 IonicContact NH2-OD2 3.2Å; R385-D418 PolarHBondContact NH2-OD2 2.9Å; N414-D418 PolarHBondContact O-N 3.29Å
419	A	66.2	Low	66	Low	20 Å²	20	66.9 Å²	66.9	17%	0.165	36%	0.357	C	S	.	.			trans	-63	128.9	-177.2	0	0	0	0	0	111.1	K415 L416 A417 N421 R422 T423	K415-A419 PolarHBondContact O-N 2.94Å; L416-A419 WeakPolarHBondContact O-CB 3.3Å; A417-A419 PolarHBondContact O-N 3.01Å; A419-N421 VanDerWaalsContact C-N 3.29Å; A419-N421 WeakPolarHBondContact CB-OD1 3.27Å; A419-N421 PolarHBondContact O-N 3.29Å; A419-N421 PolarHBondContact O-OD1 2.89Å; A419-R422 WeakPolarHBondContact O-CA 3.27Å; A419-R422 WeakPolarHBondContact O-CB 3.37Å; A419-R422 PolarHBondContact O-N 3.09Å; A419-T423 PolarHBondContact O-N 3.37Å
420	P	54.5	Low	64.7	Low	94 Å²	94	69.9 Å²	69.9	61%	0.61	37%	0.372	S	S	*	.	H	α-helix	trans	-66.5	-31.3	-165.9	24.5	-34.8	0	0	0	113.2	R422 T423 L424	P420-R422 PolarHBondContact O-N 3.28Å; P420-T423 WeakPolarHBondContact CA-OG1 3.35Å; P420-T423 PolarHBondContact O-N 3.35Å; P420-T423 PolarHBondContact O-OG1 3.46Å; P420-L424 WeakPolarHBondContact O-CB 3.16Å; P420-L424 WeakPolarHBondContact O-CD1 3.36Å; P420-L424 VanDerWaalsContact O-CG 3.27Å; P420-L424 WeakPolarHBondContact O-CG 3.43Å; P420-L424 PolarHBondContact O-N 3.01Å
421	N	59.6	Low	63.2	Low	57 Å²	57	70.7 Å²	70.7	31%	0.305	38%	0.377	S	S	.	.	H	α-helix	trans	-58.4	-34	170.5	55.7	-3	0	0	0	112.7	A419 S425 T446	A419-N421 VanDerWaalsContact C-N 3.29Å; A419-N421 WeakPolarHBondContact CB-OD1 3.27Å; A419-N421 PolarHBondContact O-N 3.29Å; A419-N421 PolarHBondContact O-OD1 2.89Å; N421-S425 PolarHBondContact O-N 3.09Å; N421-S425 VanDerWaalsContact O-N 3.1Å; N421-S425 PolarHBondContact O-OG 3.18Å; N421-S425 VanDerWaalsContact O-OG 3.05Å; N421-T446 HydrophobicContact CB-CG2 3.72Å; N421-T446 PolarHBondContact ND2-O 3.07Å
422	R	63.5	Low	61.6	Low	16 Å²	16	73.1 Å²	73.1	6%	0.06	39%	0.393	C	S	.	.	H	α-helix	trans	-88.4	-32.4	179.5	-67.1	-175.8	128.1	-133.2	-18.9	113.1	L416 A419 P420 L424 S425 N426 Q468 T472	L416-R422 WeakPolarHBondContact O-CD 3.18Å; A419-R422 WeakPolarHBondContact O-CA 3.27Å; A419-R422 WeakPolarHBondContact O-CB 3.37Å; A419-R422 PolarHBondContact O-N 3.09Å; P420-R422 PolarHBondContact O-N 3.28Å; R422-L424 PolarHBondContact O-N 3.03Å; R422-S425 PolarHBondContact O-N 3Å; R422-N426 WeakPolarHBondContact O-CB 3.44Å; R422-N426 PolarHBondContact O-N 3.26Å; R422-N426 PolarHBondContact O-ND2 3Å; R422-Q468 VanDerWaalsContact NE-NE2 3.17Å; R422-T472 VanDerWaalsContact CZ-OG1 3.27Å; R422-T472 PolarHBondContact NH1-OG1 3.33Å; R422-T472 PolarHBondContact NH2-OG1 3.46Å
423	T	62.9	Low	59.6	Low	72 Å²	72	73.8 Å²	73.8	44%	0.442	40%	0.4	S	S	.	.	H	α-helix	trans	-64	-35.5	169.5	60.9	0	0	0	0	110.4	A419 P420 A427	A419-T423 PolarHBondContact O-N 3.37Å; P420-T423 WeakPolarHBondContact CA-OG1 3.35Å; P420-T423 PolarHBondContact O-N 3.35Å; P420-T423 PolarHBondContact O-OG1 3.46Å; T423-A427 VanDerWaalsContact O-CB 3.26Å; T423-A427 WeakPolarHBondContact O-CB 3.24Å; T423-A427 PolarHBondContact O-N 2.89Å
424	L	55.8	Low	58.2	Low	97 Å²	97	79.5 Å²	79.5	51%	0.508	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-50.5	167.7	-71.6	165.7	0	0	0	112.8	P420 R422 N426 A427 F428	P420-L424 WeakPolarHBondContact O-CB 3.16Å; P420-L424 WeakPolarHBondContact O-CD1 3.36Å; P420-L424 VanDerWaalsContact O-CG 3.27Å; P420-L424 WeakPolarHBondContact O-CG 3.43Å; P420-L424 PolarHBondContact O-N 3.01Å; R422-L424 PolarHBondContact O-N 3.03Å; L424-N426 VanDerWaalsContact C-N 3.28Å; L424-N426 PolarHBondContact O-N 3.24Å; L424-A427 PolarHBondContact O-N 3.26Å; L424-A427 VanDerWaalsContact O-N 3.12Å; L424-F428 HydrophobicContact CD2-CE2 4.04Å; L424-F428 WeakPolarHBondContact O-CD2 3.46Å; L424-F428 PolarHBondContact O-N 2.99Å
425	S	63	Low	57	Low	25 Å²	25	81.2 Å²	81.2	18%	0.175	46%	0.46	C	S	.	.	H	α-helix	trans	-57.3	-39.5	177.4	-59.9	0	0	0	0	113.2	N421 R422 Q429 L430 D431	N421-S425 PolarHBondContact O-N 3.09Å; N421-S425 VanDerWaalsContact O-N 3.1Å; N421-S425 PolarHBondContact O-OG 3.18Å; N421-S425 VanDerWaalsContact O-OG 3.05Å; R422-S425 PolarHBondContact O-N 3Å; S425-Q429 PolarHBondContact O-N 3.22Å; S425-L430 PolarHBondContact O-N 3.36Å; S425-D431 VanDerWaalsContact CB-OD2 3.26Å; S425-D431 WeakPolarHBondContact CB-OD2 3.47Å
426	N	61.7	Low	55.5	Low	83 Å²	83	83.1 Å²	83.1	44%	0.444	47%	0.468	S	S	.	.	H	α-helix	trans	-69.4	-40.9	174.3	-78.1	-79.6	0	0	0	112.5	R422 L424 F428 Q429	R422-N426 WeakPolarHBondContact O-CB 3.44Å; R422-N426 PolarHBondContact O-N 3.26Å; R422-N426 PolarHBondContact O-ND2 3Å; L424-N426 VanDerWaalsContact C-N 3.28Å; L424-N426 PolarHBondContact O-N 3.24Å; N426-F428 VanDerWaalsContact C-N 3.34Å; N426-F428 PolarHBondContact O-N 3.2Å; N426-Q429 WeakPolarHBondContact O-CA 3.35Å; N426-Q429 PolarHBondContact O-N 3Å
427	A	62.3	Low	54.4	Low	75 Å²	75	85.4 Å²	85.4	62%	0.62	49%	0.493	S	S	*	.	H	α-helix	trans	-64	-38.1	178	0	0	0	0	0	112.4	T423 L424 Q429	T423-A427 VanDerWaalsContact O-CB 3.26Å; T423-A427 WeakPolarHBondContact O-CB 3.24Å; T423-A427 PolarHBondContact O-N 2.89Å; L424-A427 PolarHBondContact O-N 3.26Å; L424-A427 VanDerWaalsContact O-N 3.12Å; A427-Q429 PolarHBondContact O-N 2.87Å
428	F	59.9	Low	53.5	Low	145 Å²	145	87.7 Å²	87.7	64%	0.636	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	7.8	171.2	-65.1	-62.7	0	0	0	113.7	L424 N426 L430	L424-F428 HydrophobicContact CD2-CE2 4.04Å; L424-F428 WeakPolarHBondContact O-CD2 3.46Å; L424-F428 PolarHBondContact O-N 2.99Å; N426-F428 VanDerWaalsContact C-N 3.34Å; N426-F428 PolarHBondContact O-N 3.2Å; F428-L430 HydrophobicContact CB-CD1 4.06Å; F428-L430 HydrophobicContact CB-CD2 4.39Å; F428-L430 HydrophobicContact CB-CG 3.81Å; F428-L430 PolarHBondContact O-N 2.84Å
429	Q	55	Low	52.5	Low	131 Å²	131	86.6 Å²	86.6	61%	0.612	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	15.6	177.3	-51	-175.7	14.9	0	0	115.6	S425 N426 A427 D431 N432	S425-Q429 PolarHBondContact O-N 3.22Å; N426-Q429 WeakPolarHBondContact O-CA 3.35Å; N426-Q429 PolarHBondContact O-N 3Å; A427-Q429 PolarHBondContact O-N 2.87Å; Q429-D431 PolarHBondContact O-N 2.92Å; Q429-N432 PolarHBondContact O-N 3.21Å
430	L	55.7	Low	51.7	Low	88 Å²	88	90.2 Å²	90.2	46%	0.461	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.2	-171.8	-59.5	176.7	0	0	0	113.5	S425 F428 N432	S425-L430 PolarHBondContact O-N 3.36Å; F428-L430 HydrophobicContact CB-CD1 4.06Å; F428-L430 HydrophobicContact CB-CD2 4.39Å; F428-L430 HydrophobicContact CB-CG 3.81Å; F428-L430 PolarHBondContact O-N 2.84Å; L430-N432 VanDerWaalsContact C-N 3.3Å
431	D	51.8	Low	51.1	Low	51 Å²	51	96 Å²	96	27%	0.273	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.2	175.4	-74.1	-72.3	0	0	0	113.6	S425 Q429	S425-D431 VanDerWaalsContact CB-OD2 3.26Å; S425-D431 WeakPolarHBondContact CB-OD2 3.47Å; Q429-D431 PolarHBondContact O-N 2.92Å
432	N	47.3	Very low	50.7	Low	127 Å²	127	98.6 Å²	98.6	68%	0.679	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-3.8	-174.3	-71	-25.5	0	0	0	114.6	Q429 L430 D434	Q429-N432 PolarHBondContact O-N 3.21Å; L430-N432 VanDerWaalsContact C-N 3.3Å; N432-D434 VanDerWaalsContact C-N 3.28Å; N432-D434 PolarHBondContact O-N 3.04Å
433	L	34.3	Very low	50	Low	119 Å²	119	99.2 Å²	99.2	62%	0.623	55%	0.551	S	S	*	*	S	Bend	trans	-76.4	79.2	179.8	-75.1	170.2	0	0	0	112.6
434	D	36.8	Very low	49	Very low	121 Å²	121	98.4 Å²	98.4	65%	0.647	55%	0.547	S	S	*	.			trans	53.7	91.8	136.1	-168.8	38.5	0	0	0	118.6	N432 K436	N432-D434 VanDerWaalsContact C-N 3.28Å; N432-D434 PolarHBondContact O-N 3.04Å; D434-K436 PolarHBondContact O-N 3.48Å
435	G	43.4	Very low	48.5	Very low	87 Å²	87	101.5 Å²	101.5	90%	0.897	56%	0.561	S	S	*	*	S	Bend	trans	69.7	-37.9	158.6	0	0	0	0	0	117.8
436	K	37.3	Very low	47.8	Very low	181 Å²	181	102.6 Å²	102.6	79%	0.787	57%	0.567	S	S	*	*	S	Bend	trans	-85.8	126.9	-177	-68.8	166.6	-175.5	164.2	0	109.1	D434 V438	D434-K436 PolarHBondContact O-N 3.48Å; K436-V438 PolarHBondContact O-N 2.87Å; K436-V438 VanDerWaalsContact O-N 3.16Å
437	A	41.7	Very low	46.9	Very low	92 Å²	92	101.1 Å²	101.1	76%	0.76	56%	0.562	S	S	*	*			trans	-65	118.8	-177.6	0	0	0	0	0	110.7	T439	A437-T439 PolarHBondContact O-N 2.89Å
438	V	46.5	Very low	45.9	Very low	65 Å²	65	100.3 Å²	100.3	39%	0.394	55%	0.551	S	S	.	*			trans	-45.7	117.3	164.4	178.7	0	0	0	0	107.4	K436 Q442 L443	K436-V438 PolarHBondContact O-N 2.87Å; K436-V438 VanDerWaalsContact O-N 3.16Å; V438-Q442 HydrophobicContact CG1-CB 3.92Å; V438-L443 HydrophobicContact CB-CD1 4.19Å; V438-L443 HydrophobicContact CG1-CD1 3.62Å
439	T	43.9	Very low	45.1	Very low	73 Å²	73	99.9 Å²	99.9	45%	0.448	56%	0.556	S	S	.	*			trans	-65.7	149.5	-159.2	63.4	0	0	0	0	110.8	A437 R441 Q442	A437-T439 PolarHBondContact O-N 2.89Å; T439-R441 PolarHBondContact O-N 3.25Å; T439-Q442 PolarHBondContact O-N 3.21Å; T439-Q442 PolarHBondContact OG1-OE1 2.86Å
440	S	47.9	Very low	44.5	Very low	96 Å²	96	99.5 Å²	99.5	67%	0.671	57%	0.565	S	S	*	*	H	α-helix	trans	-54.7	-19.8	-179.2	-44.9	0	0	0	0	113.8	C444	S440-C444 WeakPolarHBondContact O-CB 3.42Å
441	R	43.1	Very low	43.9	Very low	215 Å²	215	104 Å²	104	81%	0.811	58%	0.581	S	S	*	*	H	α-helix	trans	-73.7	-47	172.3	-110.7	175.4	170.2	160	-6.5	112.5	T439 C444 M445	T439-R441 PolarHBondContact O-N 3.25Å; R441-C444 WeakPolarHBondContact O-CB 3.36Å; R441-C444 PolarHBondContact O-N 3.49Å; R441-M445 WeakPolarHBondContact O-CG 3.29Å; R441-M445 PolarHBondContact O-N 3.15Å
442	Q	51.5	Low	43.5	Very low	112 Å²	112	112.9 Å²	112.9	52%	0.523	61%	0.61	S	S	.	*	H	α-helix	trans	-62.9	-55.4	-174.7	-73.9	160.8	-52	0	0	111.3	V438 T439 C444 M445 T446	V438-Q442 HydrophobicContact CG1-CB 3.92Å; T439-Q442 PolarHBondContact O-N 3.21Å; T439-Q442 PolarHBondContact OG1-OE1 2.86Å; Q442-C444 PolarHBondContact O-N 2.87Å; Q442-M445 PolarHBondContact O-N 3.45Å; Q442-T446 PolarHBondContact O-N 3.01Å; Q442-T446 PolarHBondContact O-OG1 2.76Å
443	L	47.3	Very low	43.1	Very low	29 Å²	29	118.2 Å²	118.2	15%	0.152	62%	0.621	C	S	.	*	H	α-helix	trans	-61.3	-29.4	176.3	-113.2	84.6	0	0	0	113.2	V438 C447 L465	V438-L443 HydrophobicContact CB-CD1 4.19Å; V438-L443 HydrophobicContact CG1-CD1 3.62Å; L443-C447 PolarHBondContact O-SG 2.99Å; L443-L465 HydrophobicContact CB-CD1 3.66Å; L443-L465 HydrophobicContact CD2-CD1 3.6Å; L443-L465 HydrophobicContact CG-CD1 4.26Å
444	C	43	Very low	43.3	Very low	54 Å²	54	121.2 Å²	121.2	37%	0.365	63%	0.629	S	S	.	*	H	α-helix	trans	-68.2	-46.3	178.3	-172.1	0	0	0	0	111.1	S440 R441 Q442 T446 C447 C448	S440-C444 WeakPolarHBondContact O-CB 3.42Å; R441-C444 WeakPolarHBondContact O-CB 3.36Å; R441-C444 PolarHBondContact O-N 3.49Å; Q442-C444 PolarHBondContact O-N 2.87Å; C444-T446 VanDerWaalsContact C-N 3.26Å; C444-T446 PolarHBondContact O-N 3.39Å; C444-C447 PolarHBondContact O-N 3.19Å; C444-C447 VanDerWaalsContact O-N 3.16Å; C444-C448 VanDerWaalsContact O-CB 3.28Å; C444-C448 WeakPolarHBondContact O-CB 3.47Å; C444-C448 PolarHBondContact O-N 3.08Å
445	M	45.4	Very low	43.3	Very low	163 Å²	163	126.3 Å²	126.3	80%	0.803	64%	0.64	S	S	*	*	H	α-helix	trans	-58.3	-38.1	175.4	-71.8	-66.3	-72.7	0	0	112.3	R441 Q442 C447	R441-M445 WeakPolarHBondContact O-CG 3.29Å; R441-M445 PolarHBondContact O-N 3.15Å; Q442-M445 PolarHBondContact O-N 3.45Å; M445-C447 PolarHBondContact O-N 2.72Å
446	T	48.8	Very low	43	Very low	48 Å²	48	131.9 Å²	131.9	29%	0.294	64%	0.639	S	S	.	*	H	α-helix	trans	-63.8	-23.5	-180	-37.8	0	0	0	0	113.4	N421 Q442 C444	N421-T446 HydrophobicContact CB-CG2 3.72Å; N421-T446 PolarHBondContact ND2-O 3.07Å; Q442-T446 PolarHBondContact O-N 3.01Å; Q442-T446 PolarHBondContact O-OG1 2.76Å; C444-T446 VanDerWaalsContact C-N 3.26Å; C444-T446 PolarHBondContact O-N 3.39Å
447	C	41.6	Very low	43.5	Very low	52 Å²	52	125.8 Å²	125.8	35%	0.351	62%	0.617	S	S	.	*	H	α-helix	trans	-127.9	-26.3	-163.6	-50.4	0	0	0	0	114.6	L443 C444 M445 N449 Q468	L443-C447 PolarHBondContact O-SG 2.99Å; C444-C447 PolarHBondContact O-N 3.19Å; C444-C447 VanDerWaalsContact O-N 3.16Å; M445-C447 PolarHBondContact O-N 2.72Å; C447-N449 PolarHBondContact O-N 3.28Å; C447-Q468 PolarHBondContact SG-NE2 3.11Å; C447-Q468 PolarHBondContact SG-OE1 2.92Å; C447-Q468 VanDerWaalsContact SG-OE1 3.36Å
448	C	41.5	Very low	43.8	Very low	58 Å²	58	126.5 Å²	126.5	39%	0.392	61%	0.612	S	S	.	*			trans	-90.5	90.3	179.6	-68.6	0	0	0	0	109.9	C444 P450	C444-C448 VanDerWaalsContact O-CB 3.28Å; C444-C448 WeakPolarHBondContact O-CB 3.47Å; C444-C448 PolarHBondContact O-N 3.08Å; C448-P450 WeakPolarHBondContact O-CD 3.33Å; C448-P450 VanDerWaalsContact O-N 3.1Å
449	N	43.4	Very low	43.9	Very low	136 Å²	136	127.4 Å²	127.4	73%	0.727	63%	0.626	S	S	*	*			trans	-50.4	117.9	162.7	-178.3	-31.3	0	0	0	108.2	C447 F451	C447-N449 PolarHBondContact O-N 3.28Å; N449-F451 PolarHBondContact O-N 2.95Å
450	P	43.3	Very low	44.2	Very low	123 Å²	123	131 Å²	131	80%	0.799	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	1	-157.4	25.6	-35.4	0	0	0	115.1	C448	C448-P450 WeakPolarHBondContact O-CD 3.33Å; C448-P450 VanDerWaalsContact O-N 3.1Å
451	F	41.5	Very low	44.3	Very low	181 Å²	181	128.8 Å²	128.8	79%	0.794	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	11.9	-158.9	-131.7	-97.3	0	0	0	117.1	N449	N449-F451 PolarHBondContact O-N 2.95Å
452	R	43.1	Very low	44.9	Very low	239 Å²	239	124.6 Å²	124.6	90%	0.902	61%	0.609	S	S	*	*	S	Bend	trans	-122.1	79	178.1	-72.7	-161.7	176.8	-148.7	0.4	115.3
453	R	40.1	Very low	45.3	Very low	238 Å²	238	123.7 Å²	123.7	90%	0.898	61%	0.608	S	S	*	*			trans	30.3	117.2	141.8	-72.9	-175.4	175.7	177.6	-1	118.7
454	F	38	Very low	46.3	Very low	182 Å²	182	126.4 Å²	126.4	80%	0.798	63%	0.625	S	S	*	*	S	Bend	trans	79.3	72	130.5	-132.8	-92.2	0	0	0	119.6	K456	F454-K456 VanDerWaalsContact C-N 3.26Å; F454-K456 PolarHBondContact O-N 3.33Å
455	W	37.4	Very low	47.5	Very low	228 Å²	228	126 Å²	126	86%	0.864	62%	0.619	S	S	*	*	S	Bend	trans	54.9	-13.2	142.6	-81.9	77	0	0	0	122.1	T457	W455-T457 PolarHBondContact O-N 3.29Å
456	K	37.7	Very low	49	Very low	204 Å²	204	119.9 Å²	119.9	89%	0.887	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	12.1	170.5	-69.7	-176.6	176	178.3	0	112.9	F454	F454-K456 VanDerWaalsContact C-N 3.26Å; F454-K456 PolarHBondContact O-N 3.33Å
457	T	47.7	Very low	50.7	Low	53 Å²	53	119.7 Å²	119.7	33%	0.325	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.2	-17.8	-160.2	2.7	0	0	0	0	115	W455 A459 K460 C461	W455-T457 PolarHBondContact O-N 3.29Å; T457-A459 VanDerWaalsContact C-N 3.32Å; T457-A459 PolarHBondContact O-N 2.91Å; T457-A459 VanDerWaalsContact O-N 3.15Å; T457-K460 CarbonylContact O-C 3.58Å; T457-K460 WeakPolarHBondContact O-CA 3.2Å; T457-K460 WeakPolarHBondContact O-CB 3.21Å; T457-K460 PolarHBondContact O-N 3.1Å; T457-C461 PolarHBondContact O-N 3Å; T457-C461 PolarHBondContact O-SG 3.14Å; T457-C461 VanDerWaalsContact O-SG 3.39Å
458	T	47.7	Very low	52.4	Low	108 Å²	108	117.8 Å²	117.8	66%	0.663	57%	0.571	S	S	*	*	H	α-helix	trans	-53	-44.3	-169.5	-38.7	0	0	0	0	113.5	C461 H462	T458-C461 PolarHBondContact O-N 2.95Å; T458-H462 WeakPolarHBondContact O-CB 3.47Å; T458-H462 PolarHBondContact O-N 2.99Å
459	A	48.1	Very low	54.4	Low	83 Å²	83	116.8 Å²	116.8	69%	0.686	56%	0.563	S	S	*	*	H	α-helix	trans	-67.9	-35.6	176.7	0	0	0	0	0	113.2	T457 L463	T457-A459 VanDerWaalsContact C-N 3.32Å; T457-A459 PolarHBondContact O-N 2.91Å; T457-A459 VanDerWaalsContact O-N 3.15Å; A459-L463 WeakPolarHBondContact O-CB 3.25Å; A459-L463 PolarHBondContact O-N 3.43Å
460	K	51	Low	56.5	Low	148 Å²	148	110.3 Å²	110.3	64%	0.643	53%	0.529	S	S	*	.	H	α-helix	trans	-69	-46	174.7	-70.8	-171.3	176.3	-174.9	0	111	T457 H462 L463 T464	T457-K460 CarbonylContact O-C 3.58Å; T457-K460 WeakPolarHBondContact O-CA 3.2Å; T457-K460 WeakPolarHBondContact O-CB 3.21Å; T457-K460 PolarHBondContact O-N 3.1Å; K460-H462 PolarHBondContact O-N 3.48Å; K460-L463 PolarHBondContact O-N 3.27Å; K460-T464 PolarHBondContact O-N 2.94Å; K460-T464 PolarHBondContact O-OG1 3.24Å; K460-T464 VanDerWaalsContact O-OG1 3.05Å
461	C	48.2	Very low	58.5	Low	51 Å²	51	104.7 Å²	104.7	35%	0.345	49%	0.492	S	S	.	.	H	α-helix	trans	-60.5	-44.5	177.6	-59.8	0	0	0	0	111.7	T457 T458 L463 T464 L465	T457-C461 PolarHBondContact O-N 3Å; T457-C461 PolarHBondContact O-SG 3.14Å; T457-C461 VanDerWaalsContact O-SG 3.39Å; T458-C461 PolarHBondContact O-N 2.95Å; C461-L463 PolarHBondContact O-N 3.37Å; C461-T464 PolarHBondContact O-N 3.15Å; C461-L465 WeakPolarHBondContact O-CB 3.44Å; C461-L465 PolarHBondContact O-N 3.18Å
462	H	56	Low	60.5	Low	127 Å²	127	97.8 Å²	97.8	59%	0.588	46%	0.464	S	S	*	.	H	α-helix	trans	-64.7	-38.3	176.4	-169.4	-90.9	0	0	0	112.2	T458 K460 F466	T458-H462 WeakPolarHBondContact O-CB 3.47Å; T458-H462 PolarHBondContact O-N 2.99Å; K460-H462 PolarHBondContact O-N 3.48Å; H462-F466 WeakPolarHBondContact O-CB 3.17Å; H462-F466 PolarHBondContact O-N 3.05Å
463	L	61	Low	62.6	Low	93 Å²	93	87.2 Å²	87.2	49%	0.487	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-43.1	174.2	-177.6	61.9	0	0	0	112.3	A459 K460 C461 F466 I467 M511	A459-L463 WeakPolarHBondContact O-CB 3.25Å; A459-L463 PolarHBondContact O-N 3.43Å; K460-L463 PolarHBondContact O-N 3.27Å; C461-L463 PolarHBondContact O-N 3.37Å; L463-F466 PolarHBondContact O-N 3.34Å; L463-I467 HydrophobicContact CD1-CD1 4.29Å; L463-I467 HydrophobicContact CD1-CG1 4.44Å; L463-I467 HydrophobicContact CG-CD1 4.01Å; L463-I467 WeakPolarHBondContact O-CG1 3.47Å; L463-I467 PolarHBondContact O-N 3.44Å; L463-M511 HydrophobicContact CD1-SD 4.17Å
464	T	67.1	Low	64.8	Low	85 Å²	85	75.9 Å²	75.9	52%	0.521	38%	0.383	S	S	.	.	H	α-helix	trans	-60.6	-50.3	176.2	-59.8	0	0	0	0	110.9	K460 C461 F466 I467 Q468	K460-T464 PolarHBondContact O-N 2.94Å; K460-T464 PolarHBondContact O-OG1 3.24Å; K460-T464 VanDerWaalsContact O-OG1 3.05Å; C461-T464 PolarHBondContact O-N 3.15Å; T464-F466 PolarHBondContact O-N 2.81Å; T464-I467 PolarHBondContact O-N 3.39Å; T464-Q468 WeakPolarHBondContact O-CB 3.39Å; T464-Q468 PolarHBondContact O-N 2.89Å
465	L	68.2	Low	67	Low	46 Å²	46	68.9 Å²	68.9	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-54.6	-42.3	174.5	-171.4	79.4	0	0	0	111.3	L443 C461 Q468 V469	L443-L465 HydrophobicContact CB-CD1 3.66Å; L443-L465 HydrophobicContact CD2-CD1 3.6Å; L443-L465 HydrophobicContact CG-CD1 4.26Å; C461-L465 WeakPolarHBondContact O-CB 3.44Å; C461-L465 PolarHBondContact O-N 3.18Å; L465-Q468 WeakPolarHBondContact O-CB 3.22Å; L465-Q468 PolarHBondContact O-N 3.27Å; L465-V469 WeakPolarHBondContact O-CG2 3.19Å; L465-V469 PolarHBondContact O-N 3.22Å
466	F	78.1	Confident	69.2	Low	34 Å²	34	60 Å²	60	15%	0.149	33%	0.334	C	S	.	.	H	α-helix	trans	-68.8	-40.9	-178.8	-165	-109.7	0	0	0	113.5	H462 L463 T464 Q468 L470 K504 P507 W508 M511	H462-F466 WeakPolarHBondContact O-CB 3.17Å; H462-F466 PolarHBondContact O-N 3.05Å; L463-F466 PolarHBondContact O-N 3.34Å; T464-F466 PolarHBondContact O-N 2.81Å; F466-Q468 VanDerWaalsContact C-N 3.32Å; F466-L470 PolarHBondContact O-N 3.03Å; F466-K504 HydrophobicContact CE2-CB 4.23Å; F466-K504 HydrophobicContact CE2-CD 3.62Å; F466-K504 HydrophobicContact CE2-CG 3.71Å; F466-K504 HydrophobicContact CZ-CB 4.02Å; F466-K504 HydrophobicContact CZ-CD 3.97Å; F466-K504 HydrophobicContact CZ-CG 4.01Å; F466-P507 HydrophobicContact CE1-CB 3.77Å; F466-P507 HydrophobicContact CZ-CB 3.55Å; F466-W508 AromaticContact CE1-CD1 3.65Å; F466-W508 AromaticContact CE2-NE1 3.92Å; F466-W508 AromaticContact CZ-CD1 3.34Å; F466-W508 AromaticContact CZ-NE1 3.56Å; F466-M511 HydrophobicContact CD1-CE 3.49Å; F466-M511 VanDerWaalsContact CD1-CE 3.49Å; F466-M511 HydrophobicContact CD1-SD 3.73Å; F466-M511 HydrophobicContact CE1-CE 3.75Å; F466-M511 HydrophobicContact CE1-SD 4.23Å; F466-M511 HydrophobicContact CG-CE 4.44Å
467	I	83.1	Confident	71.5	Confident	45 Å²	45	50.5 Å²	50.5	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-44.3	169.7	-68.5	163.7	0	0	0	109.9	L463 T464 V469 L470 L471 M511	L463-I467 HydrophobicContact CD1-CD1 4.29Å; L463-I467 HydrophobicContact CD1-CG1 4.44Å; L463-I467 HydrophobicContact CG-CD1 4.01Å; L463-I467 WeakPolarHBondContact O-CG1 3.47Å; L463-I467 PolarHBondContact O-N 3.44Å; T464-I467 PolarHBondContact O-N 3.39Å; I467-V469 PolarHBondContact O-N 3.23Å; I467-L470 WeakPolarHBondContact O-CB 3.32Å; I467-L470 PolarHBondContact O-N 3.09Å; I467-L471 HydrophobicContact CG2-CD1 3.66Å; I467-L471 HydrophobicContact CG2-CG 4.13Å; I467-L471 WeakPolarHBondContact O-CG 3.41Å; I467-L471 PolarHBondContact O-N 3.17Å; I467-M511 HydrophobicContact CB-CE 4.39Å; I467-M511 HydrophobicContact CB-SD 4.46Å; I467-M511 HydrophobicContact CD1-SD 4.41Å; I467-M511 HydrophobicContact CG1-CE 3.93Å; I467-M511 HydrophobicContact CG1-CG 4.45Å; I467-M511 HydrophobicContact CG1-SD 3.41Å; I467-M511 WeakPolarHBondContact CG1-SD 3.45Å
468	Q	77.9	Confident	73.2	Confident	12 Å²	12	48 Å²	48	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-45	-177.1	-153.2	-175.7	0.1	0	0	111.9	L416 R422 C447 T464 L465 F466 L470 L471 T472	L416-Q468 HydrophobicContact CD1-CG 4.06Å; L416-Q468 HydrophobicContact CD2-CG 3.84Å; L416-Q468 HydrophobicContact CG-CG 4.41Å; R422-Q468 VanDerWaalsContact NE-NE2 3.17Å; C447-Q468 PolarHBondContact SG-NE2 3.11Å; C447-Q468 PolarHBondContact SG-OE1 2.92Å; C447-Q468 VanDerWaalsContact SG-OE1 3.36Å; T464-Q468 WeakPolarHBondContact O-CB 3.39Å; T464-Q468 PolarHBondContact O-N 2.89Å; L465-Q468 WeakPolarHBondContact O-CB 3.22Å; L465-Q468 PolarHBondContact O-N 3.27Å; F466-Q468 VanDerWaalsContact C-N 3.32Å; Q468-L470 PolarHBondContact O-N 3.06Å; Q468-L471 PolarHBondContact O-N 2.99Å; Q468-T472 WeakPolarHBondContact O-CB 3.44Å; Q468-T472 PolarHBondContact O-N 2.89Å; Q468-T472 PolarHBondContact O-OG1 3.36Å
469	V	83.5	Confident	74.7	Confident	37 Å²	37	43.5 Å²	43.5	22%	0.224	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-42.1	175.5	174.3	0	0	0	0	111.4	L465 I467 T472 T473 W508	L465-V469 WeakPolarHBondContact O-CG2 3.19Å; L465-V469 PolarHBondContact O-N 3.22Å; I467-V469 PolarHBondContact O-N 3.23Å; V469-T472 PolarHBondContact O-N 3.26Å; V469-T473 PolarHBondContact O-N 2.91Å; V469-T473 PolarHBondContact O-OG1 3.26Å; V469-W508 HydrophobicContact CG1-CZ2 4.26Å
470	L	86.9	Confident	76.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-49.8	174.6	171.1	62.1	0	0	0	111.8	F407 F466 I467 Q468 T472 T473 I474 F495 W508 M511 V512	F407-L470 HydrophobicContact CD1-CD2 4.41Å; F407-L470 HydrophobicContact CE1-CD2 3.68Å; F407-L470 HydrophobicContact CZ-CD2 4.24Å; F466-L470 PolarHBondContact O-N 3.03Å; I467-L470 WeakPolarHBondContact O-CB 3.32Å; I467-L470 PolarHBondContact O-N 3.09Å; Q468-L470 PolarHBondContact O-N 3.06Å; L470-T472 VanDerWaalsContact C-N 3.26Å; L470-T472 PolarHBondContact O-N 2.71Å; L470-T473 PolarHBondContact O-N 2.87Å; L470-T473 PolarHBondContact O-OG1 3.22Å; L470-I474 HydrophobicContact CD1-CD1 3.74Å; L470-I474 HydrophobicContact CD1-CG1 4.15Å; L470-I474 HydrophobicContact CG-CD1 3.85Å; L470-I474 WeakPolarHBondContact O-CG1 3.33Å; L470-I474 PolarHBondContact O-N 3.16Å; L470-F495 HydrophobicContact CD1-CE2 3.54Å; L470-F495 HydrophobicContact CD1-CZ 3.85Å; L470-W508 HydrophobicContact CD1-CB 4.11Å; L470-W508 HydrophobicContact CD1-CD2 3.6Å; L470-W508 HydrophobicContact CD1-CE3 3.76Å; L470-W508 HydrophobicContact CD1-CG 3.75Å; L470-W508 HydrophobicContact CD1-CZ3 4.41Å; L470-M511 HydrophobicContact CB-CE 3.86Å; L470-M511 HydrophobicContact CD2-CE 3.46Å; L470-M511 VanDerWaalsContact CD2-CE 3.46Å; L470-M511 HydrophobicContact CG-CE 4.29Å; L470-V512 HydrophobicContact CD2-CG2 4.22Å
471	L	86.7	Confident	77.6	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-34.3	-178.8	-67.7	174.2	0	0	0	111.7	F407 Y408 K411 L416 I467 Q468 I474 D475	F407-L471 HydrophobicContact CD1-CD2 4.39Å; F407-L471 HydrophobicContact CE1-CD2 4.16Å; Y408-L471 HydrophobicContact CD2-CD2 3.93Å; Y408-L471 HydrophobicContact CG-CD2 4.37Å; K411-L471 HydrophobicContact CB-CD1 3.88Å; K411-L471 HydrophobicContact CB-CD2 4.1Å; L416-L471 HydrophobicContact CD2-CB 3.86Å; L416-L471 HydrophobicContact CD2-CD1 3.63Å; L416-L471 HydrophobicContact CD2-CG 4.4Å; I467-L471 HydrophobicContact CG2-CD1 3.66Å; I467-L471 HydrophobicContact CG2-CG 4.13Å; I467-L471 WeakPolarHBondContact O-CG 3.41Å; I467-L471 PolarHBondContact O-N 3.17Å; Q468-L471 PolarHBondContact O-N 2.99Å; L471-I474 PolarHBondContact O-N 2.96Å; L471-D475 WeakPolarHBondContact O-CB 3.37Å; L471-D475 PolarHBondContact O-N 3.44Å
472	T	83.7	Confident	79	Confident	35 Å²	35	32.4 Å²	32.4	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-39.7	176.8	-46.4	0	0	0	0	112.2	R422 Q468 V469 L470 D475 G476	R422-T472 VanDerWaalsContact CZ-OG1 3.27Å; R422-T472 PolarHBondContact NH1-OG1 3.33Å; R422-T472 PolarHBondContact NH2-OG1 3.46Å; Q468-T472 WeakPolarHBondContact O-CB 3.44Å; Q468-T472 PolarHBondContact O-N 2.89Å; Q468-T472 PolarHBondContact O-OG1 3.36Å; V469-T472 PolarHBondContact O-N 3.26Å; L470-T472 VanDerWaalsContact C-N 3.26Å; L470-T472 PolarHBondContact O-N 2.71Å; T472-D475 PolarHBondContact O-N 3.3Å; T472-G476 PolarHBondContact O-N 2.9Å
473	T	85.7	Confident	79.8	Confident	17 Å²	17	32.8 Å²	32.8	10%	0.104	19%	0.189	C	C	.	.	H	α-helix	trans	-72.2	-30.4	176	53.4	0	0	0	0	112.4	V469 L470 I477 W508	V469-T473 PolarHBondContact O-N 2.91Å; V469-T473 PolarHBondContact O-OG1 3.26Å; L470-T473 PolarHBondContact O-N 2.87Å; L470-T473 PolarHBondContact O-OG1 3.22Å; T473-I477 WeakPolarHBondContact O-CB 3.41Å; T473-I477 WeakPolarHBondContact O-CD1 3.17Å; T473-I477 WeakPolarHBondContact O-CG1 3.44Å; T473-I477 PolarHBondContact O-N 3.06Å; T473-I477 VanDerWaalsContact O-N 3.16Å; T473-W508 HydrophobicContact CG2-CH2 3.88Å; T473-W508 HydrophobicContact CG2-CZ2 4.44Å; T473-W508 WeakPolarHBondContact OG1-CH2 3.2Å
474	I	86.7	Confident	80.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-46.2	168.5	-63.5	163.1	0	0	0	110.3	W401 V404 Y408 L470 L471 G476 I477 L478 F495	W401-I474 HydrophobicContact CH2-CG2 4.14Å; W401-I474 HydrophobicContact CZ2-CG2 4.41Å; V404-I474 HydrophobicContact CG1-CD1 3.49Å; V404-I474 VanDerWaalsContact CG1-CD1 3.49Å; V404-I474 HydrophobicContact CG1-CG1 3.76Å; V404-I474 HydrophobicContact CG1-CG2 4.4Å; Y408-I474 HydrophobicContact CD2-CB 4Å; Y408-I474 HydrophobicContact CD2-CG2 3.63Å; Y408-I474 HydrophobicContact CE2-CG2 4.38Å; Y408-I474 HydrophobicContact CG-CG2 3.94Å; L470-I474 HydrophobicContact CD1-CD1 3.74Å; L470-I474 HydrophobicContact CD1-CG1 4.15Å; L470-I474 HydrophobicContact CG-CD1 3.85Å; L470-I474 WeakPolarHBondContact O-CG1 3.33Å; L470-I474 PolarHBondContact O-N 3.16Å; L471-I474 PolarHBondContact O-N 2.96Å; I474-G476 PolarHBondContact O-N 2.69Å; I474-I477 PolarHBondContact O-N 3.21Å; I474-I477 VanDerWaalsContact O-N 3.17Å; I474-L478 HydrophobicContact CG2-CD1 3.87Å; I474-L478 HydrophobicContact CG2-CG 4.21Å; I474-L478 WeakPolarHBondContact O-CG 3.33Å; I474-L478 PolarHBondContact O-N 3.03Å; I474-F495 HydrophobicContact CD1-CE2 4.41Å; I474-F495 HydrophobicContact CG1-CD2 4.21Å; I474-F495 HydrophobicContact CG1-CE2 3.95Å
475	D	85	Confident	80.5	Confident	35 Å²	35	32.5 Å²	32.5	19%	0.187	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-48.3	178.7	-161.8	82.7	0	0	0	111.9	R385 Y386 Y408 A417 L471 T472 I477 L478 G479	R385-D475 IonicContact NH1-OD1 2.7Å; R385-D475 PolarHBondContact NH1-OD1 2.81Å; Y386-D475 PolarHBondContact OH-OD1 3.38Å; Y408-D475 HydrophobicContact CE2-CB 3.97Å; Y408-D475 PolarHBondContact OH-OD1 3.35Å; A417-D475 HydrophobicContact CB-CB 4.48Å; A417-D475 VanDerWaalsContact CB-CG 3.45Å; A417-D475 WeakPolarHBondContact CB-OD1 3.44Å; L471-D475 WeakPolarHBondContact O-CB 3.37Å; L471-D475 PolarHBondContact O-N 3.44Å; T472-D475 PolarHBondContact O-N 3.3Å; D475-I477 VanDerWaalsContact C-N 3.33Å; D475-I477 PolarHBondContact O-N 3.16Å; D475-L478 PolarHBondContact O-N 3.29Å; D475-G479 PolarHBondContact O-N 2.93Å
476	G	83.8	Confident	81	Confident	43 Å²	43	33.8 Å²	33.8	44%	0.443	18%	0.177	S	C	.	.	H	α-helix	trans	-65	-31.3	176.1	0	0	0	0	0	114	T472 I474 S480	T472-G476 PolarHBondContact O-N 2.9Å; I474-G476 PolarHBondContact O-N 2.69Å; G476-S480 WeakPolarHBondContact O-CB 3.44Å; G476-S480 PolarHBondContact O-N 3.42Å; G476-S480 PolarHBondContact O-OG 2.84Å
477	I	85.3	Confident	81.3	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-70.3	-46.7	171.9	-71.7	166	0	0	0	110.2	W401 T473 I474 D475 S480 H481 M491 A494 F495 V553	W401-I477 HydrophobicContact CH2-CB 4.33Å; W401-I477 HydrophobicContact CH2-CG2 3.78Å; W401-I477 HydrophobicContact CZ2-CG2 3.89Å; T473-I477 WeakPolarHBondContact O-CB 3.41Å; T473-I477 WeakPolarHBondContact O-CD1 3.17Å; T473-I477 WeakPolarHBondContact O-CG1 3.44Å; T473-I477 PolarHBondContact O-N 3.06Å; T473-I477 VanDerWaalsContact O-N 3.16Å; I474-I477 PolarHBondContact O-N 3.21Å; I474-I477 VanDerWaalsContact O-N 3.17Å; D475-I477 VanDerWaalsContact C-N 3.33Å; D475-I477 PolarHBondContact O-N 3.16Å; I477-S480 PolarHBondContact O-N 3.24Å; I477-S480 PolarHBondContact O-OG 3.14Å; I477-H481 VanDerWaalsContact O-CB 3.23Å; I477-H481 WeakPolarHBondContact O-CB 3.24Å; I477-H481 PolarHBondContact O-N 2.72Å; I477-H481 PolarHBondContact O-ND1 3.02Å; I477-M491 HydrophobicContact CG2-CB 4.06Å; I477-M491 HydrophobicContact CG2-CG 4.25Å; I477-A494 HydrophobicContact CD1-CB 4.3Å; I477-A494 HydrophobicContact CG1-CB 4.33Å; I477-A494 HydrophobicContact CG2-CB 4.39Å; I477-F495 VanDerWaalsContact CD1-CA 3.48Å; I477-F495 HydrophobicContact CD1-CB 3.86Å; I477-F495 HydrophobicContact CD1-CD2 4.34Å; I477-V553 HydrophobicContact CD1-CG1 4.49Å; I477-V553 HydrophobicContact CG1-CG1 4.27Å
478	L	84.4	Confident	81.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-50.2	176.8	-67.4	171.1	0	0	0	111	L382 Y386 W401 E405 Y408 I474 D475 S480 H481 V482 M491	L382-L478 HydrophobicContact CD2-CD1 4.47Å; Y386-L478 HydrophobicContact CD2-CB 4.24Å; Y386-L478 HydrophobicContact CE2-CB 3.58Å; Y386-L478 HydrophobicContact CE2-CD1 4.23Å; Y386-L478 HydrophobicContact CE2-CG 4.44Å; W401-L478 HydrophobicContact CZ2-CD2 3.83Å; W401-L478 HydrophobicContact CZ2-CG 4.23Å; E405-L478 HydrophobicContact CG-CD2 4.25Å; Y408-L478 HydrophobicContact CD1-CD1 4.24Å; Y408-L478 HydrophobicContact CE1-CD1 4.12Å; Y408-L478 HydrophobicContact CE2-CD1 4.44Å; Y408-L478 HydrophobicContact CG-CD1 4.48Å; I474-L478 HydrophobicContact CG2-CD1 3.87Å; I474-L478 HydrophobicContact CG2-CG 4.21Å; I474-L478 WeakPolarHBondContact O-CG 3.33Å; I474-L478 PolarHBondContact O-N 3.03Å; D475-L478 PolarHBondContact O-N 3.29Å; L478-S480 PolarHBondContact O-N 3.36Å; L478-S480 VanDerWaalsContact O-N 3.09Å; L478-H481 PolarHBondContact O-N 2.96Å; L478-V482 HydrophobicContact CB-CG2 4.18Å; L478-V482 HydrophobicContact CD2-CG2 3.74Å; L478-V482 VanDerWaalsContact O-CB 3.22Å; L478-V482 WeakPolarHBondContact O-CB 3.36Å; L478-V482 WeakPolarHBondContact O-CG2 3.5Å; L478-V482 PolarHBondContact O-N 2.89Å; L478-M491 HydrophobicContact CD2-SD 4.26Å
479	G	79.3	Confident	81.9	Confident	14 Å²	14	34.8 Å²	34.8	14%	0.144	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-5.6	179.7	0	0	0	0	0	115.8	D475 K483	D475-G479 PolarHBondContact O-N 2.93Å; G479-K483 WeakPolarHBondContact O-CD 3.2Å; G479-K483 WeakPolarHBondContact O-CE 3.47Å; G479-K483 PolarHBondContact O-NZ 3.39Å
480	S	78.5	Confident	82.1	Confident	37 Å²	37	33.5 Å²	33.5	26%	0.259	18%	0.181	S	C	.	.	H	α-helix	trans	-110.9	-44.5	170.1	54.5	0	0	0	0	112.5	G476 I477 L478	G476-S480 WeakPolarHBondContact O-CB 3.44Å; G476-S480 PolarHBondContact O-N 3.42Å; G476-S480 PolarHBondContact O-OG 2.84Å; I477-S480 PolarHBondContact O-N 3.24Å; I477-S480 PolarHBondContact O-OG 3.14Å; L478-S480 PolarHBondContact O-N 3.36Å; L478-S480 VanDerWaalsContact O-N 3.09Å
481	H	80.2	Confident	82.1	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-87.4	-34.4	-172.2	-71.2	63.6	0	0	0	113.8	I477 L478 L484 R485 R486 M491	I477-H481 VanDerWaalsContact O-CB 3.23Å; I477-H481 WeakPolarHBondContact O-CB 3.24Å; I477-H481 PolarHBondContact O-N 2.72Å; I477-H481 PolarHBondContact O-ND1 3.02Å; L478-H481 PolarHBondContact O-N 2.96Å; H481-L484 CarbonylContact O-C 3.5Å; H481-L484 PolarHBondContact O-N 3.18Å; H481-R485 PolarHBondContact O-N 2.99Å; H481-R486 HydrophobicContact CB-CB 4.12Å; H481-R486 PolarHBondContact O-N 2.92Å; H481-M491 HydrophobicContact CB-CG 3.46Å; H481-M491 VanDerWaalsContact CB-CG 3.46Å; H481-M491 HydrophobicContact CB-SD 3.78Å
482	V	78	Confident	82.3	Confident	11 Å²	11	33.5 Å²	33.5	7%	0.067	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-42.8	177.7	-178.5	0	0	0	0	110.1	I383 Y386 C387 L478 L484 R485 M491	I383-V482 HydrophobicContact CG1-CG1 4.33Å; Y386-V482 HydrophobicContact CD2-CB 4.16Å; Y386-V482 HydrophobicContact CD2-CG1 4.2Å; Y386-V482 HydrophobicContact CD2-CG2 4.4Å; Y386-V482 HydrophobicContact CG-CB 4.39Å; C387-V482 PolarHBondContact SG-O 3.16Å; C387-V482 VanDerWaalsContact SG-O 3.36Å; L478-V482 HydrophobicContact CB-CG2 4.18Å; L478-V482 HydrophobicContact CD2-CG2 3.74Å; L478-V482 VanDerWaalsContact O-CB 3.22Å; L478-V482 WeakPolarHBondContact O-CB 3.36Å; L478-V482 WeakPolarHBondContact O-CG2 3.5Å; L478-V482 PolarHBondContact O-N 2.89Å; V482-L484 PolarHBondContact O-N 2.81Å; V482-L484 VanDerWaalsContact O-N 3.11Å; V482-R485 PolarHBondContact O-N 2.86Å; V482-M491 HydrophobicContact CG2-CE 4.43Å; V482-M491 HydrophobicContact CG2-SD 3.85Å
483	K	73.2	Confident	82.7	Confident	134 Å²	134	33.1 Å²	33.1	58%	0.583	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-35.5	172.4	-68.6	-172.6	-172.6	150	0	112.8	G479	G479-K483 WeakPolarHBondContact O-CD 3.2Å; G479-K483 WeakPolarHBondContact O-CE 3.47Å; G479-K483 PolarHBondContact O-NZ 3.39Å
484	L	71.9	Confident	82.9	Confident	53 Å²	53	32.3 Å²	32.3	28%	0.277	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	22.9	-178.9	-66	167.6	0	0	0	113	H481 V482 R486 V557 F560	H481-L484 CarbonylContact O-C 3.5Å; H481-L484 PolarHBondContact O-N 3.18Å; V482-L484 PolarHBondContact O-N 2.81Å; V482-L484 VanDerWaalsContact O-N 3.11Å; L484-R486 HydrophobicContact CB-CG 4.42Å; L484-R486 PolarHBondContact O-N 3.23Å; L484-V557 HydrophobicContact CD1-CB 4.26Å; L484-V557 HydrophobicContact CD1-CG1 3.64Å; L484-V557 HydrophobicContact CD1-CG2 4.01Å; L484-F560 HydrophobicContact CB-CD2 3.94Å; L484-F560 HydrophobicContact CB-CE2 4.23Å; L484-F560 HydrophobicContact CD1-CB 4.15Å; L484-F560 HydrophobicContact CD1-CD2 4.08Å; L484-F560 HydrophobicContact CD2-CB 4.07Å; L484-F560 HydrophobicContact CD2-CD2 3.84Å; L484-F560 HydrophobicContact CD2-CG 4.26Å; L484-F560 HydrophobicContact CG-CD2 4.16Å
485	R	70.6	Confident	83.1	Confident	120 Å²	120	32.3 Å²	32.3	45%	0.453	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.7	37	178.2	-67	-168.5	169.5	-144.4	-4.1	114.2	D391 F393 H481 V482	D391-R485 PolarHBondContact O-NH1 2.86Å; D391-R485 PolarHBondContact O-NH2 3.33Å; D391-R485 VanDerWaalsContact O-NH2 3.16Å; F393-R485 HydrophobicContact CE1-CG 4.03Å; F393-R485 HydrophobicContact CZ-CG 4.38Å; H481-R485 PolarHBondContact O-N 2.99Å; V482-R485 PolarHBondContact O-N 2.86Å
486	R	78.7	Confident	83.4	Confident	73 Å²	73	30.7 Å²	30.7	28%	0.275	16%	0.162	S	C	.	.			trans	-75.3	155	-178.9	-68.2	-52.7	-156.1	-162.8	0.1	112.4	H481 L484 A490 A556 F560	H481-R486 HydrophobicContact CB-CB 4.12Å; H481-R486 PolarHBondContact O-N 2.92Å; L484-R486 HydrophobicContact CB-CG 4.42Å; L484-R486 PolarHBondContact O-N 3.23Å; R486-A490 HydrophobicContact CB-CB 4.3Å; R486-A556 PolarHBondContact NE-O 3.45Å; R486-A556 PolarHBondContact NH2-O 2.88Å; R486-F560 VanDerWaalsContact NH1-CE2 3.27Å
487	T	84.6	Confident	83.7	Confident	66 Å²	66	28.6 Å²	28.6	41%	0.405	14%	0.141	S	C	.	.			trans	-72.2	155.5	-175.3	61.6	0	0	0	0	113.1	D489 A490 M491	T487-D489 PolarHBondContact O-N 3.32Å; T487-A490 WeakPolarHBondContact O-CB 3.29Å; T487-A490 PolarHBondContact O-N 3.39Å; T487-A490 PolarHBondContact OG1-N 3.08Å; T487-M491 PolarHBondContact O-N 3.12Å
488	N	85.1	Confident	83.8	Confident	5 Å²	5	28.9 Å²	28.9	3%	0.027	14%	0.144	C	C	.	.	H	α-helix	trans	-56.1	-32.4	174.8	-65.3	-12.8	0	0	0	113.1	R379 Q396 H399 W401 N402 M491 F492	R379-N488 PolarHBondContact NH2-ND2 3.49Å; R379-N488 PolarHBondContact NH2-OD1 2.86Å; Q396-N488 PolarHBondContact OE1-OD1 3.2Å; H399-N488 HydrophobicContact CB-CB 3.59Å; H399-N488 PolarHBondContact CE1-O 2.86Å; H399-N488 VanDerWaalsContact CE1-O 3.3Å; H399-N488 PolarHBondContact ND1-O 3.06Å; W401-N488 HydrophobicContact CB-CB 4.06Å; W401-N488 WeakPolarHBondContact CB-O 3.33Å; W401-N488 HydrophobicContact CG-CB 4.5Å; N402-N488 PolarHBondContact ND2-ND2 3.45Å; N402-N488 PolarHBondContact OD1-ND2 3.13Å; N488-M491 WeakPolarHBondContact OD1-CE 3.47Å; N488-F492 WeakPolarHBondContact O-CB 3.18Å; N488-F492 PolarHBondContact O-N 3.06Å
489	D	87.4	Confident	84	Confident	40 Å²	40	28.9 Å²	28.9	21%	0.214	14%	0.144	C	C	.	.	H	α-helix	trans	-69.4	-38	173.9	171.5	98.2	0	0	0	112.4	R364 H399 T487 K493	R364-D489 IonicContact NH1-OD1 3.61Å; R364-D489 PolarHBondContact NH1-OD1 3.23Å; H399-D489 VanDerWaalsContact CE1-CA 3.49Å; H399-D489 WeakPolarHBondContact CE1-CA 3.41Å; T487-D489 PolarHBondContact O-N 3.32Å; D489-K493 WeakPolarHBondContact O-CB 3.45Å; D489-K493 WeakPolarHBondContact O-CG 3.21Å; D489-K493 PolarHBondContact O-N 3.03Å; D489-K493 WeakPolarHBondContact OD1-CE 3.42Å; D489-K493 IonicContact OD1-NZ 2.74Å; D489-K493 PolarHBondContact OD1-NZ 2.7Å; D489-K493 WeakPolarHBondContact OD2-CD 3.19Å; D489-K493 WeakPolarHBondContact OD2-CE 3.4Å; D489-K493 IonicContact OD2-NZ 3.71Å; D489-K493 PolarHBondContact OD2-NZ 2.93Å
490	A	87.5	Confident	84.5	Confident	11 Å²	11	28.4 Å²	28.4	9%	0.091	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-43.3	174.6	0	0	0	0	0	111.9	R486 T487 K493 A494 A556	R486-A490 HydrophobicContact CB-CB 4.3Å; T487-A490 WeakPolarHBondContact O-CB 3.29Å; T487-A490 PolarHBondContact O-N 3.39Å; T487-A490 PolarHBondContact OG1-N 3.08Å; A490-K493 PolarHBondContact O-N 3.19Å; A490-A494 PolarHBondContact O-N 3.08Å; A490-A556 HydrophobicContact CB-CB 4.16Å
491	M	87.9	Confident	84.9	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-42.9	176.4	-66.9	-167.7	-80.3	0	0	112.1	W401 I477 L478 H481 V482 T487 N488 K493 A494 F495	W401-M491 HydrophobicContact CD2-CB 3.72Å; W401-M491 VanDerWaalsContact CE2-CB 3.5Å; W401-M491 HydrophobicContact CE3-CB 4.31Å; W401-M491 HydrophobicContact CG-CB 4.05Å; W401-M491 HydrophobicContact CH2-CB 4.47Å; W401-M491 HydrophobicContact CZ2-CB 3.9Å; W401-M491 HydrophobicContact CZ2-SD 4.31Å; I477-M491 HydrophobicContact CG2-CB 4.06Å; I477-M491 HydrophobicContact CG2-CG 4.25Å; L478-M491 HydrophobicContact CD2-SD 4.26Å; H481-M491 HydrophobicContact CB-CG 3.46Å; H481-M491 VanDerWaalsContact CB-CG 3.46Å; H481-M491 HydrophobicContact CB-SD 3.78Å; V482-M491 HydrophobicContact CG2-CE 4.43Å; V482-M491 HydrophobicContact CG2-SD 3.85Å; T487-M491 PolarHBondContact O-N 3.12Å; N488-M491 WeakPolarHBondContact OD1-CE 3.47Å; M491-K493 PolarHBondContact O-N 2.86Å; M491-A494 PolarHBondContact O-N 3.37Å; M491-F495 WeakPolarHBondContact O-CB 3.46Å; M491-F495 PolarHBondContact O-N 2.91Å
492	F	91.3	Very high	85	Confident	1 Å²	1	35.1 Å²	35.1	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-62.2	-39.8	173.4	-174.2	-106.9	0	0	0	112.7	L363 R364 L367 H399 V400 W401 N488 F495 V496	L363-F492 HydrophobicContact CD2-CZ 4.34Å; L363-F492 HydrophobicContact CG-CZ 4.32Å; R364-F492 HydrophobicContact CB-CD1 4.27Å; R364-F492 HydrophobicContact CB-CE1 3.84Å; L367-F492 HydrophobicContact CD1-CZ 4.3Å; H399-F492 AromaticContact CE1-CG 3.97Å; V400-F492 HydrophobicContact CB-CD2 4.36Å; V400-F492 HydrophobicContact CB-CE2 4.11Å; V400-F492 HydrophobicContact CB-CZ 4.5Å; V400-F492 HydrophobicContact CG1-CD2 4.3Å; V400-F492 HydrophobicContact CG1-CE2 3.67Å; V400-F492 HydrophobicContact CG1-CZ 4.15Å; W401-F492 HydrophobicContact CB-CB 4.34Å; W401-F492 HydrophobicContact CE3-CB 4.42Å; N488-F492 WeakPolarHBondContact O-CB 3.18Å; N488-F492 PolarHBondContact O-N 3.06Å; F492-F495 WeakPolarHBondContact O-CB 3.49Å; F492-F495 PolarHBondContact O-N 2.73Å; F492-V496 HydrophobicContact CD1-CG2 4.27Å; F492-V496 HydrophobicContact CE1-CG2 3.92Å; F492-V496 HydrophobicContact CE2-CG2 4.36Å; F492-V496 HydrophobicContact CZ-CG2 3.97Å; F492-V496 WeakPolarHBondContact O-CG2 3.45Å; F492-V496 PolarHBondContact O-N 3.19Å
493	K	91.1	Very high	85.4	Confident	28 Å²	28	37.5 Å²	37.5	12%	0.122	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-39.2	175.4	-77.9	166.3	-177.3	161.7	0	112.4	R356 C360 D489 A490 M491 F495 S497	R356-K493 WeakPolarHBondContact O-CE 3.44Å; C360-K493 HydrophobicContact CB-CD 4.44Å; C360-K493 HydrophobicContact CB-CG 3.71Å; D489-K493 WeakPolarHBondContact O-CB 3.45Å; D489-K493 WeakPolarHBondContact O-CG 3.21Å; D489-K493 PolarHBondContact O-N 3.03Å; D489-K493 WeakPolarHBondContact OD1-CE 3.42Å; D489-K493 IonicContact OD1-NZ 2.74Å; D489-K493 PolarHBondContact OD1-NZ 2.7Å; D489-K493 WeakPolarHBondContact OD2-CD 3.19Å; D489-K493 WeakPolarHBondContact OD2-CE 3.4Å; D489-K493 IonicContact OD2-NZ 3.71Å; D489-K493 PolarHBondContact OD2-NZ 2.93Å; A490-K493 PolarHBondContact O-N 3.19Å; M491-K493 PolarHBondContact O-N 2.86Å; K493-F495 VanDerWaalsContact C-N 3.35Å; K493-S497 PolarHBondContact O-N 2.94Å; K493-S497 VanDerWaalsContact O-N 3.09Å; K493-S497 PolarHBondContact O-OG 3.37Å
494	A	89.5	Confident	86	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-43.7	171.4	0	0	0	0	0	111.4	I477 A490 M491 S497 A498 V553	I477-A494 HydrophobicContact CD1-CB 4.3Å; I477-A494 HydrophobicContact CG1-CB 4.33Å; I477-A494 HydrophobicContact CG2-CB 4.39Å; A490-A494 PolarHBondContact O-N 3.08Å; M491-A494 PolarHBondContact O-N 3.37Å; A494-S497 WeakPolarHBondContact O-CB 3.31Å; A494-S497 PolarHBondContact O-N 3.38Å; A494-A498 WeakPolarHBondContact O-CB 3.31Å; A494-A498 PolarHBondContact O-N 2.99Å; A494-V553 HydrophobicContact CB-CG1 3.99Å; A494-V553 VanDerWaalsContact CB-O 3.29Å; A494-V553 WeakPolarHBondContact CB-O 3.31Å
495	F	92	Very high	86.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-47.2	177.4	176.3	-101.9	0	0	0	113.2	W401 V404 L470 I474 I477 M491 F492 K493 S497 A498 A499 W508	W401-F495 HydrophobicContact CE3-CB 4.32Å; W401-F495 HydrophobicContact CH2-CB 4.32Å; W401-F495 HydrophobicContact CZ3-CB 3.55Å; W401-F495 HydrophobicContact CZ3-CD2 4.03Å; W401-F495 AromaticContact CZ3-CG 3.8Å; W401-F495 HydrophobicContact CZ3-CG 3.8Å; V404-F495 HydrophobicContact CG1-CE2 4.34Å; V404-F495 HydrophobicContact CG1-CZ 4.48Å; L470-F495 HydrophobicContact CD1-CE2 3.54Å; L470-F495 HydrophobicContact CD1-CZ 3.85Å; I474-F495 HydrophobicContact CD1-CE2 4.41Å; I474-F495 HydrophobicContact CG1-CD2 4.21Å; I474-F495 HydrophobicContact CG1-CE2 3.95Å; I477-F495 VanDerWaalsContact CD1-CA 3.48Å; I477-F495 HydrophobicContact CD1-CB 3.86Å; I477-F495 HydrophobicContact CD1-CD2 4.34Å; M491-F495 WeakPolarHBondContact O-CB 3.46Å; M491-F495 PolarHBondContact O-N 2.91Å; F492-F495 WeakPolarHBondContact O-CB 3.49Å; F492-F495 PolarHBondContact O-N 2.73Å; K493-F495 VanDerWaalsContact C-N 3.35Å; F495-S497 VanDerWaalsContact C-N 3.34Å; F495-S497 PolarHBondContact O-N 2.89Å; F495-A498 PolarHBondContact O-N 3.18Å; F495-A499 VanDerWaalsContact O-CB 3.24Å; F495-A499 WeakPolarHBondContact O-CB 3.48Å; F495-A499 PolarHBondContact O-N 3.27Å; F495-W508 HydrophobicContact CD2-CE3 4.43Å; F495-W508 HydrophobicContact CD2-CZ3 4.38Å; F495-W508 AromaticContact CE2-CE3 3.67Å; F495-W508 HydrophobicContact CE2-CE3 3.67Å; F495-W508 AromaticContact CE2-CZ3 3.98Å; F495-W508 HydrophobicContact CE2-CZ3 3.98Å; F495-W508 HydrophobicContact CZ-CB 4.41Å; F495-W508 AromaticContact CZ-CE3 3.78Å; F495-W508 HydrophobicContact CZ-CE3 3.78Å
496	V	91.7	Very high	87.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62	-41.7	176	174	0	0	0	0	110.9	L363 F492 A499 L500 L505	L363-V496 HydrophobicContact CD2-CG2 4.22Å; F492-V496 HydrophobicContact CD1-CG2 4.27Å; F492-V496 HydrophobicContact CE1-CG2 3.92Å; F492-V496 HydrophobicContact CE2-CG2 4.36Å; F492-V496 HydrophobicContact CZ-CG2 3.97Å; F492-V496 WeakPolarHBondContact O-CG2 3.45Å; F492-V496 PolarHBondContact O-N 3.19Å; V496-A499 PolarHBondContact O-N 3.36Å; V496-L500 HydrophobicContact CG1-CD1 4.02Å; V496-L500 HydrophobicContact CG1-CG 4.41Å; V496-L500 WeakPolarHBondContact O-CB 3.24Å; V496-L500 VanDerWaalsContact O-CG 3.31Å; V496-L500 WeakPolarHBondContact O-CG 3.25Å; V496-L500 PolarHBondContact O-N 3.36Å; V496-L505 HydrophobicContact CG1-CD1 4.31Å; V496-L505 HydrophobicContact CG1-CD2 4.36Å; V496-L505 HydrophobicContact CG2-CD1 4.34Å
497	S	89.1	Confident	88.3	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.2	-48.6	172.5	-69.3	0	0	0	0	112.4	K493 A494 F495 A499 L500 N501	K493-S497 PolarHBondContact O-N 2.94Å; K493-S497 VanDerWaalsContact O-N 3.09Å; K493-S497 PolarHBondContact O-OG 3.37Å; A494-S497 WeakPolarHBondContact O-CB 3.31Å; A494-S497 PolarHBondContact O-N 3.38Å; F495-S497 VanDerWaalsContact C-N 3.34Å; F495-S497 PolarHBondContact O-N 2.89Å; S497-A499 VanDerWaalsContact C-N 3.29Å; S497-A499 PolarHBondContact O-N 3.16Å; S497-L500 PolarHBondContact O-N 3.43Å; S497-N501 VanDerWaalsContact O-CG 3.23Å; S497-N501 PolarHBondContact O-N 3Å; S497-N501 PolarHBondContact O-OD1 3.29Å
498	A	88	Confident	88.6	Confident	9 Å²	9	22.8 Å²	22.8	7%	0.074	11%	0.107	C	C	.	.	H	α-helix	trans	-62.5	-37.2	179.1	0	0	0	0	0	112.4	A494 F495 R502 V553	A494-A498 WeakPolarHBondContact O-CB 3.31Å; A494-A498 PolarHBondContact O-N 2.99Å; F495-A498 PolarHBondContact O-N 3.18Å; A498-R502 PolarHBondContact O-N 3.26Å; A498-R502 VanDerWaalsContact O-N 3.16Å; A498-V553 HydrophobicContact CB-CG1 4.18Å; A498-V553 HydrophobicContact CB-CG2 3.76Å
499	A	88.9	Confident	89	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-72.4	-33.3	178.6	0	0	0	0	0	113	F495 V496 S497 R503 K504 L505 W508	F495-A499 VanDerWaalsContact O-CB 3.24Å; F495-A499 WeakPolarHBondContact O-CB 3.48Å; F495-A499 PolarHBondContact O-N 3.27Å; V496-A499 PolarHBondContact O-N 3.36Å; S497-A499 VanDerWaalsContact C-N 3.29Å; S497-A499 PolarHBondContact O-N 3.16Å; A499-R503 PolarHBondContact O-N 2.83Å; A499-K504 PolarHBondContact O-N 3.3Å; A499-L505 HydrophobicContact CB-CB 3.97Å; A499-L505 HydrophobicContact CB-CD1 3.81Å; A499-L505 PolarHBondContact O-N 2.72Å; A499-L505 VanDerWaalsContact O-N 3.14Å; A499-W508 VanDerWaalsContact CA-CZ3 3.42Å; A499-W508 HydrophobicContact CB-CD2 4.24Å; A499-W508 HydrophobicContact CB-CE3 3.3Å; A499-W508 HydrophobicContact CB-CH2 4.47Å; A499-W508 HydrophobicContact CB-CZ3 3.45Å; A499-W508 VanDerWaalsContact CB-CZ3 3.45Å
500	L	88.7	Confident	89.1	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-68.8	-49.5	171.1	-75.3	170.6	0	0	0	110.8	V355 L359 V496 S497 R502 R503 L505 L544 Y549 L551	V355-L500 HydrophobicContact CG1-CD1 3.94Å; V355-L500 HydrophobicContact CG2-CD1 3.92Å; L359-L500 HydrophobicContact CD2-CD1 4.24Å; V496-L500 HydrophobicContact CG1-CD1 4.02Å; V496-L500 HydrophobicContact CG1-CG 4.41Å; V496-L500 WeakPolarHBondContact O-CB 3.24Å; V496-L500 VanDerWaalsContact O-CG 3.31Å; V496-L500 WeakPolarHBondContact O-CG 3.25Å; V496-L500 PolarHBondContact O-N 3.36Å; S497-L500 PolarHBondContact O-N 3.43Å; L500-R502 VanDerWaalsContact C-N 3.29Å; L500-R502 PolarHBondContact O-N 3.14Å; L500-R503 WeakPolarHBondContact O-CA 3.23Å; L500-R503 PolarHBondContact O-N 2.83Å; L500-L505 HydrophobicContact CD2-CD2 3.86Å; L500-L505 HydrophobicContact CG-CD2 4.2Å; L500-L544 HydrophobicContact CD2-CB 4.22Å; L500-L544 HydrophobicContact CD2-CD1 4.12Å; L500-Y549 HydrophobicContact CB-CD2 4Å; L500-Y549 HydrophobicContact CB-CE2 4.35Å; L500-Y549 HydrophobicContact CB-CG 4.36Å; L500-Y549 HydrophobicContact CD2-CE2 4.05Å; L500-Y549 WeakPolarHBondContact O-CD2 3.35Å; L500-L551 HydrophobicContact CB-CD1 3.94Å; L500-L551 HydrophobicContact CD1-CD1 3.84Å
501	N	86.9	Confident	89	Confident	44 Å²	44	24.7 Å²	24.7	24%	0.235	11%	0.11	C	C	.	.	H	α-helix	trans	-54.2	-44	178.2	-65.9	-0	0	0	0	112.1	S497 R503 Y549 L551	S497-N501 VanDerWaalsContact O-CG 3.23Å; S497-N501 PolarHBondContact O-N 3Å; S497-N501 PolarHBondContact O-OD1 3.29Å; N501-R503 VanDerWaalsContact C-N 3.26Å; N501-R503 PolarHBondContact O-N 3.35Å; N501-Y549 WeakPolarHBondContact CA-O 3.44Å; N501-Y549 WeakPolarHBondContact CB-O 3.44Å; N501-Y549 WeakPolarHBondContact OD1-CB 3.44Å; N501-Y549 PolarHBondContact OD1-O 2.89Å; N501-L551 PolarHBondContact ND2-N 2.87Å; N501-L551 PolarHBondContact ND2-O 2.68Å; N501-L551 VanDerWaalsContact OD1-CB 3.31Å; N501-L551 WeakPolarHBondContact OD1-CB 3.43Å; N501-L551 PolarHBondContact OD1-N 3Å
502	R	83.7	Confident	89	Confident	135 Å²	135	24.6 Å²	24.6	51%	0.509	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-2.9	176.4	-64.8	-174.3	-176.6	-111.7	3.6	114.1	A498 L500 K504	A498-R502 PolarHBondContact O-N 3.26Å; A498-R502 VanDerWaalsContact O-N 3.16Å; L500-R502 VanDerWaalsContact C-N 3.29Å; L500-R502 PolarHBondContact O-N 3.14Å; R502-K504 VanDerWaalsContact C-N 3.25Å; R502-K504 HydrophobicContact CB-CG 4.21Å; R502-K504 WeakPolarHBondContact O-CG 3.49Å; R502-K504 PolarHBondContact O-N 3.36Å
503	R	86.1	Confident	88.9	Confident	62 Å²	62	25 Å²	25	23%	0.234	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	32.3	-171.8	-63.6	174.4	160.2	-161.9	-4.1	114	A499 L500 N501 S545 R546 F547 Y548	A499-R503 PolarHBondContact O-N 2.83Å; L500-R503 WeakPolarHBondContact O-CA 3.23Å; L500-R503 PolarHBondContact O-N 2.83Å; N501-R503 VanDerWaalsContact C-N 3.26Å; N501-R503 PolarHBondContact O-N 3.35Å; R503-S545 VanDerWaalsContact CD-O 3.29Å; R503-S545 WeakPolarHBondContact CD-O 3.28Å; R503-S545 PolarHBondContact NE-O 2.89Å; R503-R546 VanDerWaalsContact NH2-C 3.34Å; R503-R546 PolarHBondContact NH2-O 3.32Å; R503-F547 PolarHBondContact NE-O 3.17Å; R503-F547 PolarHBondContact NH2-O 3.43Å; R503-Y548 VanDerWaalsContact CZ-CE2 3.44Å; R503-Y548 VanDerWaalsContact CZ-CZ 3.44Å; R503-Y548 VanDerWaalsContact NH2-N 3.19Å
504	K	86	Confident	88.7	Confident	88 Å²	88	31.1 Å²	31.1	38%	0.383	13%	0.134	S	C	.	.			trans	-116.5	5.3	-174.1	-62.1	-48.9	179.3	-175.6	0	115.5	F466 A499 R502 A506 P507 W508	F466-K504 HydrophobicContact CE2-CB 4.23Å; F466-K504 HydrophobicContact CE2-CD 3.62Å; F466-K504 HydrophobicContact CE2-CG 3.71Å; F466-K504 HydrophobicContact CZ-CB 4.02Å; F466-K504 HydrophobicContact CZ-CD 3.97Å; F466-K504 HydrophobicContact CZ-CG 4.01Å; A499-K504 PolarHBondContact O-N 3.3Å; R502-K504 VanDerWaalsContact C-N 3.25Å; R502-K504 HydrophobicContact CB-CG 4.21Å; R502-K504 WeakPolarHBondContact O-CG 3.49Å; R502-K504 PolarHBondContact O-N 3.36Å; K504-A506 PolarHBondContact O-N 3Å; K504-P507 VanDerWaalsContact O-CD 3.31Å; K504-P507 WeakPolarHBondContact O-CD 3.41Å; K504-W508 HydrophobicContact CB-CD2 4.12Å; K504-W508 HydrophobicContact CB-CG 4.12Å; K504-W508 HydrophobicContact CB-CZ2 4.36Å; K504-W508 WeakPolarHBondContact O-CB 3.45Å; K504-W508 PolarHBondContact O-N 2.71Å
505	L	90.5	Very high	88.5	Confident	7 Å²	7	31.8 Å²	31.8	4%	0.037	14%	0.138	C	C	.	.	H	α-helix	trans	-45.7	-58.8	-178.4	-177.6	63.9	0	0	0	114.2	L363 V496 A499 L500 W508 L509 L541	L363-L505 HydrophobicContact CD2-CD1 4.46Å; V496-L505 HydrophobicContact CG1-CD1 4.31Å; V496-L505 HydrophobicContact CG1-CD2 4.36Å; V496-L505 HydrophobicContact CG2-CD1 4.34Å; A499-L505 HydrophobicContact CB-CB 3.97Å; A499-L505 HydrophobicContact CB-CD1 3.81Å; A499-L505 PolarHBondContact O-N 2.72Å; A499-L505 VanDerWaalsContact O-N 3.14Å; L500-L505 HydrophobicContact CD2-CD2 3.86Å; L500-L505 HydrophobicContact CG-CD2 4.2Å; L505-W508 PolarHBondContact O-N 3.35Å; L505-L509 HydrophobicContact CD1-CD1 3.77Å; L505-L509 HydrophobicContact CD1-CG 4.14Å; L505-L509 HydrophobicContact CG-CD1 3.89Å; L505-L509 VanDerWaalsContact O-CG 3.25Å; L505-L509 WeakPolarHBondContact O-CG 3.46Å; L505-L509 PolarHBondContact O-N 3.01Å; L505-L541 HydrophobicContact CD2-CD1 4.34Å; L505-L541 HydrophobicContact CD2-CD2 4.03Å; L505-L541 HydrophobicContact CG-CD1 4.37Å
506	A	90.6	Very high	88.2	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-49.2	179.3	0	0	0	0	0	113.1	K504 W508 L509 R510 C538 L541 D542	K504-A506 PolarHBondContact O-N 3Å; A506-W508 PolarHBondContact O-N 3.14Å; A506-L509 PolarHBondContact O-N 3.41Å; A506-R510 VanDerWaalsContact O-CB 3.23Å; A506-R510 WeakPolarHBondContact O-CB 3.44Å; A506-R510 PolarHBondContact O-N 3.44Å; A506-C538 HydrophobicContact CB-CB 3.98Å; A506-C538 PolarHBondContact O-SG 3.26Å; A506-C538 VanDerWaalsContact O-SG 3.36Å; A506-L541 HydrophobicContact CB-CB 3.99Å; A506-D542 WeakPolarHBondContact CB-OD1 3.34Å
507	P	88.4	Confident	88	Confident	38 Å²	38	42.8 Å²	42.8	25%	0.247	19%	0.19	C	C	.	.	H	α-helix	trans	-54.4	-39	170.1	-32.7	37.3	0	0	0	116.3	F466 K504 M511	F466-P507 HydrophobicContact CE1-CB 3.77Å; F466-P507 HydrophobicContact CZ-CB 3.55Å; K504-P507 VanDerWaalsContact O-CD 3.31Å; K504-P507 WeakPolarHBondContact O-CD 3.41Å; P507-M511 WeakPolarHBondContact O-CB 3.44Å; P507-M511 PolarHBondContact O-N 3.36Å; P507-M511 VanDerWaalsContact O-N 3.09Å
508	W	91.2	Very high	87.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70.5	-46.6	178	-75.9	-3.4	0	0	0	111.9	F466 V469 L470 T473 F495 A499 K504 L505 A506 R510 M511 V512	F466-W508 AromaticContact CE1-CD1 3.65Å; F466-W508 AromaticContact CE2-NE1 3.92Å; F466-W508 AromaticContact CZ-CD1 3.34Å; F466-W508 AromaticContact CZ-NE1 3.56Å; V469-W508 HydrophobicContact CG1-CZ2 4.26Å; L470-W508 HydrophobicContact CD1-CB 4.11Å; L470-W508 HydrophobicContact CD1-CD2 3.6Å; L470-W508 HydrophobicContact CD1-CE3 3.76Å; L470-W508 HydrophobicContact CD1-CG 3.75Å; L470-W508 HydrophobicContact CD1-CZ3 4.41Å; T473-W508 HydrophobicContact CG2-CH2 3.88Å; T473-W508 HydrophobicContact CG2-CZ2 4.44Å; T473-W508 WeakPolarHBondContact OG1-CH2 3.2Å; F495-W508 HydrophobicContact CD2-CE3 4.43Å; F495-W508 HydrophobicContact CD2-CZ3 4.38Å; F495-W508 AromaticContact CE2-CE3 3.67Å; F495-W508 HydrophobicContact CE2-CE3 3.67Å; F495-W508 AromaticContact CE2-CZ3 3.98Å; F495-W508 HydrophobicContact CE2-CZ3 3.98Å; F495-W508 HydrophobicContact CZ-CB 4.41Å; F495-W508 AromaticContact CZ-CE3 3.78Å; F495-W508 HydrophobicContact CZ-CE3 3.78Å; A499-W508 VanDerWaalsContact CA-CZ3 3.42Å; A499-W508 HydrophobicContact CB-CD2 4.24Å; A499-W508 HydrophobicContact CB-CE3 3.3Å; A499-W508 HydrophobicContact CB-CH2 4.47Å; A499-W508 HydrophobicContact CB-CZ3 3.45Å; A499-W508 VanDerWaalsContact CB-CZ3 3.45Å; K504-W508 HydrophobicContact CB-CD2 4.12Å; K504-W508 HydrophobicContact CB-CG 4.12Å; K504-W508 HydrophobicContact CB-CZ2 4.36Å; K504-W508 WeakPolarHBondContact O-CB 3.45Å; K504-W508 PolarHBondContact O-N 2.71Å; L505-W508 PolarHBondContact O-N 3.35Å; A506-W508 PolarHBondContact O-N 3.14Å; W508-R510 VanDerWaalsContact C-N 3.33Å; W508-R510 PolarHBondContact O-N 3.22Å; W508-M511 WeakPolarHBondContact O-CB 3.41Å; W508-M511 PolarHBondContact O-N 2.96Å; W508-V512 PolarHBondContact O-N 2.84Å
509	L	91.6	Very high	87.7	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-45.2	175	-64.9	167.1	0	0	0	110.6	L363 L367 L505 A506 M511 V512 F513 I534 L541	L363-L509 HydrophobicContact CD1-CD1 4.42Å; L363-L509 HydrophobicContact CD2-CD1 4.22Å; L367-L509 HydrophobicContact CD1-CD2 4.11Å; L505-L509 HydrophobicContact CD1-CD1 3.77Å; L505-L509 HydrophobicContact CD1-CG 4.14Å; L505-L509 HydrophobicContact CG-CD1 3.89Å; L505-L509 VanDerWaalsContact O-CG 3.25Å; L505-L509 WeakPolarHBondContact O-CG 3.46Å; L505-L509 PolarHBondContact O-N 3.01Å; A506-L509 PolarHBondContact O-N 3.41Å; L509-M511 PolarHBondContact O-N 3.09Å; L509-V512 PolarHBondContact O-N 2.8Å; L509-F513 HydrophobicContact CB-CD2 4.22Å; L509-F513 HydrophobicContact CB-CE2 4.46Å; L509-F513 HydrophobicContact CD2-CD2 4.41Å; L509-F513 HydrophobicContact CD2-CE2 3.81Å; L509-F513 WeakPolarHBondContact O-CB 3.19Å; L509-F513 WeakPolarHBondContact O-CD2 3.35Å; L509-F513 PolarHBondContact O-N 3.44Å; L509-I534 HydrophobicContact CB-CG1 4.47Å; L509-L541 HydrophobicContact CD1-CD1 3.4Å
510	R	89.7	Confident	87.6	Confident	62 Å²	62	49.5 Å²	49.5	23%	0.234	22%	0.22	C	C	.	.	H	α-helix	trans	-55.5	-34.3	172.9	-177.8	-178.7	-77.3	125.5	-3.1	112.6	A506 W508 R514 D535 C538	A506-R510 VanDerWaalsContact O-CB 3.23Å; A506-R510 WeakPolarHBondContact O-CB 3.44Å; A506-R510 PolarHBondContact O-N 3.44Å; W508-R510 VanDerWaalsContact C-N 3.33Å; W508-R510 PolarHBondContact O-N 3.22Å; R510-R514 HydrophobicContact CG-CG 4.34Å; R510-R514 WeakPolarHBondContact O-CB 3.31Å; R510-R514 VanDerWaalsContact O-CG 3.22Å; R510-R514 WeakPolarHBondContact O-CG 3.24Å; R510-R514 PolarHBondContact O-N 2.84Å; R510-D535 IonicContact CZ-OD1 2.87Å; R510-D535 VanDerWaalsContact CZ-OD1 3.3Å; R510-D535 IonicContact NE-OD1 3.15Å; R510-D535 PolarHBondContact NE-OD1 3.16Å; R510-D535 IonicContact NH2-OD1 2.67Å; R510-D535 PolarHBondContact NH2-OD1 3.08Å; R510-C538 VanDerWaalsContact NH2-CB 3.3Å
511	M	85.9	Confident	87.3	Confident	30 Å²	30	52.7 Å²	52.7	15%	0.148	24%	0.235	C	C	.	.	H	α-helix	trans	-79	-35.8	-178.7	-167.1	153	67.6	0	0	113.1	F407 L463 F466 I467 L470 P507 W508 L509	F407-M511 VanDerWaalsContact CE2-O 3.3Å; F407-M511 WeakPolarHBondContact CE2-O 3.48Å; F407-M511 HydrophobicContact CZ-CG 4.16Å; L463-M511 HydrophobicContact CD1-SD 4.17Å; F466-M511 HydrophobicContact CD1-CE 3.49Å; F466-M511 VanDerWaalsContact CD1-CE 3.49Å; F466-M511 HydrophobicContact CD1-SD 3.73Å; F466-M511 HydrophobicContact CE1-CE 3.75Å; F466-M511 HydrophobicContact CE1-SD 4.23Å; F466-M511 HydrophobicContact CG-CE 4.44Å; I467-M511 HydrophobicContact CB-CE 4.39Å; I467-M511 HydrophobicContact CB-SD 4.46Å; I467-M511 HydrophobicContact CD1-SD 4.41Å; I467-M511 HydrophobicContact CG1-CE 3.93Å; I467-M511 HydrophobicContact CG1-CG 4.45Å; I467-M511 HydrophobicContact CG1-SD 3.41Å; I467-M511 WeakPolarHBondContact CG1-SD 3.45Å; L470-M511 HydrophobicContact CB-CE 3.86Å; L470-M511 HydrophobicContact CD2-CE 3.46Å; L470-M511 VanDerWaalsContact CD2-CE 3.46Å; L470-M511 HydrophobicContact CG-CE 4.29Å; P507-M511 WeakPolarHBondContact O-CB 3.44Å; P507-M511 PolarHBondContact O-N 3.36Å; P507-M511 VanDerWaalsContact O-N 3.09Å; W508-M511 WeakPolarHBondContact O-CB 3.41Å; W508-M511 PolarHBondContact O-N 2.96Å; L509-M511 PolarHBondContact O-N 3.09Å
512	V	87.8	Confident	87.3	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-69.2	-55.7	172.3	175.8	0	0	0	0	110.4	V403 F407 L470 W508 L509 R514 C515	V403-V512 HydrophobicContact CG1-CG1 4.15Å; F407-V512 HydrophobicContact CB-CG1 4.05Å; F407-V512 HydrophobicContact CB-CG2 4.43Å; F407-V512 HydrophobicContact CD1-CG2 4.01Å; F407-V512 HydrophobicContact CD2-CB 4.37Å; F407-V512 HydrophobicContact CD2-CG1 4.44Å; F407-V512 HydrophobicContact CD2-CG2 4.33Å; F407-V512 HydrophobicContact CE1-CG2 4.36Å; F407-V512 HydrophobicContact CG-CB 4.39Å; F407-V512 HydrophobicContact CG-CG1 4.28Å; F407-V512 HydrophobicContact CG-CG2 3.99Å; L470-V512 HydrophobicContact CD2-CG2 4.22Å; W508-V512 PolarHBondContact O-N 2.84Å; L509-V512 PolarHBondContact O-N 2.8Å; V512-R514 PolarHBondContact O-N 2.94Å; V512-C515 VanDerWaalsContact O-CB 3.25Å; V512-C515 WeakPolarHBondContact O-CB 3.21Å; V512-C515 PolarHBondContact O-N 3.49Å; V512-C515 VanDerWaalsContact O-N 3.09Å
513	F	89	Confident	87.5	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.039	20%	0.201	C	C	.	.	H	α-helix	trans	-82.5	-2.2	-170.8	-64	-66.2	0	0	0	115.4	L367 V400 V403 L509 M519 Y523 I529 I534	L367-F513 HydrophobicContact CD1-CE2 3.91Å; L367-F513 HydrophobicContact CD1-CZ 4.1Å; L367-F513 HydrophobicContact CD2-CD2 4.31Å; L367-F513 HydrophobicContact CD2-CE2 3.85Å; L367-F513 HydrophobicContact CD2-CZ 4.02Å; L367-F513 HydrophobicContact CG-CE2 4.45Å; L367-F513 HydrophobicContact CG-CZ 4.45Å; V400-F513 HydrophobicContact CG1-CZ 4.08Å; V403-F513 HydrophobicContact CG1-CD1 4.46Å; V403-F513 HydrophobicContact CG1-CE1 3.83Å; L509-F513 HydrophobicContact CB-CD2 4.22Å; L509-F513 HydrophobicContact CB-CE2 4.46Å; L509-F513 HydrophobicContact CD2-CD2 4.41Å; L509-F513 HydrophobicContact CD2-CE2 3.81Å; L509-F513 WeakPolarHBondContact O-CB 3.19Å; L509-F513 WeakPolarHBondContact O-CD2 3.35Å; L509-F513 PolarHBondContact O-N 3.44Å; F513-M519 HydrophobicContact CB-SD 4.32Å; F513-M519 HydrophobicContact CD1-SD 4.08Å; F513-M519 WeakPolarHBondContact O-CG 3.48Å; F513-Y523 HydrophobicContact CD1-CE2 4.12Å; F513-Y523 AromaticContact CE1-CE2 3.79Å; F513-Y523 HydrophobicContact CE1-CE2 3.79Å; F513-Y523 AromaticContact CE1-CZ 3.9Å; F513-Y523 WeakPolarHBondContact CE1-OH 3.48Å; F513-I529 HydrophobicContact CB-CG2 3.99Å; F513-I529 HydrophobicContact CD1-CD1 3.54Å; F513-I529 HydrophobicContact CD1-CG2 4.22Å; F513-I529 HydrophobicContact CE1-CD1 3.57Å; F513-I529 HydrophobicContact CG-CD1 4.11Å; F513-I529 HydrophobicContact CG-CG2 4.3Å; F513-I529 HydrophobicContact CZ-CD1 4.17Å; F513-I534 HydrophobicContact CB-CB 3.89Å; F513-I534 HydrophobicContact CB-CD1 4.31Å; F513-I534 HydrophobicContact CB-CG1 3.91Å; F513-I534 HydrophobicContact CB-CG2 4.05Å; F513-I534 HydrophobicContact CD2-CD1 3.72Å; F513-I534 HydrophobicContact CD2-CG1 3.97Å; F513-I534 HydrophobicContact CE2-CD1 4.41Å; F513-I534 HydrophobicContact CG-CD1 4.2Å; F513-I534 HydrophobicContact CG-CG1 4.28Å
514	R	86.8	Confident	87.5	Confident	158 Å²	158	42.1 Å²	42.1	60%	0.596	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	0.7	162.9	-70.7	-177.5	172.5	-166	-2	113.2	R510 V512 Q516 I534 D535	R510-R514 HydrophobicContact CG-CG 4.34Å; R510-R514 WeakPolarHBondContact O-CB 3.31Å; R510-R514 VanDerWaalsContact O-CG 3.22Å; R510-R514 WeakPolarHBondContact O-CG 3.24Å; R510-R514 PolarHBondContact O-N 2.84Å; V512-R514 PolarHBondContact O-N 2.94Å; R514-Q516 PolarHBondContact O-N 3.18Å; R514-I534 HydrophobicContact CG-CG2 4.32Å; R514-D535 IonicContact CZ-OD1 2.7Å; R514-D535 IonicContact CZ-OD2 3.85Å; R514-D535 VanDerWaalsContact CZ-OD2 3.29Å; R514-D535 IonicContact NE-OD2 2.71Å; R514-D535 PolarHBondContact NE-OD2 2.9Å; R514-D535 VanDerWaalsContact NH2-CG 3.26Å; R514-D535 IonicContact NH2-OD1 2.88Å; R514-D535 PolarHBondContact NH2-OD1 2.7Å; R514-D535 IonicContact NH2-OD2 2.66Å; R514-D535 PolarHBondContact NH2-OD2 3.34Å
515	C	85.8	Confident	87.5	Confident	14 Å²	14	41.5 Å²	41.5	10%	0.095	20%	0.2	C	C	.	.			trans	-78	102.9	175.5	-164.8	0	0	0	0	109.3	F407 K411 V512 Q517 V518 M519	F407-C515 HydrophobicContact CD2-CB 3.91Å; F407-C515 HydrophobicContact CE2-CB 4Å; K411-C515 PolarHBondContact NZ-SG 3.43Å; K411-C515 VanDerWaalsContact NZ-SG 3.39Å; V512-C515 VanDerWaalsContact O-CB 3.25Å; V512-C515 WeakPolarHBondContact O-CB 3.21Å; V512-C515 PolarHBondContact O-N 3.49Å; V512-C515 VanDerWaalsContact O-N 3.09Å; C515-Q517 VanDerWaalsContact C-N 3.32Å; C515-Q517 PolarHBondContact O-N 3.28Å; C515-V518 HydrophobicContact CB-CB 4.14Å; C515-V518 HydrophobicContact CB-CG2 3.86Å; C515-V518 WeakPolarHBondContact O-CA 3.33Å; C515-V518 WeakPolarHBondContact O-CB 3.47Å; C515-V518 PolarHBondContact O-N 2.87Å; C515-M519 PolarHBondContact O-N 2.94Å; C515-M519 VanDerWaalsContact O-N 3.17Å
516	Q	86.3	Confident	87.3	Confident	134 Å²	134	48.5 Å²	48.5	63%	0.626	23%	0.227	S	C	*	.	H	α-helix	trans	-48.1	-48.9	-173.6	179.1	173.4	-7.4	0	0	113.5	R514 V518 M519 E520	R514-Q516 PolarHBondContact O-N 3.18Å; Q516-V518 VanDerWaalsContact C-N 3.28Å; Q516-V518 PolarHBondContact O-N 2.76Å; Q516-M519 WeakPolarHBondContact O-CB 3.5Å; Q516-M519 PolarHBondContact O-N 2.75Å; Q516-E520 VanDerWaalsContact CG-CD 3.48Å; Q516-E520 HydrophobicContact CG-CG 4.26Å; Q516-E520 VanDerWaalsContact CG-OE1 3.23Å; Q516-E520 WeakPolarHBondContact CG-OE1 3.31Å; Q516-E520 PolarHBondContact NE2-OE1 3.2Å; Q516-E520 WeakPolarHBondContact O-CG 3.39Å; Q516-E520 PolarHBondContact O-N 3.31Å
517	Q	86.1	Confident	87.1	Confident	97 Å²	97	48.3 Å²	48.3	45%	0.453	23%	0.225	S	C	.	.	H	α-helix	trans	-55.6	-39.3	177	-62.8	170.9	-66.8	0	0	113.1	L410 C515 E521	L410-Q517 HydrophobicContact CD1-CB 4.17Å; C515-Q517 VanDerWaalsContact C-N 3.32Å; C515-Q517 PolarHBondContact O-N 3.28Å; Q517-E521 VanDerWaalsContact O-CB 3.3Å; Q517-E521 WeakPolarHBondContact O-CB 3.24Å; Q517-E521 VanDerWaalsContact O-CG 3.26Å; Q517-E521 WeakPolarHBondContact O-CG 3.49Å; Q517-E521 PolarHBondContact O-N 2.95Å
518	V	86.4	Confident	87.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.3	-39	178	176	0	0	0	0	110.6	V403 F407 L410 C515 Q516 C522	V403-V518 HydrophobicContact CG1-CG1 3.23Å; F407-V518 HydrophobicContact CB-CG2 4.06Å; F407-V518 HydrophobicContact CD2-CG2 4.19Å; L410-V518 HydrophobicContact CD1-CG2 3.53Å; C515-V518 HydrophobicContact CB-CB 4.14Å; C515-V518 HydrophobicContact CB-CG2 3.86Å; C515-V518 WeakPolarHBondContact O-CA 3.33Å; C515-V518 WeakPolarHBondContact O-CB 3.47Å; C515-V518 PolarHBondContact O-N 2.87Å; Q516-V518 VanDerWaalsContact C-N 3.28Å; Q516-V518 PolarHBondContact O-N 2.76Å; V518-C522 WeakPolarHBondContact O-CB 3.43Å; V518-C522 PolarHBondContact O-N 3.25Å; V518-C522 PolarHBondContact O-SG 3.46Å; V518-C522 VanDerWaalsContact O-SG 3.4Å
519	M	86.1	Confident	87	Confident	24 Å²	24	46.9 Å²	46.9	12%	0.118	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-44.7	176.8	-66.7	-52.8	-52.9	0	0	111.7	F513 C515 Q516 Y523 I529 C530	F513-M519 HydrophobicContact CB-SD 4.32Å; F513-M519 HydrophobicContact CD1-SD 4.08Å; F513-M519 WeakPolarHBondContact O-CG 3.48Å; C515-M519 PolarHBondContact O-N 2.94Å; C515-M519 VanDerWaalsContact O-N 3.17Å; Q516-M519 WeakPolarHBondContact O-CB 3.5Å; Q516-M519 PolarHBondContact O-N 2.75Å; M519-Y523 HydrophobicContact CE-CD2 3.72Å; M519-Y523 HydrophobicContact CE-CG 3.8Å; M519-Y523 WeakPolarHBondContact O-CB 3.49Å; M519-Y523 PolarHBondContact O-N 2.91Å; M519-Y523 VanDerWaalsContact O-N 3.08Å; M519-Y523 HydrophobicContact SD-CD2 3.91Å; M519-Y523 HydrophobicContact SD-CE2 4.38Å; M519-I529 HydrophobicContact CE-CB 3.77Å; M519-I529 HydrophobicContact CE-CG2 3.5Å; M519-I529 HydrophobicContact SD-CG2 3.81Å; M519-C530 WeakPolarHBondContact CE-SG 3.29Å
520	E	85.4	Confident	86.7	Confident	126 Å²	126	49.5 Å²	49.5	59%	0.589	23%	0.233	S	C	*	.	H	α-helix	trans	-68.4	-36.8	-179.9	-69.8	167.8	166.4	0	0	112.9	Q516	Q516-E520 VanDerWaalsContact CG-CD 3.48Å; Q516-E520 HydrophobicContact CG-CG 4.26Å; Q516-E520 VanDerWaalsContact CG-OE1 3.23Å; Q516-E520 WeakPolarHBondContact CG-OE1 3.31Å; Q516-E520 PolarHBondContact NE2-OE1 3.2Å; Q516-E520 WeakPolarHBondContact O-CG 3.39Å; Q516-E520 PolarHBondContact O-N 3.31Å
521	E	83.8	Confident	86.5	Confident	70 Å²	70	50.7 Å²	50.7	33%	0.327	25%	0.247	S	C	.	.	H	α-helix	trans	-83.2	-33	-180	-70.1	179.3	150.9	0	0	114	S374 R406 Q517	S374-E521 WeakPolarHBondContact CB-O 3.48Å; S374-E521 PolarHBondContact OG-O 3.01Å; R406-E521 IonicContact CZ-OE1 3.34Å; R406-E521 IonicContact CZ-OE2 2.87Å; R406-E521 VanDerWaalsContact CZ-OE2 3.29Å; R406-E521 IonicContact NE-OE1 2.72Å; R406-E521 IonicContact NE-OE2 2.84Å; R406-E521 PolarHBondContact NE-OE2 3.36Å; R406-E521 VanDerWaalsContact NH2-CD 3.3Å; R406-E521 IonicContact NH2-OE1 2.72Å; R406-E521 PolarHBondContact NH2-OE1 3.18Å; R406-E521 IonicContact NH2-OE2 3.27Å; R406-E521 PolarHBondContact NH2-OE2 3.25Å; R406-E521 VanDerWaalsContact NH2-OE2 3.08Å; Q517-E521 VanDerWaalsContact O-CB 3.3Å; Q517-E521 WeakPolarHBondContact O-CB 3.24Å; Q517-E521 VanDerWaalsContact O-CG 3.26Å; Q517-E521 WeakPolarHBondContact O-CG 3.49Å; Q517-E521 PolarHBondContact O-N 2.95Å
522	C	86.2	Confident	86.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-105.5	-20.3	-169.8	-56.6	0	0	0	0	114.5	L371 L372 A375 V403 V518	L371-C522 HydrophobicContact CD1-CB 4.22Å; L372-C522 WeakPolarHBondContact CB-O 3.38Å; L372-C522 PolarHBondContact N-O 2.9Å; A375-C522 HydrophobicContact CB-CB 3.95Å; V403-C522 HydrophobicContact CG2-CB 4.27Å; V518-C522 WeakPolarHBondContact O-CB 3.43Å; V518-C522 PolarHBondContact O-N 3.25Å; V518-C522 PolarHBondContact O-SG 3.46Å; V518-C522 VanDerWaalsContact O-SG 3.4Å
523	Y	88.5	Confident	86.3	Confident	9 Å²	9	52.5 Å²	52.5	4%	0.035	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-123.8	140.3	-170.1	-76.6	-83	0	0	0	114.3	L367 G370 L371 V403 F513 M519 I529	L367-Y523 VanDerWaalsContact O-CE1 3.27Å; L367-Y523 WeakPolarHBondContact O-CE1 3.41Å; L367-Y523 PolarHBondContact O-OH 3.17Å; G370-Y523 WeakPolarHBondContact O-CA 3.35Å; L371-Y523 HydrophobicContact CB-CE1 4.16Å; L371-Y523 HydrophobicContact CD1-CE1 4.02Å; L371-Y523 HydrophobicContact CD1-CE2 4.04Å; V403-Y523 HydrophobicContact CG1-CE2 4.01Å; V403-Y523 HydrophobicContact CG2-CE2 3.94Å; F513-Y523 HydrophobicContact CD1-CE2 4.12Å; F513-Y523 AromaticContact CE1-CE2 3.79Å; F513-Y523 HydrophobicContact CE1-CE2 3.79Å; F513-Y523 AromaticContact CE1-CZ 3.9Å; F513-Y523 WeakPolarHBondContact CE1-OH 3.48Å; M519-Y523 HydrophobicContact CE-CD2 3.72Å; M519-Y523 HydrophobicContact CE-CG 3.8Å; M519-Y523 WeakPolarHBondContact O-CB 3.49Å; M519-Y523 PolarHBondContact O-N 2.91Å; M519-Y523 VanDerWaalsContact O-N 3.08Å; M519-Y523 HydrophobicContact SD-CD2 3.91Å; M519-Y523 HydrophobicContact SD-CE2 4.38Å; Y523-I529 HydrophobicContact CE1-CD1 3.81Å; Y523-I529 HydrophobicContact CE1-CG1 4.47Å; Y523-I529 HydrophobicContact CE2-CD1 4.2Å
524	A	86.7	Confident	86.2	Confident	11 Å²	11	52.2 Å²	52.2	9%	0.091	26%	0.264	C	S	.	.			trans	-68.9	152.2	166.8	0	0	0	0	0	111.4	G370 L372 W526 S527 C530	G370-A524 PolarHBondContact O-N 3.48Å; L372-A524 HydrophobicContact CD2-CB 4.19Å; A524-W526 HydrophobicContact CB-CD2 4.08Å; A524-W526 HydrophobicContact CB-CG 4.16Å; A524-W526 HydrophobicContact CB-CZ2 4.14Å; A524-W526 PolarHBondContact O-N 3.49Å; A524-S527 WeakPolarHBondContact O-CB 3.41Å; A524-S527 PolarHBondContact O-N 2.84Å; A524-S527 PolarHBondContact O-OG 3.43Å; A524-C530 PolarHBondContact O-SG 3.43Å; A524-C530 VanDerWaalsContact O-SG 3.39Å
525	S	85.2	Confident	86.3	Confident	74 Å²	74	46.8 Å²	46.8	52%	0.517	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.4	176.3	53.9	0	0	0	0	113.5	S527 C530 V531	S525-S527 VanDerWaalsContact C-N 3.32Å; S525-C530 WeakPolarHBondContact O-CB 3.37Å; S525-V531 WeakPolarHBondContact O-CG2 3.39Å
526	W	86.3	Confident	86.3	Confident	155 Å²	155	48.9 Å²	48.9	59%	0.587	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	0.3	177	58.4	-99.9	0	0	0	114.3	H369 G370 A524	H369-W526 AromaticContact CE1-CE3 3.68Å; H369-W526 AromaticContact CE1-CZ3 3.69Å; H369-W526 AromaticContact ND1-CZ3 3.88Å; G370-W526 VanDerWaalsContact CA-CH2 3.49Å; A524-W526 HydrophobicContact CB-CD2 4.08Å; A524-W526 HydrophobicContact CB-CG 4.16Å; A524-W526 HydrophobicContact CB-CZ2 4.14Å; A524-W526 PolarHBondContact O-N 3.49Å
527	S	87.2	Confident	86.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-61.3	151.3	177.7	69.7	0	0	0	0	111.9	H369 A524 S525 I529 C530 V531	H369-S527 WeakPolarHBondContact O-CA 3.21Å; H369-S527 WeakPolarHBondContact O-CB 3.43Å; A524-S527 WeakPolarHBondContact O-CB 3.41Å; A524-S527 PolarHBondContact O-N 2.84Å; A524-S527 PolarHBondContact O-OG 3.43Å; S525-S527 VanDerWaalsContact C-N 3.32Å; S527-I529 PolarHBondContact O-N 3.21Å; S527-C530 PolarHBondContact O-N 3.27Å; S527-C530 VanDerWaalsContact OG-CB 3.27Å; S527-C530 WeakPolarHBondContact OG-CB 3.34Å; S527-C530 PolarHBondContact OG-N 3.45Å; S527-C530 VanDerWaalsContact OG-N 3.15Å; S527-C530 PolarHBondContact OG-SG 2.85Å; S527-V531 WeakPolarHBondContact O-CG2 3.49Å; S527-V531 PolarHBondContact O-N 2.97Å
528	Y	88.1	Confident	86.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.8	-38.5	178.2	168.4	-101.8	0	0	0	111.6	W314 L366 H369 V532 T537	W314-Y528 HydrophobicContact CB-CD2 3.87Å; W314-Y528 HydrophobicContact CB-CG 4.24Å; W314-Y528 HydrophobicContact CD2-CD2 4.03Å; W314-Y528 AromaticContact CE3-CD2 3.78Å; W314-Y528 HydrophobicContact CE3-CD2 3.78Å; W314-Y528 AromaticContact CE3-CE2 3.99Å; W314-Y528 HydrophobicContact CE3-CE2 3.99Å; W314-Y528 HydrophobicContact CG-CD2 4.07Å; L366-Y528 HydrophobicContact CD1-CD1 3.62Å; L366-Y528 HydrophobicContact CD1-CD2 4.05Å; L366-Y528 HydrophobicContact CD1-CE1 3.9Å; L366-Y528 HydrophobicContact CD1-CE2 4.29Å; L366-Y528 HydrophobicContact CD1-CG 3.71Å; L366-Y528 HydrophobicContact CD2-CD1 4.18Å; L366-Y528 HydrophobicContact CD2-CE1 3.76Å; L366-Y528 HydrophobicContact CG-CD1 3.74Å; L366-Y528 HydrophobicContact CG-CE1 3.86Å; L366-Y528 HydrophobicContact CG-CG 4.34Å; H369-Y528 PolarHBondContact ND1-N 3.35Å; H369-Y528 PolarHBondContact O-N 2.93Å; Y528-V532 HydrophobicContact CD2-CB 4.02Å; Y528-V532 HydrophobicContact CD2-CG2 3.76Å; Y528-V532 HydrophobicContact CE2-CB 3.64Å; Y528-V532 HydrophobicContact CE2-CG1 3.81Å; Y528-V532 HydrophobicContact CE2-CG2 3.65Å; Y528-V532 WeakPolarHBondContact O-CB 3.33Å; Y528-V532 PolarHBondContact O-N 2.87Å; Y528-T537 VanDerWaalsContact CE1-OG1 3.29Å; Y528-T537 WeakPolarHBondContact CE1-OG1 3.27Å; Y528-T537 PolarHBondContact OH-OG1 2.66Å
529	I	87.8	Confident	86.8	Confident	7 Å²	7	44 Å²	44	4%	0.036	23%	0.23	C	C	.	.	H	α-helix	trans	-70.8	-39	-177.9	-49.2	-177.5	0	0	0	111.2	L367 F513 M519 Y523 S527 G533 I534	L367-I529 HydrophobicContact CB-CD1 4.45Å; L367-I529 HydrophobicContact CD2-CD1 3.53Å; L367-I529 HydrophobicContact CD2-CG1 4.16Å; F513-I529 HydrophobicContact CB-CG2 3.99Å; F513-I529 HydrophobicContact CD1-CD1 3.54Å; F513-I529 HydrophobicContact CD1-CG2 4.22Å; F513-I529 HydrophobicContact CE1-CD1 3.57Å; F513-I529 HydrophobicContact CG-CD1 4.11Å; F513-I529 HydrophobicContact CG-CG2 4.3Å; F513-I529 HydrophobicContact CZ-CD1 4.17Å; M519-I529 HydrophobicContact CE-CB 3.77Å; M519-I529 HydrophobicContact CE-CG2 3.5Å; M519-I529 HydrophobicContact SD-CG2 3.81Å; Y523-I529 HydrophobicContact CE1-CD1 3.81Å; Y523-I529 HydrophobicContact CE1-CG1 4.47Å; Y523-I529 HydrophobicContact CE2-CD1 4.2Å; S527-I529 PolarHBondContact O-N 3.21Å; I529-G533 WeakPolarHBondContact O-CA 3.3Å; I529-G533 PolarHBondContact O-N 2.9Å; I529-G533 VanDerWaalsContact O-N 3.11Å; I529-I534 HydrophobicContact CG2-CB 4.3Å
530	C	86	Confident	86.9	Confident	58 Å²	58	44 Å²	44	39%	0.392	23%	0.23	S	C	.	.	H	α-helix	trans	-69	-40.4	173.9	-71	0	0	0	0	112.9	M519 A524 S525 S527	M519-C530 WeakPolarHBondContact CE-SG 3.29Å; A524-C530 PolarHBondContact O-SG 3.43Å; A524-C530 VanDerWaalsContact O-SG 3.39Å; S525-C530 WeakPolarHBondContact O-CB 3.37Å; S527-C530 PolarHBondContact O-N 3.27Å; S527-C530 VanDerWaalsContact OG-CB 3.27Å; S527-C530 WeakPolarHBondContact OG-CB 3.34Å; S527-C530 PolarHBondContact OG-N 3.45Å; S527-C530 VanDerWaalsContact OG-N 3.15Å; S527-C530 PolarHBondContact OG-SG 2.85Å
531	V	85.1	Confident	87.1	Confident	87 Å²	87	38.1 Å²	38.1	53%	0.527	20%	0.203	S	C	.	.	H	α-helix	trans	-82.4	-41.3	-172.6	176	0	0	0	0	113	S525 S527	S525-V531 WeakPolarHBondContact O-CG2 3.39Å; S527-V531 WeakPolarHBondContact O-CG2 3.49Å; S527-V531 PolarHBondContact O-N 2.97Å
532	V	85.4	Confident	87.3	Confident	44 Å²	44	37.5 Å²	37.5	27%	0.267	20%	0.202	S	C	.	.	H	α-helix	trans	-103.8	-25	-174.4	-176.9	0	0	0	0	112.3	W314 Y528 E536	W314-V532 HydrophobicContact CE3-CG2 4.31Å; W314-V532 HydrophobicContact CH2-CG2 4.34Å; W314-V532 HydrophobicContact CZ3-CG2 4.15Å; Y528-V532 HydrophobicContact CD2-CB 4.02Å; Y528-V532 HydrophobicContact CD2-CG2 3.76Å; Y528-V532 HydrophobicContact CE2-CB 3.64Å; Y528-V532 HydrophobicContact CE2-CG1 3.81Å; Y528-V532 HydrophobicContact CE2-CG2 3.65Å; Y528-V532 WeakPolarHBondContact O-CB 3.33Å; Y528-V532 PolarHBondContact O-N 2.87Å; V532-E536 HydrophobicContact CG1-CB 4.06Å; V532-E536 HydrophobicContact CG1-CG 3.96Å
533	G	84.5	Confident	87.3	Confident	25 Å²	25	41.2 Å²	41.2	26%	0.258	22%	0.216	S	C	.	.			trans	78.9	140.9	-172.2	0	0	0	0	0	112.8	I529 D535	I529-G533 WeakPolarHBondContact O-CA 3.3Å; I529-G533 PolarHBondContact O-N 2.9Å; I529-G533 VanDerWaalsContact O-N 3.11Å; G533-D535 PolarHBondContact O-N 2.74Å
534	I	87.3	Confident	87.2	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-59	-21.6	-180	-166.9	63.6	0	0	0	113.6	L367 L509 F513 R514 I529 E536 T537 C538	L367-I534 HydrophobicContact CD2-CD1 3.62Å; L509-I534 HydrophobicContact CB-CG1 4.47Å; F513-I534 HydrophobicContact CB-CB 3.89Å; F513-I534 HydrophobicContact CB-CD1 4.31Å; F513-I534 HydrophobicContact CB-CG1 3.91Å; F513-I534 HydrophobicContact CB-CG2 4.05Å; F513-I534 HydrophobicContact CD2-CD1 3.72Å; F513-I534 HydrophobicContact CD2-CG1 3.97Å; F513-I534 HydrophobicContact CE2-CD1 4.41Å; F513-I534 HydrophobicContact CG-CD1 4.2Å; F513-I534 HydrophobicContact CG-CG1 4.28Å; R514-I534 HydrophobicContact CG-CG2 4.32Å; I529-I534 HydrophobicContact CG2-CB 4.3Å; I534-E536 VanDerWaalsContact C-N 3.31Å; I534-E536 PolarHBondContact O-N 3.16Å; I534-T537 WeakPolarHBondContact O-CB 3.47Å; I534-T537 PolarHBondContact O-N 2.74Å; I534-T537 VanDerWaalsContact O-N 3.08Å; I534-C538 PolarHBondContact O-N 3.32Å; I534-C538 PolarHBondContact O-SG 2.83Å; I534-C538 VanDerWaalsContact O-SG 3.36Å
535	D	88.4	Confident	87	Confident	43 Å²	43	42.7 Å²	42.7	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-29.6	-173.8	-80.7	-68.4	0	0	0	114.5	R510 R514 G533 C538 K539	R510-D535 IonicContact CZ-OD1 2.87Å; R510-D535 VanDerWaalsContact CZ-OD1 3.3Å; R510-D535 IonicContact NE-OD1 3.15Å; R510-D535 PolarHBondContact NE-OD1 3.16Å; R510-D535 IonicContact NH2-OD1 2.67Å; R510-D535 PolarHBondContact NH2-OD1 3.08Å; R514-D535 IonicContact CZ-OD1 2.7Å; R514-D535 IonicContact CZ-OD2 3.85Å; R514-D535 VanDerWaalsContact CZ-OD2 3.29Å; R514-D535 IonicContact NE-OD2 2.71Å; R514-D535 PolarHBondContact NE-OD2 2.9Å; R514-D535 VanDerWaalsContact NH2-CG 3.26Å; R514-D535 IonicContact NH2-OD1 2.88Å; R514-D535 PolarHBondContact NH2-OD1 2.7Å; R514-D535 IonicContact NH2-OD2 2.66Å; R514-D535 PolarHBondContact NH2-OD2 3.34Å; G533-D535 PolarHBondContact O-N 2.74Å; D535-C538 PolarHBondContact O-N 2.8Å; D535-K539 WeakPolarHBondContact O-CG 3.43Å; D535-K539 PolarHBondContact O-N 3.42Å
536	E	86.5	Confident	86.8	Confident	58 Å²	58	47.5 Å²	47.5	27%	0.271	23%	0.233	S	C	.	.	H	α-helix	trans	-68	-37.7	172.6	-76.6	-64.4	111.1	0	0	112.1	R318 V532 I534 K539 L540	R318-E536 IonicContact CZ-OE2 2.68Å; R318-E536 IonicContact NH1-OE2 2.72Å; R318-E536 IonicContact NH2-OE2 3.61Å; R318-E536 PolarHBondContact NH2-OE2 3.41Å; V532-E536 HydrophobicContact CG1-CB 4.06Å; V532-E536 HydrophobicContact CG1-CG 3.96Å; I534-E536 VanDerWaalsContact C-N 3.31Å; I534-E536 PolarHBondContact O-N 3.16Å; E536-K539 WeakPolarHBondContact OE1-CD 3.46Å; E536-K539 WeakPolarHBondContact OE1-CE 3.37Å; E536-K539 IonicContact OE1-NZ 3.52Å; E536-K539 PolarHBondContact OE1-NZ 3.28Å; E536-L540 PolarHBondContact O-N 3.29Å
537	T	89.2	Confident	86.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-41.5	171.1	-56.3	0	0	0	0	111.3	L321 L363 L366 Y528 I534 K539 L540 L541	L321-T537 HydrophobicContact CD2-CG2 3.73Å; L363-T537 HydrophobicContact CD1-CG2 4.12Å; L366-T537 HydrophobicContact CD2-CG2 4.44Å; Y528-T537 VanDerWaalsContact CE1-OG1 3.29Å; Y528-T537 WeakPolarHBondContact CE1-OG1 3.27Å; Y528-T537 PolarHBondContact OH-OG1 2.66Å; I534-T537 WeakPolarHBondContact O-CB 3.47Å; I534-T537 PolarHBondContact O-N 2.74Å; I534-T537 VanDerWaalsContact O-N 3.08Å; T537-K539 PolarHBondContact O-N 3.09Å; T537-L540 WeakPolarHBondContact O-CB 3.46Å; T537-L540 PolarHBondContact O-N 3.28Å; T537-L540 VanDerWaalsContact O-N 3.16Å; T537-L541 HydrophobicContact CG2-CD1 3.84Å; T537-L541 HydrophobicContact CG2-CG 4.32Å; T537-L541 WeakPolarHBondContact O-CG 3.41Å; T537-L541 PolarHBondContact O-N 3.49Å
538	C	89.5	Confident	85.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-43.9	176.6	-69.3	0	0	0	0	111.9	A506 R510 I534 D535 L540 L541 D542	A506-C538 HydrophobicContact CB-CB 3.98Å; A506-C538 PolarHBondContact O-SG 3.26Å; A506-C538 VanDerWaalsContact O-SG 3.36Å; R510-C538 VanDerWaalsContact NH2-CB 3.3Å; I534-C538 PolarHBondContact O-N 3.32Å; I534-C538 PolarHBondContact O-SG 2.83Å; I534-C538 VanDerWaalsContact O-SG 3.36Å; D535-C538 PolarHBondContact O-N 2.8Å; C538-L540 VanDerWaalsContact C-N 3.27Å; C538-L540 PolarHBondContact O-N 3.4Å; C538-L541 CarbonylContact O-C 3.51Å; C538-L541 PolarHBondContact O-N 2.94Å; C538-L541 VanDerWaalsContact O-N 3.09Å; C538-D542 WeakPolarHBondContact O-CB 3.13Å; C538-D542 PolarHBondContact O-N 2.68Å; C538-D542 VanDerWaalsContact O-OD2 3.11Å
539	K	89.5	Confident	85.2	Confident	128 Å²	128	44.4 Å²	44.4	56%	0.557	22%	0.223	S	C	*	.	H	α-helix	trans	-56.8	-37.7	175.4	-72.3	169.3	-172.1	174.3	0	113.1	D535 E536 T537	D535-K539 WeakPolarHBondContact O-CG 3.43Å; D535-K539 PolarHBondContact O-N 3.42Å; E536-K539 WeakPolarHBondContact OE1-CD 3.46Å; E536-K539 WeakPolarHBondContact OE1-CE 3.37Å; E536-K539 IonicContact OE1-NZ 3.52Å; E536-K539 PolarHBondContact OE1-NZ 3.28Å; T537-K539 PolarHBondContact O-N 3.09Å
540	L	88.9	Confident	84.7	Confident	24 Å²	24	47.2 Å²	47.2	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-69.2	-44.1	175.2	-66.2	172.7	0	0	0	111.2	Q322 I325 E536 T537 C538 R543	Q322-L540 HydrophobicContact CG-CD2 4.46Å; I325-L540 HydrophobicContact CD1-CB 3.85Å; E536-L540 PolarHBondContact O-N 3.29Å; T537-L540 WeakPolarHBondContact O-CB 3.46Å; T537-L540 PolarHBondContact O-N 3.28Å; T537-L540 VanDerWaalsContact O-N 3.16Å; C538-L540 VanDerWaalsContact C-N 3.27Å; C538-L540 PolarHBondContact O-N 3.4Å; L540-R543 WeakPolarHBondContact O-CB 3.45Å; L540-R543 WeakPolarHBondContact O-CG 3.41Å; L540-R543 PolarHBondContact O-N 3.26Å
541	L	89.6	Confident	84.4	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-73.1	-24.8	179.9	-67.8	174	0	0	0	113.8	I325 L359 L363 L505 A506 L509 T537 C538 R543 L544	I325-L541 HydrophobicContact CD1-CD2 3.73Å; I325-L541 HydrophobicContact CD1-CG 4.31Å; I325-L541 HydrophobicContact CG1-CD2 4.31Å; L359-L541 HydrophobicContact CD1-CD2 4.4Å; L363-L541 HydrophobicContact CD1-CD1 4.02Å; L505-L541 HydrophobicContact CD2-CD1 4.34Å; L505-L541 HydrophobicContact CD2-CD2 4.03Å; L505-L541 HydrophobicContact CG-CD1 4.37Å; A506-L541 HydrophobicContact CB-CB 3.99Å; L509-L541 HydrophobicContact CD1-CD1 3.4Å; T537-L541 HydrophobicContact CG2-CD1 3.84Å; T537-L541 HydrophobicContact CG2-CG 4.32Å; T537-L541 WeakPolarHBondContact O-CG 3.41Å; T537-L541 PolarHBondContact O-N 3.49Å; C538-L541 CarbonylContact O-C 3.51Å; C538-L541 PolarHBondContact O-N 2.94Å; C538-L541 VanDerWaalsContact O-N 3.09Å; L541-R543 PolarHBondContact O-N 3.34Å; L541-R543 VanDerWaalsContact O-N 3.16Å; L541-L544 HydrophobicContact CD2-CD1 3.86Å; L541-L544 VanDerWaalsContact O-CB 3.28Å; L541-L544 WeakPolarHBondContact O-CB 3.49Å; L541-L544 PolarHBondContact O-N 2.84Å
542	D	87.4	Confident	84.1	Confident	57 Å²	57	41.1 Å²	41.1	31%	0.305	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-61.5	-22.3	175.3	-76.9	-39.8	0	0	0	111.1	A506 C538 L544 S545	A506-D542 WeakPolarHBondContact CB-OD1 3.34Å; C538-D542 WeakPolarHBondContact O-CB 3.13Å; C538-D542 PolarHBondContact O-N 2.68Å; C538-D542 VanDerWaalsContact O-OD2 3.11Å; D542-L544 PolarHBondContact O-N 3.4Å; D542-S545 WeakPolarHBondContact O-CB 3.38Å; D542-S545 PolarHBondContact O-N 3.2Å; D542-S545 PolarHBondContact O-OG 3.27Å
543	R	86.4	Confident	83.7	Confident	79 Å²	79	41 Å²	41	30%	0.298	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-60.2	-30.9	169.2	-63.3	173.7	62.8	-166	-3.4	113.2	D326 L540 L541	D326-R543 IonicContact OD1-CZ 3.03Å; D326-R543 IonicContact OD1-NH1 3.29Å; D326-R543 PolarHBondContact OD1-NH1 2.98Å; D326-R543 IonicContact OD1-NH2 2.71Å; D326-R543 PolarHBondContact OD1-NH2 2.71Å; D326-R543 IonicContact OD2-NH1 3.17Å; L540-R543 WeakPolarHBondContact O-CB 3.45Å; L540-R543 WeakPolarHBondContact O-CG 3.41Å; L540-R543 PolarHBondContact O-N 3.26Å; L541-R543 PolarHBondContact O-N 3.34Å; L541-R543 VanDerWaalsContact O-N 3.16Å
544	L	85.7	Confident	83.2	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-76.9	-23.9	-178.9	-52.9	-173.5	0	0	0	112.5	I325 F328 V329 L359 L500 L541 D542 R546 F547 Y549	I325-L544 HydrophobicContact CG2-CD2 4.07Å; F328-L544 HydrophobicContact CD1-CD1 4.21Å; F328-L544 HydrophobicContact CD1-CD2 3.64Å; F328-L544 HydrophobicContact CE1-CD1 4.3Å; F328-L544 HydrophobicContact CE1-CD2 4.06Å; V329-L544 HydrophobicContact CG2-CD2 3.87Å; L359-L544 HydrophobicContact CD1-CD1 4.28Å; L359-L544 HydrophobicContact CD2-CD1 3.78Å; L500-L544 HydrophobicContact CD2-CB 4.22Å; L500-L544 HydrophobicContact CD2-CD1 4.12Å; L541-L544 HydrophobicContact CD2-CD1 3.86Å; L541-L544 VanDerWaalsContact O-CB 3.28Å; L541-L544 WeakPolarHBondContact O-CB 3.49Å; L541-L544 PolarHBondContact O-N 2.84Å; D542-L544 PolarHBondContact O-N 3.4Å; L544-R546 PolarHBondContact O-N 2.87Å; L544-F547 PolarHBondContact O-N 3.08Å; L544-Y549 WeakPolarHBondContact O-CE2 3.49Å; L544-Y549 PolarHBondContact O-OH 3.37Å
545	S	83.2	Confident	82.6	Confident	48 Å²	48	45.3 Å²	45.3	34%	0.336	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-62.6	-8.3	-178.6	71.3	0	0	0	0	114.9	R503 D542	R503-S545 VanDerWaalsContact CD-O 3.29Å; R503-S545 WeakPolarHBondContact CD-O 3.28Å; R503-S545 PolarHBondContact NE-O 2.89Å; D542-S545 WeakPolarHBondContact O-CB 3.38Å; D542-S545 PolarHBondContact O-N 3.2Å; D542-S545 PolarHBondContact O-OG 3.27Å
546	R	80.7	Confident	81.7	Confident	176 Å²	176	43.9 Å²	43.9	66%	0.664	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-79	-24	-176.8	-61.6	-179.2	179	-165.6	-1.1	114.5	L339 R503 L544	L339-R546 WeakPolarHBondContact CD2-O 3.43Å; R503-R546 VanDerWaalsContact NH2-C 3.34Å; R503-R546 PolarHBondContact NH2-O 3.32Å; L544-R546 PolarHBondContact O-N 2.87Å
547	F	80	Confident	80.8	Confident	17 Å²	17	41.7 Å²	41.7	8%	0.075	21%	0.205	C	C	.	.	S	Bend	trans	-100.6	148.5	-178.1	-54.1	-88.2	0	0	0	110.7	V329 C332 Q333 V337 L339 R503 L544 Y549	V329-F547 HydrophobicContact CG1-CZ 4.36Å; V329-F547 HydrophobicContact CG2-CE2 4.36Å; C332-F547 HydrophobicContact CB-CD1 4Å; C332-F547 HydrophobicContact CB-CD2 4.44Å; C332-F547 HydrophobicContact CB-CE1 3.85Å; C332-F547 HydrophobicContact CB-CE2 4.31Å; C332-F547 HydrophobicContact CB-CG 4.29Å; C332-F547 HydrophobicContact CB-CZ 4.01Å; Q333-F547 HydrophobicContact CG-CZ 4.44Å; V337-F547 HydrophobicContact CB-CD1 4.32Å; V337-F547 HydrophobicContact CG1-CB 4.06Å; V337-F547 HydrophobicContact CG1-CD1 4.46Å; L339-F547 HydrophobicContact CD2-CD1 3.68Å; L339-F547 HydrophobicContact CD2-CE1 3.97Å; L339-F547 HydrophobicContact CD2-CG 4.35Å; R503-F547 PolarHBondContact NE-O 3.17Å; R503-F547 PolarHBondContact NH2-O 3.43Å; L544-F547 PolarHBondContact O-N 3.08Å; F547-Y549 HydrophobicContact CB-CE1 4.02Å; F547-Y549 HydrophobicContact CB-CE2 4.04Å; F547-Y549 WeakPolarHBondContact O-CD2 3.43Å; F547-Y549 WeakPolarHBondContact O-CE2 3.16Å
548	Y	73.2	Confident	79.9	Confident	64 Å²	64	47 Å²	47	25%	0.251	23%	0.225	S	C	.	.			trans	-87.1	144.6	167.2	-74.7	-78.9	0	0	0	109.9	V337 P338 L339 S340 L341 R503	V337-Y548 WeakPolarHBondContact CG1-O 3.34Å; P338-Y548 PolarHBondContact O-N 3.48Å; L339-Y548 WeakPolarHBondContact O-CD2 3.42Å; L339-Y548 WeakPolarHBondContact O-CE2 3.46Å; S340-Y548 WeakPolarHBondContact O-CD2 3.43Å; L341-Y548 HydrophobicContact CD1-CE1 4.47Å; L341-Y548 HydrophobicContact CD1-CE2 4.46Å; R503-Y548 VanDerWaalsContact CZ-CE2 3.44Å; R503-Y548 VanDerWaalsContact CZ-CZ 3.44Å; R503-Y548 VanDerWaalsContact NH2-N 3.19Å
549	Y	75.6	Confident	78.9	Confident	9 Å²	9	50 Å²	50	4%	0.035	24%	0.244	C	C	.	.			trans	-135.1	132.6	-176.2	-54.7	-80.5	0	0	0	110.1	F328 V351 L500 N501 L544 F547 L551	F328-Y549 AromaticContact CE1-CE1 3.94Å; F328-Y549 HydrophobicContact CE1-CE1 3.94Å; F328-Y549 AromaticContact CE1-CZ 3.93Å; F328-Y549 WeakPolarHBondContact CE1-OH 3.29Å; F328-Y549 HydrophobicContact CZ-CD1 4.41Å; F328-Y549 AromaticContact CZ-CE1 3.56Å; F328-Y549 HydrophobicContact CZ-CE1 3.56Å; V351-Y549 HydrophobicContact CG1-CD1 4.45Å; L500-Y549 HydrophobicContact CB-CD2 4Å; L500-Y549 HydrophobicContact CB-CE2 4.35Å; L500-Y549 HydrophobicContact CB-CG 4.36Å; L500-Y549 HydrophobicContact CD2-CE2 4.05Å; L500-Y549 WeakPolarHBondContact O-CD2 3.35Å; N501-Y549 WeakPolarHBondContact CA-O 3.44Å; N501-Y549 WeakPolarHBondContact CB-O 3.44Å; N501-Y549 WeakPolarHBondContact OD1-CB 3.44Å; N501-Y549 PolarHBondContact OD1-O 2.89Å; L544-Y549 WeakPolarHBondContact O-CE2 3.49Å; L544-Y549 PolarHBondContact O-OH 3.37Å; F547-Y549 HydrophobicContact CB-CE1 4.02Å; F547-Y549 HydrophobicContact CB-CE2 4.04Å; F547-Y549 WeakPolarHBondContact O-CD2 3.43Å; F547-Y549 WeakPolarHBondContact O-CE2 3.16Å; Y549-L551 HydrophobicContact CD1-CD1 4.46Å; Y549-L551 HydrophobicContact CG-CD1 4.43Å
550	S	77.6	Confident	77.8	Confident	66 Å²	66	46.9 Å²	46.9	46%	0.462	23%	0.231	S	C	.	.			trans	-117.3	70.8	164.7	-167.5	0	0	0	0	109	T347	T347-S550 WeakPolarHBondContact CB-O 3.49Å; T347-S550 VanDerWaalsContact CG2-O 3.24Å; T347-S550 WeakPolarHBondContact CG2-O 3.3Å; T347-S550 PolarHBondContact OG1-O 3.14Å
551	L	79.8	Confident	76.7	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	24%	0.241	C	C	.	.			trans	-86.9	132.8	179	-63.8	160.3	0	0	0	110.1	V351 L352 V355 L500 N501 Y549 V553	V351-L551 HydrophobicContact CG1-CD2 4.43Å; L352-L551 HydrophobicContact CB-CD2 4.21Å; L352-L551 HydrophobicContact CD1-CD2 3.89Å; V355-L551 HydrophobicContact CG1-CD1 4.48Å; V355-L551 HydrophobicContact CG2-CD1 4.03Å; V355-L551 HydrophobicContact CG2-CD2 4.29Å; L500-L551 HydrophobicContact CB-CD1 3.94Å; L500-L551 HydrophobicContact CD1-CD1 3.84Å; N501-L551 PolarHBondContact ND2-N 2.87Å; N501-L551 PolarHBondContact ND2-O 2.68Å; N501-L551 VanDerWaalsContact OD1-CB 3.31Å; N501-L551 WeakPolarHBondContact OD1-CB 3.43Å; N501-L551 PolarHBondContact OD1-N 3Å; Y549-L551 HydrophobicContact CD1-CD1 4.46Å; Y549-L551 HydrophobicContact CG-CD1 4.43Å; L551-V553 PolarHBondContact O-N 2.72Å
552	P	78.3	Confident	75.5	Confident	13 Å²	13	51.2 Å²	51.2	8%	0.084	26%	0.264	C	S	.	.			trans	-65.9	103.6	175.3	26.3	-35.1	0	0	0	111.2	L352 D554 L555	L352-P552 HydrophobicContact CD1-CG 4.1Å; L352-P552 HydrophobicContact CD2-CG 3.71Å; P552-D554 WeakPolarHBondContact CA-OD1 3.47Å; P552-D554 WeakPolarHBondContact CB-OD1 3.44Å; P552-L555 HydrophobicContact CB-CB 4.14Å; P552-L555 HydrophobicContact CB-CD1 4.44Å; P552-L555 HydrophobicContact CG-CB 4.17Å; P552-L555 HydrophobicContact CG-CD1 4.07Å; P552-L555 HydrophobicContact CG-CG 4.49Å; P552-L555 WeakPolarHBondContact O-CB 3.41Å; P552-L555 PolarHBondContact O-N 2.9Å
553	V	75.9	Confident	74.4	Confident	40 Å²	40	52.9 Å²	52.9	24%	0.242	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-63.5	-37.4	173.3	178	0	0	0	0	110.2	I477 A494 A498 L551 L555	I477-V553 HydrophobicContact CD1-CG1 4.49Å; I477-V553 HydrophobicContact CG1-CG1 4.27Å; A494-V553 HydrophobicContact CB-CG1 3.99Å; A494-V553 VanDerWaalsContact CB-O 3.29Å; A494-V553 WeakPolarHBondContact CB-O 3.31Å; A498-V553 HydrophobicContact CB-CG1 4.18Å; A498-V553 HydrophobicContact CB-CG2 3.76Å; L551-V553 PolarHBondContact O-N 2.72Å; V553-L555 VanDerWaalsContact C-N 3.3Å; V553-L555 PolarHBondContact O-N 3.31Å
554	D	75.5	Confident	73.2	Confident	59 Å²	59	54.6 Å²	54.6	32%	0.316	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-79.3	3.3	-178.8	63.5	-34.9	0	0	0	114.2	P552 A556 V557 R558	P552-D554 WeakPolarHBondContact CA-OD1 3.47Å; P552-D554 WeakPolarHBondContact CB-OD1 3.44Å; D554-A556 PolarHBondContact O-N 2.9Å; D554-V557 CarbonylContact O-C 3.5Å; D554-V557 WeakPolarHBondContact O-CA 3.46Å; D554-V557 WeakPolarHBondContact O-CB 3.47Å; D554-V557 PolarHBondContact O-N 3.1Å; D554-R558 HydrophobicContact CB-CG 4.41Å; D554-R558 PolarHBondContact O-N 2.89Å; D554-R558 IonicContact OD1-CZ 3.68Å; D554-R558 IonicContact OD1-NE 2.79Å; D554-R558 PolarHBondContact OD1-NE 2.84Å; D554-R558 IonicContact OD1-NH2 2.71Å; D554-R558 PolarHBondContact OD1-NH2 2.93Å; D554-R558 WeakPolarHBondContact OD2-CG 3.45Å; D554-R558 IonicContact OD2-CZ 3.82Å; D554-R558 IonicContact OD2-NE 2.64Å; D554-R558 PolarHBondContact OD2-NE 2.95Å; D554-R558 IonicContact OD2-NH2 3.26Å; D554-R558 PolarHBondContact OD2-NH2 3.14Å
555	L	73.9	Confident	71.9	Confident	62 Å²	62	60.8 Å²	60.8	33%	0.325	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-56.8	-27.1	-174.7	-168.1	70.7	0	0	0	114.5	L352 P552 V553	L352-L555 HydrophobicContact CD1-CD2 4.31Å; L352-L555 HydrophobicContact CD2-CD2 4.06Å; L352-L555 HydrophobicContact CG-CD2 4.42Å; P552-L555 HydrophobicContact CB-CB 4.14Å; P552-L555 HydrophobicContact CB-CD1 4.44Å; P552-L555 HydrophobicContact CG-CB 4.17Å; P552-L555 HydrophobicContact CG-CD1 4.07Å; P552-L555 HydrophobicContact CG-CG 4.49Å; P552-L555 WeakPolarHBondContact O-CB 3.41Å; P552-L555 PolarHBondContact O-N 2.9Å; V553-L555 VanDerWaalsContact C-N 3.3Å; V553-L555 PolarHBondContact O-N 3.31Å
556	A	69.3	Low	70.7	Confident	13 Å²	13	62.3 Å²	62.3	11%	0.107	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-81.3	-15.6	174	0	0	0	0	0	113.5	R486 A490 D554	R486-A556 PolarHBondContact NE-O 3.45Å; R486-A556 PolarHBondContact NH2-O 2.88Å; A490-A556 HydrophobicContact CB-CB 4.16Å; D554-A556 PolarHBondContact O-N 2.9Å
557	V	68.8	Low	69.2	Low	12 Å²	12	65 Å²	65	7%	0.073	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-33.9	-177.1	167.2	0	0	0	0	111.6	L484 D554 P559 F560 T561	L484-V557 HydrophobicContact CD1-CB 4.26Å; L484-V557 HydrophobicContact CD1-CG1 3.64Å; L484-V557 HydrophobicContact CD1-CG2 4.01Å; D554-V557 CarbonylContact O-C 3.5Å; D554-V557 WeakPolarHBondContact O-CA 3.46Å; D554-V557 WeakPolarHBondContact O-CB 3.47Å; D554-V557 PolarHBondContact O-N 3.1Å; V557-P559 VanDerWaalsContact C-N 3.32Å; V557-P559 VanDerWaalsContact O-N 3.1Å; V557-F560 WeakPolarHBondContact O-CA 3.25Å; V557-F560 PolarHBondContact O-N 2.96Å; V557-T561 HydrophobicContact CG1-CG2 3.73Å; V557-T561 PolarHBondContact O-N 3.31Å; V557-T561 VanDerWaalsContact O-N 3.14Å
558	R	69.3	Low	68.7	Low	112 Å²	112	67.4 Å²	67.4	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-42.7	-44	178.5	-77.5	-172.3	-171.8	-161.1	-3.4	115.5	D554 F560 T561 A562	D554-R558 HydrophobicContact CB-CG 4.41Å; D554-R558 PolarHBondContact O-N 2.89Å; D554-R558 IonicContact OD1-CZ 3.68Å; D554-R558 IonicContact OD1-NE 2.79Å; D554-R558 PolarHBondContact OD1-NE 2.84Å; D554-R558 IonicContact OD1-NH2 2.71Å; D554-R558 PolarHBondContact OD1-NH2 2.93Å; D554-R558 WeakPolarHBondContact OD2-CG 3.45Å; D554-R558 IonicContact OD2-CZ 3.82Å; D554-R558 IonicContact OD2-NE 2.64Å; D554-R558 PolarHBondContact OD2-NE 2.95Å; D554-R558 IonicContact OD2-NH2 3.26Å; D554-R558 PolarHBondContact OD2-NH2 3.14Å; R558-F560 PolarHBondContact O-N 3.26Å; R558-T561 WeakPolarHBondContact CA-OG1 3.26Å; R558-T561 PolarHBondContact O-N 2.97Å; R558-T561 PolarHBondContact O-OG1 3.29Å; R558-A562 VanDerWaalsContact O-CB 3.24Å; R558-A562 WeakPolarHBondContact O-CB 3.34Å; R558-A562 PolarHBondContact O-N 3.41Å
559	P	69.3	Low	68.4	Low	62 Å²	62	67.5 Å²	67.5	40%	0.403	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-24.6	179.3	-22.8	35	0	0	0	113.8	V557 M563	V557-P559 VanDerWaalsContact C-N 3.32Å; V557-P559 VanDerWaalsContact O-N 3.1Å; P559-M563 WeakPolarHBondContact O-CE 3.19Å; P559-M563 WeakPolarHBondContact O-CG 2.89Å
560	F	66.6	Low	68.1	Low	63 Å²	63	70.8 Å²	70.8	28%	0.276	39%	0.391	S	S	.	.	H	α-helix	trans	-92	-34.4	178.2	-66.5	-37.1	0	0	0	112.6	L484 R486 V557 R558 M563 N564	L484-F560 HydrophobicContact CB-CD2 3.94Å; L484-F560 HydrophobicContact CB-CE2 4.23Å; L484-F560 HydrophobicContact CD1-CB 4.15Å; L484-F560 HydrophobicContact CD1-CD2 4.08Å; L484-F560 HydrophobicContact CD2-CB 4.07Å; L484-F560 HydrophobicContact CD2-CD2 3.84Å; L484-F560 HydrophobicContact CD2-CG 4.26Å; L484-F560 HydrophobicContact CG-CD2 4.16Å; R486-F560 VanDerWaalsContact NH1-CE2 3.27Å; V557-F560 WeakPolarHBondContact O-CA 3.25Å; V557-F560 PolarHBondContact O-N 2.96Å; R558-F560 PolarHBondContact O-N 3.26Å; F560-M563 HydrophobicContact CD1-SD 4.06Å; F560-M563 PolarHBondContact O-N 2.96Å; F560-N564 PolarHBondContact O-N 3.08Å; F560-N564 PolarHBondContact O-OD1 3.35Å
561	T	64.5	Low	67.5	Low	57 Å²	57	71.1 Å²	71.1	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-65	-47.7	170.5	55	0	0	0	0	110	V557 R558 M563 N564 D565	V557-T561 HydrophobicContact CG1-CG2 3.73Å; V557-T561 PolarHBondContact O-N 3.31Å; V557-T561 VanDerWaalsContact O-N 3.14Å; R558-T561 WeakPolarHBondContact CA-OG1 3.26Å; R558-T561 PolarHBondContact O-N 2.97Å; R558-T561 PolarHBondContact O-OG1 3.29Å; T561-M563 PolarHBondContact O-N 3.45Å; T561-N564 CarbonylContact O-C 3.49Å; T561-N564 WeakPolarHBondContact O-CA 3.41Å; T561-N564 WeakPolarHBondContact O-CB 3.24Å; T561-N564 PolarHBondContact O-N 3.12Å; T561-D565 VanDerWaalsContact C-OD2 3.25Å; T561-D565 PolarHBondContact O-N 3.48Å
562	A	65.2	Low	66.7	Low	60 Å²	60	75.3 Å²	75.3	50%	0.496	41%	0.409	S	S	.	.	H	α-helix	trans	-65.9	-10.4	176	0	0	0	0	0	114.8	R558 A566	R558-A562 VanDerWaalsContact O-CB 3.24Å; R558-A562 WeakPolarHBondContact O-CB 3.34Å; R558-A562 PolarHBondContact O-N 3.41Å; A562-A566 WeakPolarHBondContact O-CB 3.39Å
563	M	64.3	Low	66	Low	93 Å²	93	79.4 Å²	79.4	46%	0.458	43%	0.431	S	S	.	.	H	α-helix	trans	-83.3	-46.9	164.3	-77.1	170.3	-161.4	0	0	110.7	P559 F560 T561 D565 A566 F567	P559-M563 WeakPolarHBondContact O-CE 3.19Å; P559-M563 WeakPolarHBondContact O-CG 2.89Å; F560-M563 HydrophobicContact CD1-SD 4.06Å; F560-M563 PolarHBondContact O-N 2.96Å; T561-M563 PolarHBondContact O-N 3.45Å; M563-D565 PolarHBondContact O-N 2.96Å; M563-A566 CarbonylContact O-C 3.59Å; M563-A566 WeakPolarHBondContact O-CA 3.45Å; M563-A566 PolarHBondContact O-N 3.2Å; M563-F567 HydrophobicContact CB-CD2 4.48Å; M563-F567 HydrophobicContact CB-CE2 4.31Å; M563-F567 WeakPolarHBondContact O-CD2 3.36Å; M563-F567 PolarHBondContact O-N 2.97Å
564	N	60.3	Low	65.2	Low	114 Å²	114	82.2 Å²	82.2	61%	0.61	44%	0.444	S	S	*	.	H	α-helix	trans	-63.3	-26.7	175.7	-68.5	5	0	0	0	113.3	F560 T561	F560-N564 PolarHBondContact O-N 3.08Å; F560-N564 PolarHBondContact O-OD1 3.35Å; T561-N564 CarbonylContact O-C 3.49Å; T561-N564 WeakPolarHBondContact O-CA 3.41Å; T561-N564 WeakPolarHBondContact O-CB 3.24Å; T561-N564 PolarHBondContact O-N 3.12Å
565	D	59.6	Low	64.5	Low	133 Å²	133	84 Å²	84	71%	0.711	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-3.4	173.9	-54	-38.8	0	0	0	112.3	T561 M563	T561-D565 VanDerWaalsContact C-OD2 3.25Å; T561-D565 PolarHBondContact O-N 3.48Å; M563-D565 PolarHBondContact O-N 2.96Å
566	A	57.8	Low	63.7	Low	80 Å²	80	85.8 Å²	85.8	66%	0.661	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	8	-178.4	0	0	0	0	0	113.5	A562 M563	A562-A566 WeakPolarHBondContact O-CB 3.39Å; M563-A566 CarbonylContact O-C 3.59Å; M563-A566 WeakPolarHBondContact O-CA 3.45Å; M563-A566 PolarHBondContact O-N 3.2Å
567	F	49	Very low	63.2	Low	231 Å²	231	92.5 Å²	92.5	100%	1.013	50%	0.498	S	S	*	.			trans	-121	0	175.2	-76.9	-59.1	0	0	0	110.8	M563	M563-F567 HydrophobicContact CB-CD2 4.48Å; M563-F567 HydrophobicContact CB-CE2 4.31Å; M563-F567 WeakPolarHBondContact O-CD2 3.36Å; M563-F567 PolarHBondContact O-N 2.97Å

Retrieved 567 of 567 residues in 438 ms (Link to these results)

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