A0A077ZHT2_TRITR Loading...

TraF and TraH domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHT2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 615 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	35.6	Very low	42.8	Very low	246 Å²	246	146.8 Å²	146.8	100%	1.212	79%	0.791	S	S	*	*				0	139.1	0	-80.2	165	101.7	0	0	108.7
2	S	39.6	Very low	42.4	Very low	93 Å²	93	147.5 Å²	147.5	65%	0.65	79%	0.793	S	S	*	*			trans	-49.2	128.7	-174.2	179.3	0	0	0	0	114.9
3	L	42.3	Very low	42	Very low	172 Å²	172	149.6 Å²	149.6	90%	0.901	80%	0.798	S	S	*	*			trans	-146	49.8	151.1	-117.8	117.4	0	0	0	109.4	K5	L3-K5 VanDerWaalsContact C-N 3.32Å
4	T	45.1	Very low	41.6	Very low	133 Å²	133	152.4 Å²	152.4	82%	0.816	81%	0.808	S	S	*	*			trans	-94.2	31.8	175.9	20.9	0	0	0	0	112.5
5	K	44.9	Very low	41.4	Very low	174 Å²	174	148.5 Å²	148.5	76%	0.757	81%	0.806	S	S	*	*	S	Bend	trans	-142.2	100.4	177.3	-66.4	-173	180	-176.9	0	109.8	L3	L3-K5 VanDerWaalsContact C-N 3.32Å
6	L	43	Very low	41	Very low	156 Å²	156	147.2 Å²	147.2	82%	0.817	80%	0.804	S	S	*	*	S	Bend	trans	129.1	104.7	163.3	-72.8	150.5	0	0	0	111.2
7	L	43.6	Very low	40.9	Very low	148 Å²	148	142.4 Å²	142.4	78%	0.775	80%	0.797	S	S	*	*	S	Bend	trans	117	73.4	176.1	-87	87.1	0	0	0	110.8	I10	L7-I10 HydrophobicContact CD2-CD1 4.28Å; L7-I10 HydrophobicContact CG-CD1 4.34Å
8	P	39.7	Very low	40.8	Very low	90 Å²	90	141.9 Å²	141.9	58%	0.584	80%	0.797	S	S	*	*				-146.5	79.3	75.3	35.7	-14.4	0	0	0	111.7	I10 L11	P8-I10 HydrophobicContact CB-CB 4.46Å; P8-I10 PolarHBondContact O-N 3.02Å; P8-L11 HydrophobicContact CB-CD1 4.35Å; P8-L11 PolarHBondContact O-N 3.19Å
9	V	46.9	Very low	40.7	Very low	121 Å²	121	144.2 Å²	144.2	73%	0.733	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-57.2	-9.4	142.2	170.1	0	0	0	0	110.7	L11	V9-L11 VanDerWaalsContact C-N 3.35Å
10	I	48.3	Very low	40.6	Very low	135 Å²	135	139.8 Å²	139.8	69%	0.692	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-75.4	-14.7	174.8	-65.8	166.9	0	0	0	113.2	L7 P8 L12	L7-I10 HydrophobicContact CD2-CD1 4.28Å; L7-I10 HydrophobicContact CG-CD1 4.34Å; P8-I10 HydrophobicContact CB-CB 4.46Å; P8-I10 PolarHBondContact O-N 3.02Å; I10-L12 VanDerWaalsContact C-N 3.34Å
11	L	41.7	Very low	40.5	Very low	147 Å²	147	136 Å²	136	77%	0.77	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-84.9	-1.7	174.1	-115.4	98.1	0	0	0	114.5	P8 V9	P8-L11 HydrophobicContact CB-CD1 4.35Å; P8-L11 PolarHBondContact O-N 3.19Å; V9-L11 VanDerWaalsContact C-N 3.35Å
12	L	38.2	Very low	40.9	Very low	155 Å²	155	129.4 Å²	129.4	81%	0.812	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-94.2	12.5	-173.4	-133.4	91.5	0	0	0	115.7	I10	I10-L12 VanDerWaalsContact C-N 3.34Å
13	M	37.4	Very low	41.1	Very low	175 Å²	175	129.6 Å²	129.6	86%	0.862	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-116.5	12.3	179.1	-78.9	-150.6	-148.6	0	0	116.3
14	M	36.4	Very low	41.3	Very low	189 Å²	189	124.3 Å²	124.3	93%	0.931	70%	0.7	S	S	*	*			trans	-116.2	60.3	170.4	-67.7	-158.6	-136.4	0	0	112.2
15	A	37.6	Very low	41.3	Very low	94 Å²	94	124.1 Å²	124.1	78%	0.777	69%	0.69	S	S	*	*			trans	-137.5	47.3	164.9	0	0	0	0	0	110.5	G17	A15-G17 PolarHBondContact O-N 2.93Å
16	T	36.5	Very low	41.3	Very low	127 Å²	127	120.9 Å²	120.9	78%	0.779	68%	0.679	S	S	*	*			trans	-75	86.7	154.2	51.1	0	0	0	0	106.6	V18	T16-V18 PolarHBondContact O-N 3.49Å
17	G	38.2	Very low	41.3	Very low	66 Å²	66	119.1 Å²	119.1	68%	0.68	67%	0.667	S	S	*	*			trans	-58.3	102.9	165.7	0	0	0	0	0	108	A15 Q19	A15-G17 PolarHBondContact O-N 2.93Å; G17-Q19 PolarHBondContact O-N 3.07Å
18	V	39	Very low	41.4	Very low	133 Å²	133	121.7 Å²	121.7	81%	0.806	67%	0.666	S	S	*	*			trans	-61.5	106	164.3	175.6	0	0	0	0	105.3	T16 A20	T16-V18 PolarHBondContact O-N 3.49Å; V18-A20 VanDerWaalsContact C-N 3.27Å; V18-A20 PolarHBondContact O-N 3.2Å
19	Q	40.2	Very low	41.3	Very low	186 Å²	186	124.3 Å²	124.3	87%	0.869	68%	0.675	S	S	*	*			trans	-66.3	92.6	171	-71.9	-179	-51	0	0	107.1	G17 S21	G17-Q19 PolarHBondContact O-N 3.07Å; Q19-S21 PolarHBondContact O-N 3.47Å
20	A	37	Very low	40.9	Very low	55 Å²	55	127.2 Å²	127.2	46%	0.455	67%	0.673	S	S	.	*			trans	-60.1	120	166.4	0	0	0	0	0	107.3	V18 D24	V18-A20 VanDerWaalsContact C-N 3.27Å; V18-A20 PolarHBondContact O-N 3.2Å; A20-D24 WeakPolarHBondContact CA-OD2 3.25Å; A20-D24 HydrophobicContact CB-CB 3.99Å
21	S	39.3	Very low	40.4	Very low	62 Å²	62	125.8 Å²	125.8	43%	0.434	67%	0.666	S	S	.	*			trans	-77.3	165.5	-178.2	82.3	0	0	0	0	109.8	Q19 R23 D24	Q19-S21 PolarHBondContact O-N 3.47Å; S21-R23 PolarHBondContact O-N 3.38Å; S21-R23 WeakPolarHBondContact OG-CB 3.48Å; S21-R23 PolarHBondContact OG-N 3.07Å; S21-D24 PolarHBondContact N-OD2 3.45Å; S21-D24 WeakPolarHBondContact O-CB 3.36Å; S21-D24 PolarHBondContact O-N 3.45Å
22	T	44.1	Very low	40.3	Very low	106 Å²	106	123.7 Å²	123.7	65%	0.65	66%	0.661	S	S	*	*	H	α-helix	trans	-50.5	-21.1	175.6	-30.6	0	0	0	0	113.3	I26	T22-I26 WeakPolarHBondContact O-CG1 3.19Å; T22-I26 PolarHBondContact O-N 3.15Å
23	R	44.7	Very low	40.3	Very low	97 Å²	97	124.9 Å²	124.9	37%	0.366	66%	0.663	S	S	.	*	H	α-helix	trans	-69.7	-42.4	174	-168	179.6	174.7	138.7	11.2	112.9	S21 E25 I26 E27 E117	S21-R23 PolarHBondContact O-N 3.38Å; S21-R23 WeakPolarHBondContact OG-CB 3.48Å; S21-R23 PolarHBondContact OG-N 3.07Å; R23-E25 VanDerWaalsContact C-N 3.26Å; R23-E25 PolarHBondContact O-N 3.21Å; R23-I26 PolarHBondContact O-N 2.8Å; R23-E27 PolarHBondContact O-N 3.36Å; R23-E117 IonicContact CZ-OE2 2.77Å; R23-E117 IonicContact NH1-OE2 3.85Å; R23-E117 PolarHBondContact NH1-OE2 3.32Å; R23-E117 PolarHBondContact NH2-O 3.17Å
24	D	46.1	Very low	40	Very low	61 Å²	61	118.6 Å²	118.6	33%	0.326	64%	0.643	S	S	.	*	H	α-helix	trans	-66.4	-31.2	178.6	-60	-48.4	0	0	0	111.3	A20 S21 R28	A20-D24 WeakPolarHBondContact CA-OD2 3.25Å; A20-D24 HydrophobicContact CB-CB 3.99Å; S21-D24 PolarHBondContact N-OD2 3.45Å; S21-D24 WeakPolarHBondContact O-CB 3.36Å; S21-D24 PolarHBondContact O-N 3.45Å; D24-R28 VanDerWaalsContact O-CG 3.28Å; D24-R28 WeakPolarHBondContact O-CG 3.25Å; D24-R28 PolarHBondContact O-N 3.19Å; D24-R28 VanDerWaalsContact O-N 3.12Å
25	E	44.7	Very low	39.9	Very low	130 Å²	130	119.1 Å²	119.1	61%	0.607	65%	0.645	S	S	*	*	H	α-helix	trans	-67.8	-41.8	172.7	-88.6	-176.5	155.3	0	0	112.4	R23 R28 L29	R23-E25 VanDerWaalsContact C-N 3.26Å; R23-E25 PolarHBondContact O-N 3.21Å; E25-R28 PolarHBondContact O-N 2.83Å; E25-L29 WeakPolarHBondContact O-CG 3.15Å; E25-L29 PolarHBondContact O-N 2.82Å
26	I	44.9	Very low	39.6	Very low	105 Å²	105	118.9 Å²	118.9	54%	0.538	64%	0.643	S	S	.	*	H	α-helix	trans	-67.1	-39.7	177.1	-66.5	166.3	0	0	0	110.6	T22 R23 R28 L29 W30	T22-I26 WeakPolarHBondContact O-CG1 3.19Å; T22-I26 PolarHBondContact O-N 3.15Å; R23-I26 PolarHBondContact O-N 2.8Å; I26-R28 PolarHBondContact O-N 3.47Å; I26-L29 WeakPolarHBondContact O-CB 3.28Å; I26-L29 PolarHBondContact O-N 3.38Å; I26-W30 PolarHBondContact O-N 2.91Å
27	E	43	Very low	39.3	Very low	120 Å²	120	117.6 Å²	117.6	56%	0.561	65%	0.646	S	S	*	*	H	α-helix	trans	-66.3	-36.9	178.8	-159	168.6	-160.5	0	0	111.9	R23 L29 W30	R23-E27 PolarHBondContact O-N 3.36Å; E27-L29 VanDerWaalsContact C-N 3.3Å; E27-L29 PolarHBondContact O-N 2.76Å; E27-W30 WeakPolarHBondContact O-CB 3.35Å; E27-W30 PolarHBondContact O-N 2.81Å; E27-W30 VanDerWaalsContact O-N 3.11Å
28	R	45.2	Very low	39	Very low	202 Å²	202	124 Å²	124	76%	0.762	66%	0.655	S	S	*	*	H	α-helix	trans	-66.8	-27.7	173	-75.1	175.7	-173.7	-177.3	4.2	114	D24 E25 I26	D24-R28 VanDerWaalsContact O-CG 3.28Å; D24-R28 WeakPolarHBondContact O-CG 3.25Å; D24-R28 PolarHBondContact O-N 3.19Å; D24-R28 VanDerWaalsContact O-N 3.12Å; E25-R28 PolarHBondContact O-N 2.83Å; I26-R28 PolarHBondContact O-N 3.47Å
29	L	38	Very low	38.8	Very low	145 Å²	145	123.7 Å²	123.7	76%	0.759	66%	0.656	S	S	*	*	H	α-helix	trans	-74.8	-17.5	174.6	-72.2	166.1	0	0	0	111.9	E25 I26 E27 N31	E25-L29 WeakPolarHBondContact O-CG 3.15Å; E25-L29 PolarHBondContact O-N 2.82Å; I26-L29 WeakPolarHBondContact O-CB 3.28Å; I26-L29 PolarHBondContact O-N 3.38Å; E27-L29 VanDerWaalsContact C-N 3.3Å; E27-L29 PolarHBondContact O-N 2.76Å; L29-N31 PolarHBondContact O-N 3.45Å
30	W	37.5	Very low	38.5	Very low	182 Å²	182	119.5 Å²	119.5	69%	0.689	65%	0.653	S	S	*	*			trans	-90.9	94.3	-178.7	-157.4	85.5	0	0	0	110.8	I26 E27 P32	I26-W30 PolarHBondContact O-N 2.91Å; E27-W30 WeakPolarHBondContact O-CB 3.35Å; E27-W30 PolarHBondContact O-N 2.81Å; E27-W30 VanDerWaalsContact O-N 3.11Å; W30-P32 HydrophobicContact CH2-CB 4.28Å; W30-P32 HydrophobicContact CZ3-CB 4.06Å; W30-P32 HydrophobicContact CZ3-CG 4.41Å
31	N	39.6	Very low	38.2	Very low	105 Å²	105	125.6 Å²	125.6	56%	0.561	67%	0.672	S	S	*	*			trans	-100.9	121.7	166.9	-174.6	-7.9	0	0	0	109	L29 Q33 G34	L29-N31 PolarHBondContact O-N 3.45Å; N31-Q33 PolarHBondContact O-N 3.39Å; N31-Q33 PolarHBondContact OD1-N 3.47Å; N31-G34 PolarHBondContact O-N 3.06Å; N31-G34 VanDerWaalsContact O-N 3.11Å
32	P	39.1	Very low	37.9	Very low	102 Å²	102	128.7 Å²	128.7	66%	0.662	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-8.8	-177.6	21.8	-33	0	0	0	115.1	W30	W30-P32 HydrophobicContact CH2-CB 4.28Å; W30-P32 HydrophobicContact CZ3-CB 4.06Å; W30-P32 HydrophobicContact CZ3-CG 4.41Å
33	Q	37.5	Very low	37.5	Very low	180 Å²	180	128.5 Å²	128.5	84%	0.841	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	14.4	175.7	-66	-167	-6.1	0	0	115.3	N31	N31-Q33 PolarHBondContact O-N 3.39Å; N31-Q33 PolarHBondContact OD1-N 3.47Å
34	G	32.7	Very low	37.1	Very low	43 Å²	43	128.8 Å²	128.8	44%	0.443	72%	0.723	S	S	.	*			trans	79.4	157.3	173.1	0	0	0	0	0	113.5	N31 A36	N31-G34 PolarHBondContact O-N 3.06Å; N31-G34 VanDerWaalsContact O-N 3.11Å; G34-A36 VanDerWaalsContact C-N 3.31Å; G34-A36 PolarHBondContact O-N 2.92Å
35	M	33.4	Very low	36.6	Very low	200 Å²	200	129.3 Å²	129.3	99%	0.985	74%	0.743	S	S	*	*	S	Bend	trans	-71.2	78.3	-172.1	-65	-174.1	-76	0	0	112
36	A	30.6	Very low	36.2	Very low	89 Å²	89	129.6 Å²	129.6	74%	0.736	75%	0.753	S	S	*	*			trans	-129.6	105.7	168.8	0	0	0	0	0	111	G34	G34-A36 VanDerWaalsContact C-N 3.31Å; G34-A36 PolarHBondContact O-N 2.92Å
37	A	30.9	Very low	35.9	Very low	100 Å²	100	130.1 Å²	130.1	83%	0.826	76%	0.764	S	S	*	*			trans	60.9	95.7	154.5	0	0	0	0	0	120
38	K	32.4	Very low	35.5	Very low	200 Å²	200	129 Å²	129	87%	0.87	78%	0.775	S	S	*	*				-153.9	130.4	118.3	-114.9	174.9	-176.9	176.6	0	110	A40	K38-A40 PolarHBondContact O-N 3.25Å
39	P	33.5	Very low	35.1	Very low	127 Å²	127	129.8 Å²	129.8	83%	0.825	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.6	117.6	177.4	2.9	9.3	0	0	0	109.2	Q41	P39-Q41 PolarHBondContact O-N 3.47Å
40	A	34.5	Very low	35.4	Very low	99 Å²	99	129.3 Å²	129.3	82%	0.818	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.6	121.6	171.7	0	0	0	0	0	109.2	K38	K38-A40 PolarHBondContact O-N 3.25Å
41	Q	31.4	Very low	35.8	Very low	182 Å²	182	128.3 Å²	128.3	85%	0.85	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.7	168.9	-86.3	166.5	-41.1	0	0	109.6	P39 A43	P39-Q41 PolarHBondContact O-N 3.47Å; Q41-A43 PolarHBondContact O-N 3.49Å; Q41-A43 VanDerWaalsContact O-N 3.11Å
42	P	32.1	Very low	36.5	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	80%	0.795	S	S	*	*			trans	-69.7	112	-175.6	-8	22.5	0	0	0	110	A44	P42-A44 PolarHBondContact O-N 2.75Å
43	A	36.7	Very low	37.8	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	79%	0.794	S	S	*	*			trans	-68.1	115.1	164.6	0	0	0	0	0	108.1	Q41 G45	Q41-A43 PolarHBondContact O-N 3.49Å; Q41-A43 VanDerWaalsContact O-N 3.11Å; A43-G45 PolarHBondContact O-N 3.37Å
44	A	36.1	Very low	39.6	Very low	104 Å²	104	126.5 Å²	126.5	86%	0.86	78%	0.781	S	S	*	*			trans	-64.6	126.1	177.9	0	0	0	0	0	111.1	P42	P42-A44 PolarHBondContact O-N 2.75Å
45	G	34.8	Very low	42.1	Very low	72 Å²	72	128 Å²	128	74%	0.742	78%	0.783	S	S	*	*			trans	78.9	67.8	146.1	0	0	0	0	0	117.9	A43	A43-G45 PolarHBondContact O-N 3.37Å
46	V	36.3	Very low	44.7	Very low	136 Å²	136	125.3 Å²	125.3	82%	0.824	76%	0.762	S	S	*	*			trans	-126.7	121.3	143.2	-176.3	0	0	0	0	107.4	A48	V46-A48 PolarHBondContact O-N 3.46Å
47	P	38.2	Very low	47.5	Very low	116 Å²	116	128.7 Å²	128.7	75%	0.753	76%	0.756	S	S	*	*			trans	-66.8	118.6	178.4	7.8	-1.1	0	0	0	109.4	R49	P47-R49 VanDerWaalsContact C-N 3.31Å; P47-R49 PolarHBondContact O-N 3.01Å
48	A	35.9	Very low	50.2	Low	97 Å²	97	125.2 Å²	125.2	80%	0.802	72%	0.722	S	S	*	*			trans	-63.5	89.4	171.6	0	0	0	0	0	109.8	V46 T50	V46-A48 PolarHBondContact O-N 3.46Å; A48-T50 PolarHBondContact O-N 2.98Å
49	R	35.6	Very low	52.8	Low	218 Å²	218	124.6 Å²	124.6	82%	0.823	71%	0.714	S	S	*	*			trans	-91.4	89.8	163.1	-117.1	-178.4	-178.2	-174.4	0.5	107.6	P47 E51	P47-R49 VanDerWaalsContact C-N 3.31Å; P47-R49 PolarHBondContact O-N 3.01Å; R49-E51 PolarHBondContact O-N 2.78Å
50	T	44	Very low	55.1	Low	135 Å²	135	118.6 Å²	118.6	83%	0.828	68%	0.675	S	S	*	*			trans	-68	82.3	159.1	44.5	0	0	0	0	108.2	A48 K52	A48-T50 PolarHBondContact O-N 2.98Å; T50-K52 PolarHBondContact O-N 2.74Å
51	E	47.5	Very low	57	Low	160 Å²	160	116 Å²	116	75%	0.748	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-66.4	117.9	165.7	-110	169.6	-170	0	0	108	R49	R49-E51 PolarHBondContact O-N 2.78Å
52	K	54.2	Low	59	Low	181 Å²	181	111.3 Å²	111.3	79%	0.787	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-57.8	135.5	170.3	-82.1	-173.1	175	-173.1	0	108.2	T50 A54	T50-K52 PolarHBondContact O-N 2.74Å; K52-A54 PolarHBondContact O-N 2.98Å
53	P	65.4	Low	60.9	Low	99 Å²	99	106.9 Å²	106.9	64%	0.643	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-53.6	140.2	176.7	-21.1	29.5	0	0	0	110.6	A69	P53-A69 HydrophobicContact CB-CB 4.24Å
54	A	76.1	Confident	63.1	Low	69 Å²	69	105.1 Å²	105.1	57%	0.57	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-55.2	138	175.7	0	0	0	0	0	110.2	K52 R56	K52-A54 PolarHBondContact O-N 2.98Å; A54-R56 PolarHBondContact O-N 3.45Å
55	P	84	Confident	65.4	Low	75 Å²	75	105.8 Å²	105.8	49%	0.487	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-63	136.2	-175.4	24.6	-33.1	0	0	0	111.5	W57 N67	P55-W57 HydrophobicContact CB-CZ2 4.24Å; P55-N67 VanDerWaalsContact CA-OD1 3.29Å; P55-N67 WeakPolarHBondContact CA-OD1 3.5Å
56	R	88.6	Confident	68	Low	144 Å²	144	103.1 Å²	103.1	54%	0.543	54%	0.536	S	S	.	.			trans	-112.7	82.9	177.4	-64.8	-64.8	-176.3	175.7	-0.2	108.9	A54 F58 N67 L68	A54-R56 PolarHBondContact O-N 3.45Å; R56-F58 PolarHBondContact O-N 3.28Å; R56-N67 PolarHBondContact N-OD1 3.37Å; R56-L68 HydrophobicContact CB-CB 4.1Å; R56-L68 PolarHBondContact O-N 3.04Å
57	W	88.9	Confident	70.6	Confident	160 Å²	160	97.6 Å²	97.6	61%	0.606	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	120.6	-176.8	-64.1	112	0	0	0	111.6	P55 Q65 N67	P55-W57 HydrophobicContact CB-CZ2 4.24Å; W57-Q65 HydrophobicContact CE3-CB 4.15Å; W57-N67 HydrophobicContact CE3-CB 3.94Å; W57-N67 HydrophobicContact CH2-CB 4.06Å; W57-N67 HydrophobicContact CZ3-CB 3.7Å
58	F	88.4	Confident	73.2	Confident	27 Å²	27	92.2 Å²	92.2	12%	0.118	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131	171.6	-177.3	-102.6	0	0	0	109.2	R56 L60 Q65 V66 L68 Y98 M164	R56-F58 PolarHBondContact O-N 3.28Å; F58-L60 HydrophobicContact CD1-CD2 3.88Å; F58-L60 HydrophobicContact CE1-CD2 3.93Å; F58-Q65 WeakPolarHBondContact O-CA 3.3Å; F58-V66 HydrophobicContact CB-CG2 4.18Å; F58-V66 HydrophobicContact CD1-CG2 4.22Å; F58-V66 PolarHBondContact N-O 3.01Å; F58-V66 PolarHBondContact O-N 3.27Å; F58-L68 HydrophobicContact CB-CD1 3.59Å; F58-L68 HydrophobicContact CB-CD2 4.04Å; F58-L68 HydrophobicContact CB-CG 3.57Å; F58-L68 HydrophobicContact CD2-CD1 4.22Å; F58-L68 HydrophobicContact CG-CD1 4Å; F58-L68 HydrophobicContact CG-CD2 4.48Å; F58-L68 HydrophobicContact CG-CG 4.34Å; F58-Y98 AromaticContact CD2-CD1 3.78Å; F58-Y98 HydrophobicContact CD2-CD1 3.78Å; F58-Y98 AromaticContact CD2-CE1 3.98Å; F58-Y98 HydrophobicContact CD2-CE1 3.98Å; F58-Y98 AromaticContact CE2-CD1 3.83Å; F58-Y98 HydrophobicContact CE2-CD1 3.83Å; F58-Y98 AromaticContact CE2-CE1 3.59Å; F58-Y98 HydrophobicContact CE2-CE1 3.59Å; F58-M164 HydrophobicContact CD2-CE 4.32Å; F58-M164 HydrophobicContact CE1-CE 4.3Å; F58-M164 HydrophobicContact CE2-CE 3.56Å; F58-M164 HydrophobicContact CZ-CE 3.56Å
59	R	86.2	Confident	75.7	Confident	186 Å²	186	88.6 Å²	88.6	70%	0.702	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	110.5	176.5	-173.4	174.4	-177.4	165.2	-0.4	108.4
60	L	83	Confident	78.4	Confident	2 Å²	2	80.7 Å²	80.7	1%	0.01	41%	0.411	C	S	.	.			trans	-65.1	157	171	-60.5	174.3	0	0	0	109.9	F58 N62 G63 R64 V66 D168 L171 Q172	F58-L60 HydrophobicContact CD1-CD2 3.88Å; F58-L60 HydrophobicContact CE1-CD2 3.93Å; L60-N62 WeakPolarHBondContact CB-OD1 3.29Å; L60-N62 PolarHBondContact O-N 2.89Å; L60-G63 WeakPolarHBondContact O-CA 3.47Å; L60-G63 PolarHBondContact O-N 3.24Å; L60-R64 VanDerWaalsContact CB-O 3.26Å; L60-R64 WeakPolarHBondContact CB-O 3.27Å; L60-R64 HydrophobicContact CD1-CB 4.32Å; L60-R64 VanDerWaalsContact CD1-NH2 3.28Å; L60-R64 WeakPolarHBondContact CG-O 3.43Å; L60-R64 PolarHBondContact N-O 2.8Å; L60-V66 HydrophobicContact CD1-CB 4.47Å; L60-V66 HydrophobicContact CD1-CG1 3.51Å; L60-V66 HydrophobicContact CD1-CG2 4.12Å; L60-V66 HydrophobicContact CD2-CG2 3.87Å; L60-V66 HydrophobicContact CG-CG1 4.13Å; L60-V66 HydrophobicContact CG-CG2 3.84Å; L60-D168 WeakPolarHBondContact CA-OD1 3.36Å; L60-D168 VanDerWaalsContact CB-OD1 3.26Å; L60-D168 WeakPolarHBondContact CB-OD1 3.38Å; L60-D168 HydrophobicContact CD2-CB 4.43Å; L60-D168 VanDerWaalsContact CD2-OD1 3.24Å; L60-D168 WeakPolarHBondContact CD2-OD1 3.22Å; L60-L171 HydrophobicContact CD1-CB 4.06Å; L60-L171 HydrophobicContact CD2-CB 3.66Å; L60-L171 HydrophobicContact CD2-CD1 4.09Å; L60-Q172 HydrophobicContact CB-CG 3.96Å; L60-Q172 HydrophobicContact CD1-CG 3.75Å; L60-Q172 HydrophobicContact CD2-CG 4.43Å; L60-Q172 HydrophobicContact CG-CG 4.27Å
61	S	74.3	Confident	80.6	Confident	43 Å²	43	74.8 Å²	74.8	30%	0.301	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.7	-178.2	59	0	0	0	0	115	G63 D168 Q172 A197	S61-G63 PolarHBondContact O-N 2.93Å; S61-G63 VanDerWaalsContact O-N 3.12Å; S61-D168 WeakPolarHBondContact CB-OD2 3.48Å; S61-D168 PolarHBondContact N-OD1 2.88Å; S61-D168 PolarHBondContact OG-OD2 3.41Å; S61-Q172 PolarHBondContact OG-NE2 3.19Å; S61-A197 WeakPolarHBondContact OG-CB 3.45Å
62	N	72	Confident	82.8	Confident	84 Å²	84	70.7 Å²	70.7	45%	0.449	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	6.6	171.2	71	1.5	0	0	0	113.8	L60 R64 Q172	L60-N62 WeakPolarHBondContact CB-OD1 3.29Å; L60-N62 PolarHBondContact O-N 2.89Å; N62-R64 VanDerWaalsContact C-N 3.28Å; N62-R64 PolarHBondContact O-N 3.29Å; N62-R64 WeakPolarHBondContact OD1-CB 3.41Å; N62-R64 PolarHBondContact OD1-N 3.02Å; N62-Q172 VanDerWaalsContact N-NE2 3.18Å; N62-Q172 WeakPolarHBondContact ND2-CG 3.24Å
63	G	73.6	Confident	84.8	Confident	35 Å²	35	62 Å²	62	36%	0.361	32%	0.315	S	S	.	.	S	Bend	trans	84.2	-8.9	179.6	0	0	0	0	0	114.7	L60 S61	L60-G63 WeakPolarHBondContact O-CA 3.47Å; L60-G63 PolarHBondContact O-N 3.24Å; S61-G63 PolarHBondContact O-N 2.93Å; S61-G63 VanDerWaalsContact O-N 3.12Å
64	R	81.6	Confident	86.1	Confident	64 Å²	64	57.8 Å²	57.8	24%	0.242	29%	0.287	C	S	.	.			trans	-71.4	136.7	178.2	-165	178.3	76.3	-148	-0.6	110	L60 N62 L171 Q172 G175	L60-R64 VanDerWaalsContact CB-O 3.26Å; L60-R64 WeakPolarHBondContact CB-O 3.27Å; L60-R64 HydrophobicContact CD1-CB 4.32Å; L60-R64 VanDerWaalsContact CD1-NH2 3.28Å; L60-R64 WeakPolarHBondContact CG-O 3.43Å; L60-R64 PolarHBondContact N-O 2.8Å; N62-R64 VanDerWaalsContact C-N 3.28Å; N62-R64 PolarHBondContact O-N 3.29Å; N62-R64 WeakPolarHBondContact OD1-CB 3.41Å; N62-R64 PolarHBondContact OD1-N 3.02Å; R64-L171 VanDerWaalsContact NH2-C 3.34Å; R64-L171 PolarHBondContact NH2-O 3.01Å; R64-Q172 PolarHBondContact NH1-O 2.9Å; R64-G175 PolarHBondContact NH1-O 3.42Å
65	Q	85.8	Confident	86.9	Confident	118 Å²	118	54.5 Å²	54.5	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	139.6	172.3	-65.2	-172.1	40.8	0	0	110.5	W57 F58	W57-Q65 HydrophobicContact CE3-CB 4.15Å; F58-Q65 WeakPolarHBondContact O-CA 3.3Å
66	V	88.7	Confident	87.3	Confident	16 Å²	16	50.9 Å²	50.9	10%	0.097	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.5	173.8	-68.7	0	0	0	0	109	F58 L60 L68 L171	F58-V66 HydrophobicContact CB-CG2 4.18Å; F58-V66 HydrophobicContact CD1-CG2 4.22Å; F58-V66 PolarHBondContact N-O 3.01Å; F58-V66 PolarHBondContact O-N 3.27Å; L60-V66 HydrophobicContact CD1-CB 4.47Å; L60-V66 HydrophobicContact CD1-CG1 3.51Å; L60-V66 HydrophobicContact CD1-CG2 4.12Å; L60-V66 HydrophobicContact CD2-CG2 3.87Å; L60-V66 HydrophobicContact CG-CG1 4.13Å; L60-V66 HydrophobicContact CG-CG2 3.84Å; V66-L68 HydrophobicContact CG2-CD2 4.35Å; V66-L68 PolarHBondContact O-N 3.49Å; V66-L171 HydrophobicContact CG2-CD1 3.94Å
67	N	91.1	Very high	87.4	Confident	21 Å²	21	44 Å²	44	11%	0.112	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.4	175.3	173.9	24.6	0	0	0	109	P55 R56 W57 A69 D70 W71	P55-N67 VanDerWaalsContact CA-OD1 3.29Å; P55-N67 WeakPolarHBondContact CA-OD1 3.5Å; R56-N67 PolarHBondContact N-OD1 3.37Å; W57-N67 HydrophobicContact CE3-CB 3.94Å; W57-N67 HydrophobicContact CH2-CB 4.06Å; W57-N67 HydrophobicContact CZ3-CB 3.7Å; N67-A69 PolarHBondContact O-N 3.43Å; N67-A69 VanDerWaalsContact OD1-CB 3.29Å; N67-A69 WeakPolarHBondContact OD1-CB 3.49Å; N67-A69 PolarHBondContact OD1-N 3.2Å; N67-A69 VanDerWaalsContact OD1-N 3.14Å; N67-D70 WeakPolarHBondContact CB-OD2 3.48Å; N67-D70 PolarHBondContact ND2-OD2 2.88Å; N67-D70 WeakPolarHBondContact O-CB 3.47Å; N67-D70 PolarHBondContact O-N 3.27Å; N67-W71 VanDerWaalsContact O-CD1 3.26Å
68	L	92	Very high	87.5	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.016	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66.2	-15.4	179.5	-66	-177.2	0	0	0	113.5	R56 F58 V66 D70 W71 F100 L171	R56-L68 HydrophobicContact CB-CB 4.1Å; R56-L68 PolarHBondContact O-N 3.04Å; F58-L68 HydrophobicContact CB-CD1 3.59Å; F58-L68 HydrophobicContact CB-CD2 4.04Å; F58-L68 HydrophobicContact CB-CG 3.57Å; F58-L68 HydrophobicContact CD2-CD1 4.22Å; F58-L68 HydrophobicContact CG-CD1 4Å; F58-L68 HydrophobicContact CG-CD2 4.48Å; F58-L68 HydrophobicContact CG-CG 4.34Å; V66-L68 HydrophobicContact CG2-CD2 4.35Å; V66-L68 PolarHBondContact O-N 3.49Å; L68-D70 PolarHBondContact O-N 3.48Å; L68-W71 PolarHBondContact O-N 3.31Å; L68-W71 VanDerWaalsContact O-N 3.14Å; L68-W71 VanDerWaalsContact O-O 3.13Å; L68-F100 HydrophobicContact CB-CB 4.23Å; L68-F100 HydrophobicContact CD1-CD1 4.3Å; L68-L171 HydrophobicContact CD2-CD1 3.9Å
69	A	89.8	Confident	87.5	Confident	21 Å²	21	38.8 Å²	38.8	17%	0.174	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-68.4	-19	171.7	0	0	0	0	0	112.8	P53 N67 W71	P53-A69 HydrophobicContact CB-CB 4.24Å; N67-A69 PolarHBondContact O-N 3.43Å; N67-A69 VanDerWaalsContact OD1-CB 3.29Å; N67-A69 WeakPolarHBondContact OD1-CB 3.49Å; N67-A69 PolarHBondContact OD1-N 3.2Å; N67-A69 VanDerWaalsContact OD1-N 3.14Å; A69-W71 PolarHBondContact O-N 2.97Å
70	D	90.5	Very high	87.7	Confident	52 Å²	52	36.5 Å²	36.5	28%	0.278	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-80.2	1.8	173.5	-65.3	-45.5	0	0	0	112.7	N67 L68 N144 V145 N146	N67-D70 WeakPolarHBondContact CB-OD2 3.48Å; N67-D70 PolarHBondContact ND2-OD2 2.88Å; N67-D70 WeakPolarHBondContact O-CB 3.47Å; N67-D70 PolarHBondContact O-N 3.27Å; L68-D70 PolarHBondContact O-N 3.48Å; D70-N144 WeakPolarHBondContact O-CA 2.92Å; D70-V145 WeakPolarHBondContact O-CG2 3.39Å; D70-V145 PolarHBondContact O-N 3.43Å; D70-N146 PolarHBondContact OD1-ND2 3.08Å
71	W	91.3	Very high	88	Confident	11 Å²	11	36.9 Å²	36.9	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	145	-171.7	-60.6	95.6	0	0	0	112.5	N67 L68 A69 L142 V143 N144 L151 L171 Y174	N67-W71 VanDerWaalsContact O-CD1 3.26Å; L68-W71 PolarHBondContact O-N 3.31Å; L68-W71 VanDerWaalsContact O-N 3.14Å; L68-W71 VanDerWaalsContact O-O 3.13Å; A69-W71 PolarHBondContact O-N 2.97Å; W71-L142 HydrophobicContact CB-CD1 3.84Å; W71-L142 HydrophobicContact CB-CG 4.47Å; W71-L142 HydrophobicContact CD2-CD1 4.45Å; W71-L142 HydrophobicContact CD2-CD2 4.13Å; W71-L142 HydrophobicContact CD2-CG 4.14Å; W71-L142 HydrophobicContact CE3-CD1 4.14Å; W71-L142 HydrophobicContact CE3-CD2 3.76Å; W71-L142 HydrophobicContact CE3-CG 3.49Å; W71-L142 VanDerWaalsContact CE3-CG 3.49Å; W71-L142 HydrophobicContact CG-CD1 4.38Å; W71-L142 HydrophobicContact CZ3-CD2 4Å; W71-L142 HydrophobicContact CZ3-CG 3.97Å; W71-V143 CarbonylContact C-O 3.58Å; W71-V143 WeakPolarHBondContact CA-O 3.49Å; W71-N144 HydrophobicContact CD2-CB 4.5Å; W71-N144 HydrophobicContact CE3-CB 3.81Å; W71-N144 HydrophobicContact CH2-CB 3.98Å; W71-N144 WeakPolarHBondContact CZ2-ND2 3.43Å; W71-N144 HydrophobicContact CZ3-CB 3.56Å; W71-L151 HydrophobicContact CH2-CD1 4.22Å; W71-L151 HydrophobicContact CZ3-CD1 4.1Å; W71-L171 HydrophobicContact CD2-CD2 3.75Å; W71-L171 HydrophobicContact CE3-CD2 4.36Å; W71-L171 HydrophobicContact CG-CD2 4.17Å; W71-L171 HydrophobicContact CH2-CD2 4.07Å; W71-L171 HydrophobicContact CZ2-CD2 3.47Å; W71-L171 VanDerWaalsContact CZ2-CD2 3.47Å; W71-L171 HydrophobicContact CZ3-CD2 4.48Å; W71-Y174 AromaticContact CH2-CD1 3.39Å; W71-Y174 HydrophobicContact CH2-CD1 3.39Å; W71-Y174 AromaticContact CH2-CD2 3.82Å; W71-Y174 HydrophobicContact CH2-CD2 3.82Å; W71-Y174 AromaticContact CH2-CE1 3.51Å; W71-Y174 HydrophobicContact CH2-CE1 3.51Å; W71-Y174 AromaticContact CH2-CE2 3.92Å; W71-Y174 HydrophobicContact CH2-CE2 3.92Å; W71-Y174 AromaticContact CH2-CG 3.53Å; W71-Y174 HydrophobicContact CH2-CG 3.53Å; W71-Y174 AromaticContact CH2-CZ 3.77Å; W71-Y174 AromaticContact CZ2-CD1 3.43Å; W71-Y174 HydrophobicContact CZ2-CD1 3.43Å; W71-Y174 VanDerWaalsContact CZ2-CD1 3.43Å; W71-Y174 AromaticContact CZ2-CE1 3.59Å; W71-Y174 HydrophobicContact CZ2-CE1 3.59Å; W71-Y174 HydrophobicContact CZ2-CG 4.01Å
72	K	93.8	Very high	88.7	Confident	73 Å²	73	39.6 Å²	39.6	32%	0.317	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.8	177.3	179.5	169.5	-79.8	-175.4	0	109.2	S101 F103 V143 V145	K72-S101 CarbonylContact C-O 3.59Å; K72-S101 WeakPolarHBondContact CA-O 3.4Å; K72-S101 WeakPolarHBondContact CB-OG 3.4Å; K72-S101 WeakPolarHBondContact CE-OG 3.42Å; K72-S101 WeakPolarHBondContact CG-OG 3.49Å; K72-F103 HydrophobicContact CD-CB 3.89Å; K72-F103 HydrophobicContact CD-CD2 4.49Å; K72-F103 HydrophobicContact CG-CB 4.07Å; K72-V143 PolarHBondContact N-O 3.19Å; K72-V143 PolarHBondContact O-N 2.89Å; K72-V145 HydrophobicContact CB-CG1 4.02Å
73	V	95	Very high	89.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	111.8	173.5	179.3	0	0	0	0	108.1	L91 F100 S101 V102 F103 T140 F141 L142 L153 F163 M167	V73-L91 HydrophobicContact CG1-CD1 4.18Å; V73-L91 HydrophobicContact CG1-CD2 4.25Å; V73-F100 HydrophobicContact CB-CD2 4.34Å; V73-F100 HydrophobicContact CB-CE2 4.38Å; V73-F100 HydrophobicContact CG2-CD2 3.58Å; V73-F100 HydrophobicContact CG2-CE2 3.71Å; V73-F100 HydrophobicContact CG2-CG 4.48Å; V73-S101 PolarHBondContact N-O 3.46Å; V73-V102 HydrophobicContact CB-CG2 4.32Å; V73-V102 CarbonylContact O-C 3.6Å; V73-V102 VanDerWaalsContact O-CA 3.25Å; V73-V102 WeakPolarHBondContact O-CA 3.31Å; V73-F103 PolarHBondContact O-N 3.48Å; V73-T140 HydrophobicContact CG1-CG2 4.02Å; V73-F141 CarbonylContact C-O 3.56Å; V73-F141 VanDerWaalsContact CA-O 3.3Å; V73-F141 WeakPolarHBondContact CA-O 3.36Å; V73-L142 HydrophobicContact CG2-CD1 4.12Å; V73-L153 HydrophobicContact CG1-CD1 4.26Å; V73-L153 HydrophobicContact CG2-CD1 4.2Å; V73-F163 HydrophobicContact CG1-CZ 4.07Å; V73-F163 HydrophobicContact CG2-CZ 4.1Å; V73-M167 HydrophobicContact CG2-CE 3.57Å
74	V	92.8	Very high	90.2	Very high	9 Å²	9	39.8 Å²	39.8	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122	170.5	178.5	0	0	0	0	107.8	F76 F103 Y105 F129 T140 F141 V143	V74-F76 HydrophobicContact CG1-CD2 4.25Å; V74-F76 HydrophobicContact CG1-CE2 3.61Å; V74-F76 HydrophobicContact CG1-CZ 3.92Å; V74-F103 WeakPolarHBondContact CA-O 3.43Å; V74-F103 HydrophobicContact CG2-CB 4.49Å; V74-Y105 HydrophobicContact CG1-CD2 3.62Å; V74-Y105 HydrophobicContact CG1-CE2 4Å; V74-F129 HydrophobicContact CB-CE1 4.26Å; V74-F129 HydrophobicContact CB-CZ 4.49Å; V74-F129 HydrophobicContact CG1-CE1 4.29Å; V74-F129 HydrophobicContact CG1-CZ 4.34Å; V74-F129 HydrophobicContact CG2-CE1 4.37Å; V74-F129 HydrophobicContact CG2-CZ 4.21Å; V74-T140 CarbonylContact O-C 3.54Å; V74-T140 VanDerWaalsContact O-CA 3.25Å; V74-T140 WeakPolarHBondContact O-CA 3.43Å; V74-F141 HydrophobicContact CB-CB 4.45Å; V74-F141 PolarHBondContact N-O 3.31Å; V74-F141 PolarHBondContact O-N 3.28Å; V74-V143 HydrophobicContact CB-CG2 4.39Å; V74-V143 HydrophobicContact CG2-CB 4.35Å; V74-V143 HydrophobicContact CG2-CG2 3.54Å
75	L	94.6	Very high	90.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.5	179.6	169.3	69.6	0	0	0	109.1	M77 F87 L91 V102 F103 P104 Y105 F115 P138 T139 T140	L75-M77 HydrophobicContact CD2-CB 4.39Å; L75-M77 HydrophobicContact CD2-CG 4.4Å; L75-M77 HydrophobicContact CD2-SD 3.91Å; L75-M77 HydrophobicContact CG-CB 4.29Å; L75-M77 HydrophobicContact CG-CG 4.5Å; L75-F87 HydrophobicContact CD1-CE1 4.38Å; L75-L91 HydrophobicContact CB-CD2 4.18Å; L75-L91 HydrophobicContact CD1-CD2 4.11Å; L75-L91 HydrophobicContact CD2-CD2 4.1Å; L75-L91 HydrophobicContact CG-CD2 4.35Å; L75-V102 HydrophobicContact CB-CG1 4.1Å; L75-F103 PolarHBondContact N-O 2.87Å; L75-P104 HydrophobicContact CD2-CB 4.27Å; L75-P104 CarbonylContact O-C 3.57Å; L75-P104 WeakPolarHBondContact O-CA 3.46Å; L75-Y105 WeakPolarHBondContact O-CB 3.49Å; L75-Y105 PolarHBondContact O-N 3.41Å; L75-F115 HydrophobicContact CD2-CD2 3.6Å; L75-F115 HydrophobicContact CD2-CE2 3.64Å; L75-F115 HydrophobicContact CD2-CG 4.4Å; L75-F115 HydrophobicContact CD2-CZ 4.46Å; L75-P138 HydrophobicContact CD1-CB 3.92Å; L75-T139 CarbonylContact C-O 3.55Å; L75-T140 HydrophobicContact CB-CG2 4.49Å; L75-T140 HydrophobicContact CD1-CG2 3.76Å
76	F	91.2	Very high	91	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	120.5	168.1	-66.1	-88	0	0	0	109.3	V74 Y105 V121 V125 F129 F130 P138 T139 F141	V74-F76 HydrophobicContact CG1-CD2 4.25Å; V74-F76 HydrophobicContact CG1-CE2 3.61Å; V74-F76 HydrophobicContact CG1-CZ 3.92Å; F76-Y105 WeakPolarHBondContact CA-O 3.49Å; F76-Y105 HydrophobicContact CD1-CD2 4.41Å; F76-Y105 HydrophobicContact CD1-CG 4.4Å; F76-Y105 AromaticContact CE1-CD2 3.75Å; F76-Y105 HydrophobicContact CE1-CD2 3.75Å; F76-Y105 HydrophobicContact CE1-CG 4.04Å; F76-Y105 AromaticContact CZ-CD2 3.93Å; F76-Y105 HydrophobicContact CZ-CD2 3.93Å; F76-V121 HydrophobicContact CD1-CG1 4.25Å; F76-V121 HydrophobicContact CD1-CG2 3.98Å; F76-V121 HydrophobicContact CE1-CG1 3.66Å; F76-V121 HydrophobicContact CE1-CG2 4.18Å; F76-V125 HydrophobicContact CE1-CG1 3.92Å; F76-V125 HydrophobicContact CZ-CG1 3.85Å; F76-F129 HydrophobicContact CE2-CB 3.78Å; F76-F129 AromaticContact CE2-CD1 3.8Å; F76-F129 HydrophobicContact CE2-CD1 3.8Å; F76-F129 HydrophobicContact CE2-CD2 4.39Å; F76-F129 HydrophobicContact CE2-CE1 4.46Å; F76-F129 AromaticContact CE2-CG 3.73Å; F76-F129 HydrophobicContact CE2-CG 3.73Å; F76-F129 HydrophobicContact CZ-CB 3.63Å; F76-F129 HydrophobicContact CZ-CD1 4.09Å; F76-F129 AromaticContact CZ-CD2 3.84Å; F76-F129 HydrophobicContact CZ-CD2 3.84Å; F76-F129 AromaticContact CZ-CG 3.58Å; F76-F129 HydrophobicContact CZ-CG 3.58Å; F76-F130 HydrophobicContact CB-CE2 4.35Å; F76-F130 HydrophobicContact CB-CZ 3.91Å; F76-F130 AromaticContact CD1-CE2 3.55Å; F76-F130 HydrophobicContact CD1-CE2 3.55Å; F76-F130 AromaticContact CD1-CZ 3.98Å; F76-F130 HydrophobicContact CD1-CZ 3.98Å; F76-F130 AromaticContact CD2-CE2 3.71Å; F76-F130 HydrophobicContact CD2-CE2 3.71Å; F76-F130 AromaticContact CD2-CZ 3.6Å; F76-F130 HydrophobicContact CD2-CZ 3.6Å; F76-F130 AromaticContact CE1-CE2 3.64Å; F76-F130 HydrophobicContact CE1-CE2 3.64Å; F76-F130 HydrophobicContact CE1-CZ 4.43Å; F76-F130 AromaticContact CE2-CE2 3.78Å; F76-F130 HydrophobicContact CE2-CE2 3.78Å; F76-F130 HydrophobicContact CE2-CZ 4.07Å; F76-F130 AromaticContact CG-CE2 3.59Å; F76-F130 HydrophobicContact CG-CE2 3.59Å; F76-F130 AromaticContact CG-CZ 3.54Å; F76-F130 HydrophobicContact CG-CZ 3.54Å; F76-F130 AromaticContact CZ-CE2 3.75Å; F76-F130 HydrophobicContact CZ-CE2 3.75Å; F76-F130 HydrophobicContact CZ-CZ 4.47Å; F76-P138 CarbonylContact O-C 3.57Å; F76-P138 VanDerWaalsContact O-CA 3.3Å; F76-P138 WeakPolarHBondContact O-CA 3.37Å; F76-T139 PolarHBondContact N-O 3.39Å; F76-T139 PolarHBondContact O-N 2.9Å; F76-F141 AromaticContact CD2-CD2 3.86Å; F76-F141 HydrophobicContact CD2-CD2 3.86Å; F76-F141 AromaticContact CD2-CE2 3.84Å; F76-F141 HydrophobicContact CD2-CE2 3.84Å; F76-F141 AromaticContact CE2-CD2 3.62Å; F76-F141 HydrophobicContact CE2-CD2 3.62Å; F76-F141 AromaticContact CE2-CE2 3.71Å; F76-F141 HydrophobicContact CE2-CE2 3.71Å
77	M	91.8	Very high	91.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	173.5	-173.1	61.3	178	-69.1	0	0	112	L75 C84 D88 P104 Y105 T106 L107 D112 F115 T118	L75-M77 HydrophobicContact CD2-CB 4.39Å; L75-M77 HydrophobicContact CD2-CG 4.4Å; L75-M77 HydrophobicContact CD2-SD 3.91Å; L75-M77 HydrophobicContact CG-CB 4.29Å; L75-M77 HydrophobicContact CG-CG 4.5Å; M77-C84 HydrophobicContact CB-CB 4.43Å; M77-D88 WeakPolarHBondContact CE-OD2 3.42Å; M77-P104 HydrophobicContact SD-CB 4.15Å; M77-Y105 WeakPolarHBondContact CG-O 3.23Å; M77-Y105 PolarHBondContact N-O 2.75Å; M77-T106 WeakPolarHBondContact O-CA 3.5Å; M77-L107 PolarHBondContact O-N 3.16Å; M77-D112 HydrophobicContact CE-CB 3.61Å; M77-D112 VanDerWaalsContact CE-CG 3.47Å; M77-F115 HydrophobicContact SD-CB 3.92Å; M77-F115 HydrophobicContact SD-CD2 4.38Å; M77-T118 HydrophobicContact CE-CG2 4.29Å; M77-T118 HydrophobicContact CG-CG2 4.42Å; M77-T118 HydrophobicContact SD-CG2 3.63Å
78	Q	90.8	Very high	91.5	Very high	67 Å²	67	39.5 Å²	39.5	31%	0.313	20%	0.196	S	C	.	.			trans	-140	141.2	170.1	-75.4	171.6	-73.7	0	0	108.5	H80 C81 L107 D108 T137	Q78-H80 PolarHBondContact O-N 3.37Å; Q78-C81 HydrophobicContact CB-CB 3.88Å; Q78-C81 WeakPolarHBondContact O-CB 3.32Å; Q78-C81 PolarHBondContact O-N 2.99Å; Q78-C81 VanDerWaalsContact O-N 3.14Å; Q78-L107 HydrophobicContact CG-CB 3.77Å; Q78-L107 HydrophobicContact CG-CD1 4.43Å; Q78-L107 HydrophobicContact CG-CG 4.47Å; Q78-D108 WeakPolarHBondContact CA-OD1 3.21Å; Q78-D108 HydrophobicContact CB-CB 4.48Å; Q78-D108 HydrophobicContact CG-CB 4.21Å; Q78-T137 HydrophobicContact CG-CG2 4.12Å; Q78-T137 PolarHBondContact OE1-OG1 3.33Å
79	G	88.5	Confident	91.8	Very high	9 Å²	9	42 Å²	42	9%	0.093	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.8	-179.3	0	0	0	0	0	113.4	H85 D108 Q110	G79-H85 PolarHBondContact O-NE2 3.08Å; G79-D108 PolarHBondContact N-OD1 2.99Å; G79-D108 PolarHBondContact N-OD2 3.29Å; G79-Q110 PolarHBondContact N-O 3.1Å
80	H	90.1	Very high	92	Very high	138 Å²	138	42.4 Å²	42.4	64%	0.639	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-0	-179.2	-60.7	87.3	0	0	0	114.8	Q78 P82 D108 Q110	Q78-H80 PolarHBondContact O-N 3.37Å; H80-P82 VanDerWaalsContact O-CD 3.25Å; H80-P82 WeakPolarHBondContact O-CD 3.45Å; H80-D108 IonicContact ND1-OD2 3.71Å; H80-D108 PolarHBondContact ND1-OD2 3.09Å; H80-Q110 PolarHBondContact CE1-OE1 3.49Å
81	C	89	Confident	92.3	Very high	10 Å²	10	40 Å²	40	7%	0.068	20%	0.2	C	C	.	.			trans	-78.3	114.2	-172	155.5	0	0	0	0	111.6	Q78 Y83 C84 H85 T137	Q78-C81 HydrophobicContact CB-CB 3.88Å; Q78-C81 WeakPolarHBondContact O-CB 3.32Å; Q78-C81 PolarHBondContact O-N 2.99Å; Q78-C81 VanDerWaalsContact O-N 3.14Å; C81-Y83 VanDerWaalsContact C-N 3.3Å; C81-Y83 PolarHBondContact O-N 3.34Å; C81-C84 HydrophobicContact CB-CB 3.67Å; C81-C84 WeakPolarHBondContact CB-SG 3.49Å; C81-C84 WeakPolarHBondContact O-CB 3.47Å; C81-C84 PolarHBondContact O-N 3.46Å; C81-C84 WeakPolarHBondContact SG-CB 3.49Å; C81-C84 PolarHBondContact SG-N 2.92Å; C81-C84 CovalentContact SG-SG 2.06Å; C81-C84 PolarHBondContact SG-SG 3Å; C81-H85 PolarHBondContact O-CD2 3.16Å; C81-H85 VanDerWaalsContact O-CD2 3.23Å; C81-H85 PolarHBondContact O-N 2.86Å; C81-T137 VanDerWaalsContact SG-C 3.58Å; C81-T137 PolarHBondContact SG-O 3.43Å; C81-T137 VanDerWaalsContact SG-O 3.35Å; C81-T137 PolarHBondContact SG-OG1 3.18Å; C81-T137 VanDerWaalsContact SG-OG1 3.42Å
82	P	89.4	Confident	92.6	Very high	100 Å²	100	43 Å²	43	65%	0.649	21%	0.213	S	C	*	.	H	α-helix	trans	-62.8	-34.7	-176.6	-23.6	34.9	0	0	0	113.5	H80 C84 Q86	H80-P82 VanDerWaalsContact O-CD 3.25Å; H80-P82 WeakPolarHBondContact O-CD 3.45Å; P82-C84 VanDerWaalsContact C-N 3.3Å; P82-Q86 PolarHBondContact O-N 3.31Å
83	Y	88.9	Confident	92.7	Very high	123 Å²	123	45.2 Å²	45.2	48%	0.482	23%	0.225	S	C	.	.	H	α-helix	trans	-69.9	-28.5	176.4	-63.8	-66.3	0	0	0	112.5	C81 Q86 F87 A157	C81-Y83 VanDerWaalsContact C-N 3.3Å; C81-Y83 PolarHBondContact O-N 3.34Å; Y83-Q86 PolarHBondContact O-N 3.38Å; Y83-F87 WeakPolarHBondContact O-CB 2.87Å; Y83-F87 PolarHBondContact O-N 3.29Å; Y83-A157 HydrophobicContact CD1-CB 4.1Å
84	C	88.5	Confident	92.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.3	-48.3	176.9	-54.5	0	0	0	0	109.2	M77 C81 P82 Q86 F87 D88 T137 P138	M77-C84 HydrophobicContact CB-CB 4.43Å; C81-C84 HydrophobicContact CB-CB 3.67Å; C81-C84 WeakPolarHBondContact CB-SG 3.49Å; C81-C84 WeakPolarHBondContact O-CB 3.47Å; C81-C84 PolarHBondContact O-N 3.46Å; C81-C84 WeakPolarHBondContact SG-CB 3.49Å; C81-C84 PolarHBondContact SG-N 2.92Å; C81-C84 CovalentContact SG-SG 2.06Å; C81-C84 PolarHBondContact SG-SG 3Å; P82-C84 VanDerWaalsContact C-N 3.3Å; C84-Q86 PolarHBondContact O-N 3.34Å; C84-Q86 VanDerWaalsContact O-N 3.08Å; C84-F87 PolarHBondContact O-N 3.24Å; C84-D88 WeakPolarHBondContact CB-OD2 3.42Å; C84-D88 VanDerWaalsContact O-CB 3.22Å; C84-D88 WeakPolarHBondContact O-CB 3.36Å; C84-D88 PolarHBondContact O-N 3.23Å; C84-T137 VanDerWaalsContact SG-CB 3.58Å; C84-P138 VanDerWaalsContact SG-N 3.4Å
85	H	93.4	Very high	92.8	Very high	86 Å²	86	45.7 Å²	45.7	40%	0.398	23%	0.229	S	C	.	.	H	α-helix	trans	-56.5	-28.6	172.1	-73.4	-74.3	0	0	0	113.7	G79 C81 P89	G79-H85 PolarHBondContact O-NE2 3.08Å; C81-H85 PolarHBondContact O-CD2 3.16Å; C81-H85 VanDerWaalsContact O-CD2 3.23Å; C81-H85 PolarHBondContact O-N 2.86Å; H85-P89 WeakPolarHBondContact O-CD 3.5Å
86	Q	90.5	Very high	92.7	Very high	128 Å²	128	52.6 Å²	52.6	60%	0.598	26%	0.262	S	S	*	.	H	α-helix	trans	-78.5	-37.9	175.9	-171.7	178.5	12.5	0	0	112.9	P82 Y83 C84 A157	P82-Q86 PolarHBondContact O-N 3.31Å; Y83-Q86 PolarHBondContact O-N 3.38Å; C84-Q86 PolarHBondContact O-N 3.34Å; C84-Q86 VanDerWaalsContact O-N 3.08Å; Q86-A157 HydrophobicContact CB-CB 4.28Å; Q86-A157 HydrophobicContact CG-CB 4.34Å
87	F	92.8	Very high	92.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-99.7	-37.8	-168.9	173.6	-111.6	0	0	0	114.1	L75 Y83 C84 P89 V90 L91 P138 T140 L154 A157 T158 F163	L75-F87 HydrophobicContact CD1-CE1 4.38Å; Y83-F87 WeakPolarHBondContact O-CB 2.87Å; Y83-F87 PolarHBondContact O-N 3.29Å; C84-F87 PolarHBondContact O-N 3.24Å; F87-P89 VanDerWaalsContact C-CD 3.49Å; F87-P89 VanDerWaalsContact C-N 3.35Å; F87-V90 WeakPolarHBondContact O-CA 3.13Å; F87-V90 VanDerWaalsContact O-CB 3.25Å; F87-V90 WeakPolarHBondContact O-CB 3.37Å; F87-V90 PolarHBondContact O-N 3.18Å; F87-L91 HydrophobicContact CE1-CB 4.1Å; F87-L91 HydrophobicContact CE1-CD2 4Å; F87-L91 HydrophobicContact CZ-CB 4.05Å; F87-L91 HydrophobicContact CZ-CD1 4.46Å; F87-L91 HydrophobicContact CZ-CD2 4.36Å; F87-L91 PolarHBondContact O-N 3.15Å; F87-P138 HydrophobicContact CB-CG 3.98Å; F87-P138 HydrophobicContact CD1-CB 3.81Å; F87-P138 HydrophobicContact CD1-CG 3.65Å; F87-P138 HydrophobicContact CE1-CB 4.46Å; F87-P138 HydrophobicContact CG-CG 4.12Å; F87-T140 HydrophobicContact CE1-CG2 3.72Å; F87-T140 HydrophobicContact CZ-CG2 4.17Å; F87-L154 HydrophobicContact CE2-CD2 4.31Å; F87-L154 HydrophobicContact CZ-CD2 4.23Å; F87-A157 HydrophobicContact CB-CB 3.97Å; F87-T158 HydrophobicContact CD2-CG2 3.84Å; F87-T158 WeakPolarHBondContact CD2-O 3.48Å; F87-T158 HydrophobicContact CE2-CG2 3.47Å; F87-T158 VanDerWaalsContact CE2-CG2 3.47Å; F87-T158 HydrophobicContact CZ-CG2 4.43Å; F87-F163 HydrophobicContact CE2-CB 4.31Å; F87-F163 AromaticContact CE2-CD2 3.87Å; F87-F163 HydrophobicContact CE2-CD2 3.87Å; F87-F163 HydrophobicContact CE2-CG 4.32Å; F87-F163 AromaticContact CZ-CD2 3.5Å; F87-F163 HydrophobicContact CZ-CD2 3.5Å; F87-F163 AromaticContact CZ-CE2 3.82Å; F87-F163 HydrophobicContact CZ-CE2 3.82Å; F87-F163 HydrophobicContact CZ-CG 4.3Å
88	D	97.1	Very high	92.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-37.5	-173.7	-66.2	-4.4	0	0	0	112.7	M77 C84 V90 L91 K92 D112 A114 F115	M77-D88 WeakPolarHBondContact CE-OD2 3.42Å; C84-D88 WeakPolarHBondContact CB-OD2 3.42Å; C84-D88 VanDerWaalsContact O-CB 3.22Å; C84-D88 WeakPolarHBondContact O-CB 3.36Å; C84-D88 PolarHBondContact O-N 3.23Å; D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V90 PolarHBondContact O-N 3.15Å; D88-L91 PolarHBondContact O-N 2.77Å; D88-K92 WeakPolarHBondContact O-CB 3.42Å; D88-K92 PolarHBondContact O-N 2.69Å; D88-D112 WeakPolarHBondContact CB-OD2 3.19Å; D88-A114 HydrophobicContact CB-CB 3.84Å; D88-F115 HydrophobicContact CB-CD2 3.83Å; D88-F115 HydrophobicContact CB-CE2 3.85Å; D88-F115 WeakPolarHBondContact O-CE2 3.23Å
89	P	97.5	Very high	92.6	Very high	55 Å²	55	59.1 Å²	59.1	36%	0.357	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-39	170.3	-23.8	34.4	0	0	0	113.5	H85 F87 K92 Q93 A114	H85-P89 WeakPolarHBondContact O-CD 3.5Å; F87-P89 VanDerWaalsContact C-CD 3.49Å; F87-P89 VanDerWaalsContact C-N 3.35Å; P89-K92 PolarHBondContact O-N 3.18Å; P89-Q93 WeakPolarHBondContact O-CB 3.47Å; P89-Q93 PolarHBondContact O-N 3.09Å; P89-A114 HydrophobicContact CG-CB 4.2Å
90	V	94.8	Very high	92.7	Very high	30 Å²	30	59 Å²	59	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-45.9	176.7	-179.3	0	0	0	0	109.8	F87 D88 K92 Q93 L94 A160	F87-V90 WeakPolarHBondContact O-CA 3.13Å; F87-V90 VanDerWaalsContact O-CB 3.25Å; F87-V90 WeakPolarHBondContact O-CB 3.37Å; F87-V90 PolarHBondContact O-N 3.18Å; D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V90 PolarHBondContact O-N 3.15Å; V90-K92 PolarHBondContact O-N 2.73Å; V90-Q93 PolarHBondContact O-N 3.46Å; V90-L94 HydrophobicContact CG1-CD1 4.24Å; V90-L94 WeakPolarHBondContact O-CG 3.4Å; V90-L94 PolarHBondContact O-N 2.57Å; V90-A160 HydrophobicContact CG1-CB 3.88Å
91	L	96.9	Very high	92.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.2	-43.7	177.8	179.6	59.1	0	0	0	111.7	V73 L75 F87 D88 L94 A95 F100 V102 F115 T140 F163	V73-L91 HydrophobicContact CG1-CD1 4.18Å; V73-L91 HydrophobicContact CG1-CD2 4.25Å; L75-L91 HydrophobicContact CB-CD2 4.18Å; L75-L91 HydrophobicContact CD1-CD2 4.11Å; L75-L91 HydrophobicContact CD2-CD2 4.1Å; L75-L91 HydrophobicContact CG-CD2 4.35Å; F87-L91 HydrophobicContact CE1-CB 4.1Å; F87-L91 HydrophobicContact CE1-CD2 4Å; F87-L91 HydrophobicContact CZ-CB 4.05Å; F87-L91 HydrophobicContact CZ-CD1 4.46Å; F87-L91 HydrophobicContact CZ-CD2 4.36Å; F87-L91 PolarHBondContact O-N 3.15Å; D88-L91 PolarHBondContact O-N 2.77Å; L91-L94 PolarHBondContact O-N 3.17Å; L91-A95 WeakPolarHBondContact O-CB 3.07Å; L91-A95 PolarHBondContact O-N 3.28Å; L91-F100 HydrophobicContact CD1-CE2 3.86Å; L91-F100 HydrophobicContact CD1-CZ 4.14Å; L91-V102 HydrophobicContact CD1-CG2 4.19Å; L91-V102 HydrophobicContact CD2-CG1 3.94Å; L91-V102 HydrophobicContact CD2-CG2 4.32Å; L91-V102 HydrophobicContact CG-CG1 4.42Å; L91-V102 HydrophobicContact CG-CG2 3.98Å; L91-F115 HydrophobicContact CG-CZ 4.46Å; L91-T140 HydrophobicContact CD2-CG2 4.06Å; L91-F163 HydrophobicContact CD1-CD1 4.4Å; L91-F163 HydrophobicContact CD1-CE1 3.66Å; L91-F163 HydrophobicContact CD1-CE2 3.9Å; L91-F163 HydrophobicContact CD1-CZ 3.37Å
92	K	97.2	Very high	93.1	Very high	76 Å²	76	55.7 Å²	55.7	33%	0.33	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-44	176.3	-175.1	173.8	-173.5	170.5	0	111.9	D88 P89 V90 A95 Q96 A114 F115	D88-K92 WeakPolarHBondContact O-CB 3.42Å; D88-K92 PolarHBondContact O-N 2.69Å; P89-K92 PolarHBondContact O-N 3.18Å; V90-K92 PolarHBondContact O-N 2.73Å; K92-A95 PolarHBondContact O-N 3.4Å; K92-Q96 WeakPolarHBondContact O-CG 3.19Å; K92-Q96 PolarHBondContact O-N 3.36Å; K92-A114 HydrophobicContact CD-CB 4.24Å; K92-A114 VanDerWaalsContact CD-O 3.28Å; K92-A114 WeakPolarHBondContact CD-O 3.38Å; K92-A114 WeakPolarHBondContact CE-O 3.35Å; K92-A114 PolarHBondContact NZ-O 3.15Å; K92-F115 HydrophobicContact CB-CE1 4.42Å; K92-F115 HydrophobicContact CB-CE2 4.36Å; K92-F115 HydrophobicContact CB-CZ 3.85Å; K92-F115 HydrophobicContact CG-CZ 4.49Å
93	Q	96.4	Very high	93.3	Very high	118 Å²	118	53.7 Å²	53.7	55%	0.551	27%	0.267	S	S	*	.	H	α-helix	trans	-61.4	-45.9	176.5	-177.7	-178.2	-3.8	0	0	111.3	P89 V90 A95 Q96 Q97	P89-Q93 WeakPolarHBondContact O-CB 3.47Å; P89-Q93 PolarHBondContact O-N 3.09Å; V90-Q93 PolarHBondContact O-N 3.46Å; Q93-A95 PolarHBondContact O-N 2.89Å; Q93-Q96 PolarHBondContact O-N 3.41Å; Q93-Q97 WeakPolarHBondContact O-CB 3.19Å; Q93-Q97 PolarHBondContact O-N 3.15Å
94	L	95.2	Very high	93.6	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-41.3	177.5	-74.3	176	0	0	0	112.5	V90 L91 Q96 Q97 Y98 F100 A160 F163 M164	V90-L94 HydrophobicContact CG1-CD1 4.24Å; V90-L94 WeakPolarHBondContact O-CG 3.4Å; V90-L94 PolarHBondContact O-N 2.57Å; L91-L94 PolarHBondContact O-N 3.17Å; L94-Q96 VanDerWaalsContact C-N 3.29Å; L94-Q96 PolarHBondContact O-N 3.1Å; L94-Q97 PolarHBondContact O-N 3.47Å; L94-Y98 HydrophobicContact CB-CD2 4.49Å; L94-Y98 HydrophobicContact CD2-CD2 3.87Å; L94-Y98 HydrophobicContact CD2-CE2 3.56Å; L94-Y98 WeakPolarHBondContact O-CB 3.34Å; L94-Y98 WeakPolarHBondContact O-CD2 3.31Å; L94-Y98 PolarHBondContact O-N 3.44Å; L94-F100 HydrophobicContact CB-CE1 4.05Å; L94-F100 HydrophobicContact CB-CZ 3.71Å; L94-F100 WeakPolarHBondContact O-CE1 3.29Å; L94-A160 HydrophobicContact CD1-CB 4.26Å; L94-A160 HydrophobicContact CD2-CB 4.01Å; L94-A160 HydrophobicContact CG-CB 4.27Å; L94-F163 HydrophobicContact CD1-CB 3.92Å; L94-F163 HydrophobicContact CD1-CD1 3.49Å; L94-F163 VanDerWaalsContact CD1-CD1 3.49Å; L94-F163 HydrophobicContact CD1-CE1 4.33Å; L94-F163 HydrophobicContact CD1-CG 4.01Å; L94-M164 HydrophobicContact CD1-CG 4.14Å; L94-M164 HydrophobicContact CD1-SD 4.34Å; L94-M164 HydrophobicContact CD2-CG 3.76Å; L94-M164 HydrophobicContact CD2-SD 4.15Å
95	A	94.8	Very high	93.9	Very high	16 Å²	16	50 Å²	50	13%	0.132	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-41.7	176.3	0	0	0	0	0	111.4	L91 K92 Q93 G99 F100 V102	L91-A95 WeakPolarHBondContact O-CB 3.07Å; L91-A95 PolarHBondContact O-N 3.28Å; K92-A95 PolarHBondContact O-N 3.4Å; Q93-A95 PolarHBondContact O-N 2.89Å; A95-G99 WeakPolarHBondContact O-CA 3.28Å; A95-G99 PolarHBondContact O-N 3.24Å; A95-F100 HydrophobicContact CB-CD2 4.02Å; A95-F100 HydrophobicContact CB-CE2 3.68Å; A95-F100 HydrophobicContact CB-CZ 4.09Å; A95-F100 WeakPolarHBondContact CB-O 3.3Å; A95-V102 HydrophobicContact CB-CG2 3.59Å
96	Q	92.9	Very high	93.8	Very high	145 Å²	145	46 Å²	46	68%	0.678	24%	0.235	S	C	*	.	H	α-helix	trans	-68.2	-40.9	174.6	-70.2	173.3	-11.4	0	0	112.5	K92 Q93 L94	K92-Q96 WeakPolarHBondContact O-CG 3.19Å; K92-Q96 PolarHBondContact O-N 3.36Å; Q93-Q96 PolarHBondContact O-N 3.41Å; L94-Q96 VanDerWaalsContact C-N 3.29Å; L94-Q96 PolarHBondContact O-N 3.1Å
97	Q	91.6	Very high	93.7	Very high	122 Å²	122	42.5 Å²	42.5	57%	0.57	22%	0.22	S	C	*	.	H	α-helix	trans	-70.1	-44.7	-177.5	-177	177.7	-4.1	0	0	112.7	Q93 L94	Q93-Q97 WeakPolarHBondContact O-CB 3.19Å; Q93-Q97 PolarHBondContact O-N 3.15Å; L94-Q97 PolarHBondContact O-N 3.47Å
98	Y	91.3	Very high	93.6	Very high	54 Å²	54	45 Å²	45	21%	0.212	23%	0.233	C	C	.	.	H	α-helix	trans	-99.2	-14.7	-175	-69.4	-77.4	0	0	0	113.6	F58 L94 F100 M164	F58-Y98 AromaticContact CD2-CD1 3.78Å; F58-Y98 HydrophobicContact CD2-CD1 3.78Å; F58-Y98 AromaticContact CD2-CE1 3.98Å; F58-Y98 HydrophobicContact CD2-CE1 3.98Å; F58-Y98 AromaticContact CE2-CD1 3.83Å; F58-Y98 HydrophobicContact CE2-CD1 3.83Å; F58-Y98 AromaticContact CE2-CE1 3.59Å; F58-Y98 HydrophobicContact CE2-CE1 3.59Å; L94-Y98 HydrophobicContact CB-CD2 4.49Å; L94-Y98 HydrophobicContact CD2-CD2 3.87Å; L94-Y98 HydrophobicContact CD2-CE2 3.56Å; L94-Y98 WeakPolarHBondContact O-CB 3.34Å; L94-Y98 WeakPolarHBondContact O-CD2 3.31Å; L94-Y98 PolarHBondContact O-N 3.44Å; Y98-F100 HydrophobicContact CD2-CE1 4.45Å; Y98-M164 HydrophobicContact CD1-CE 4.1Å; Y98-M164 HydrophobicContact CD2-CE 3.92Å; Y98-M164 HydrophobicContact CD2-SD 3.86Å; Y98-M164 HydrophobicContact CE1-CE 4.1Å; Y98-M164 HydrophobicContact CE2-CE 3.92Å; Y98-M164 HydrophobicContact CE2-CG 3.99Å; Y98-M164 HydrophobicContact CE2-SD 3.91Å; Y98-M164 HydrophobicContact CG-CE 4.01Å; Y98-M164 HydrophobicContact CG-SD 4.46Å
99	G	88.1	Confident	93.1	Very high	27 Å²	27	47.2 Å²	47.2	28%	0.278	26%	0.257	S	S	.	.			trans	79.5	17.1	174.5	0	0	0	0	0	115.4	A95	A95-G99 WeakPolarHBondContact O-CA 3.28Å; A95-G99 PolarHBondContact O-N 3.24Å
100	F	90.8	Very high	92.7	Very high	7 Å²	7	49.2 Å²	49.2	3%	0.031	26%	0.261	C	S	.	.			trans	-80.2	151.5	167.7	61.2	-96.2	0	0	0	110.5	L68 V73 L91 L94 A95 Y98 V102 F163 M164 M167	L68-F100 HydrophobicContact CB-CB 4.23Å; L68-F100 HydrophobicContact CD1-CD1 4.3Å; V73-F100 HydrophobicContact CB-CD2 4.34Å; V73-F100 HydrophobicContact CB-CE2 4.38Å; V73-F100 HydrophobicContact CG2-CD2 3.58Å; V73-F100 HydrophobicContact CG2-CE2 3.71Å; V73-F100 HydrophobicContact CG2-CG 4.48Å; L91-F100 HydrophobicContact CD1-CE2 3.86Å; L91-F100 HydrophobicContact CD1-CZ 4.14Å; L94-F100 HydrophobicContact CB-CE1 4.05Å; L94-F100 HydrophobicContact CB-CZ 3.71Å; L94-F100 WeakPolarHBondContact O-CE1 3.29Å; A95-F100 HydrophobicContact CB-CD2 4.02Å; A95-F100 HydrophobicContact CB-CE2 3.68Å; A95-F100 HydrophobicContact CB-CZ 4.09Å; A95-F100 WeakPolarHBondContact CB-O 3.3Å; Y98-F100 HydrophobicContact CD2-CE1 4.45Å; F100-V102 HydrophobicContact CD2-CG2 4.22Å; F100-V102 HydrophobicContact CE2-CG2 3.93Å; F100-F163 HydrophobicContact CE2-CE1 4.26Å; F100-F163 AromaticContact CZ-CE1 3.79Å; F100-F163 HydrophobicContact CZ-CE1 3.79Å; F100-M164 HydrophobicContact CE1-SD 4.27Å; F100-M167 HydrophobicContact CZ-CE 4.46Å
101	S	91.8	Very high	92.5	Very high	49 Å²	49	48.9 Å²	48.9	34%	0.343	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	146.2	179.3	62.8	0	0	0	0	111.8	K72 V73	K72-S101 CarbonylContact C-O 3.59Å; K72-S101 WeakPolarHBondContact CA-O 3.4Å; K72-S101 WeakPolarHBondContact CB-OG 3.4Å; K72-S101 WeakPolarHBondContact CE-OG 3.42Å; K72-S101 WeakPolarHBondContact CG-OG 3.49Å; V73-S101 PolarHBondContact N-O 3.46Å
102	V	95	Very high	92.3	Very high	29 Å²	29	49.4 Å²	49.4	18%	0.176	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.1	173.5	-178.2	0	0	0	0	109	V73 L75 L91 A95 F100 F115	V73-V102 HydrophobicContact CB-CG2 4.32Å; V73-V102 CarbonylContact O-C 3.6Å; V73-V102 VanDerWaalsContact O-CA 3.25Å; V73-V102 WeakPolarHBondContact O-CA 3.31Å; L75-V102 HydrophobicContact CB-CG1 4.1Å; L91-V102 HydrophobicContact CD1-CG2 4.19Å; L91-V102 HydrophobicContact CD2-CG1 3.94Å; L91-V102 HydrophobicContact CD2-CG2 4.32Å; L91-V102 HydrophobicContact CG-CG1 4.42Å; L91-V102 HydrophobicContact CG-CG2 3.98Å; A95-V102 HydrophobicContact CB-CG2 3.59Å; F100-V102 HydrophobicContact CD2-CG2 4.22Å; F100-V102 HydrophobicContact CE2-CG2 3.93Å; V102-F115 HydrophobicContact CB-CE1 4.04Å; V102-F115 HydrophobicContact CB-CZ 4.2Å; V102-F115 HydrophobicContact CG1-CE1 3.8Å; V102-F115 HydrophobicContact CG1-CZ 3.74Å; V102-F115 HydrophobicContact CG2-CZ 4.43Å
103	F	94	Very high	92.1	Very high	59 Å²	59	51.4 Å²	51.4	26%	0.259	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	102.2	175.7	-166.2	-85.1	0	0	0	109.8	K72 V73 V74 L75 Y105 L119	K72-F103 HydrophobicContact CD-CB 3.89Å; K72-F103 HydrophobicContact CD-CD2 4.49Å; K72-F103 HydrophobicContact CG-CB 4.07Å; V73-F103 PolarHBondContact O-N 3.48Å; V74-F103 WeakPolarHBondContact CA-O 3.43Å; V74-F103 HydrophobicContact CG2-CB 4.49Å; L75-F103 PolarHBondContact N-O 2.87Å; F103-Y105 HydrophobicContact CD1-CD2 4.09Å; F103-Y105 AromaticContact CD1-CE2 3.79Å; F103-Y105 HydrophobicContact CD1-CE2 3.79Å; F103-Y105 HydrophobicContact CE1-CD1 4.29Å; F103-Y105 HydrophobicContact CE1-CD2 4.23Å; F103-Y105 AromaticContact CE1-CE1 3.76Å; F103-Y105 HydrophobicContact CE1-CE1 3.76Å; F103-Y105 AromaticContact CE1-CE2 3.69Å; F103-Y105 HydrophobicContact CE1-CE2 3.69Å; F103-Y105 HydrophobicContact CE1-CG 4.49Å; F103-Y105 AromaticContact CE1-CZ 3.41Å; F103-Y105 VanDerWaalsContact CE1-CZ 3.41Å; F103-L119 HydrophobicContact CE1-CD1 4.12Å; F103-L119 HydrophobicContact CE2-CD1 4.47Å; F103-L119 HydrophobicContact CZ-CD1 3.59Å
104	P	95.8	Very high	92	Very high	12 Å²	12	46.1 Å²	46.1	8%	0.078	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.9	-174	35.6	-35	0	0	0	112.3	L75 M77 F115 T118 L119	L75-P104 HydrophobicContact CD2-CB 4.27Å; L75-P104 CarbonylContact O-C 3.57Å; L75-P104 WeakPolarHBondContact O-CA 3.46Å; M77-P104 HydrophobicContact SD-CB 4.15Å; P104-F115 HydrophobicContact CB-CB 3.95Å; P104-F115 HydrophobicContact CB-CD1 4.24Å; P104-F115 HydrophobicContact CB-CG 4.05Å; P104-F115 HydrophobicContact CG-CB 4.03Å; P104-F115 HydrophobicContact CG-CD1 4.01Å; P104-F115 HydrophobicContact CG-CG 4.21Å; P104-T118 HydrophobicContact CB-CG2 3.99Å; P104-T118 HydrophobicContact CG-CG2 4.24Å; P104-L119 PolarHBondContact O-N 2.84Å
105	Y	93.7	Very high	92	Very high	34 Å²	34	47.1 Å²	47.1	13%	0.133	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.3	175.6	-93.5	-47.7	0	0	0	108.7	V74 L75 F76 M77 F103 L119 V121 V125	V74-Y105 HydrophobicContact CG1-CD2 3.62Å; V74-Y105 HydrophobicContact CG1-CE2 4Å; L75-Y105 WeakPolarHBondContact O-CB 3.49Å; L75-Y105 PolarHBondContact O-N 3.41Å; F76-Y105 WeakPolarHBondContact CA-O 3.49Å; F76-Y105 HydrophobicContact CD1-CD2 4.41Å; F76-Y105 HydrophobicContact CD1-CG 4.4Å; F76-Y105 AromaticContact CE1-CD2 3.75Å; F76-Y105 HydrophobicContact CE1-CD2 3.75Å; F76-Y105 HydrophobicContact CE1-CG 4.04Å; F76-Y105 AromaticContact CZ-CD2 3.93Å; F76-Y105 HydrophobicContact CZ-CD2 3.93Å; M77-Y105 WeakPolarHBondContact CG-O 3.23Å; M77-Y105 PolarHBondContact N-O 2.75Å; F103-Y105 HydrophobicContact CD1-CD2 4.09Å; F103-Y105 AromaticContact CD1-CE2 3.79Å; F103-Y105 HydrophobicContact CD1-CE2 3.79Å; F103-Y105 HydrophobicContact CE1-CD1 4.29Å; F103-Y105 HydrophobicContact CE1-CD2 4.23Å; F103-Y105 AromaticContact CE1-CE1 3.76Å; F103-Y105 HydrophobicContact CE1-CE1 3.76Å; F103-Y105 AromaticContact CE1-CE2 3.69Å; F103-Y105 HydrophobicContact CE1-CE2 3.69Å; F103-Y105 HydrophobicContact CE1-CG 4.49Å; F103-Y105 AromaticContact CE1-CZ 3.41Å; F103-Y105 VanDerWaalsContact CE1-CZ 3.41Å; Y105-L119 CarbonylContact C-O 3.54Å; Y105-L119 WeakPolarHBondContact CA-O 3.27Å; Y105-L119 HydrophobicContact CD1-CB 4.25Å; Y105-L119 HydrophobicContact CE1-CB 4.3Å; Y105-V121 HydrophobicContact CD1-CB 4.31Å; Y105-V121 HydrophobicContact CD1-CG1 4.32Å; Y105-V121 HydrophobicContact CD1-CG2 4.01Å; Y105-V121 HydrophobicContact CG-CG1 4.35Å; Y105-V121 HydrophobicContact CG-CG2 3.96Å; Y105-V125 HydrophobicContact CD2-CG1 4.03Å; Y105-V125 HydrophobicContact CE2-CG1 3.6Å
106	T	91.8	Very high	91.9	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.9	177.9	177.7	0	0	0	0	111.9	M77 D108 G109 Q110 T118 L119 P120 V121	M77-T106 WeakPolarHBondContact O-CA 3.5Å; T106-D108 PolarHBondContact OG1-N 2.91Å; T106-D108 PolarHBondContact OG1-OD1 2.92Å; T106-G109 VanDerWaalsContact CG2-CA 3.44Å; T106-G109 PolarHBondContact OG1-N 2.98Å; T106-G109 VanDerWaalsContact OG1-N 3.14Å; T106-Q110 WeakPolarHBondContact CB-O 3.33Å; T106-Q110 PolarHBondContact OG1-N 3.49Å; T106-Q110 VanDerWaalsContact OG1-N 3.08Å; T106-Q110 PolarHBondContact OG1-O 2.81Å; T106-T118 WeakPolarHBondContact CB-OG1 3.35Å; T106-T118 WeakPolarHBondContact CG2-OG1 3.22Å; T106-L119 WeakPolarHBondContact CG2-O 3.27Å; T106-L119 PolarHBondContact N-O 3.19Å; T106-P120 WeakPolarHBondContact O-CA 3.42Å; T106-V121 VanDerWaalsContact O-CG2 3.26Å; T106-V121 WeakPolarHBondContact O-CG2 3.33Å; T106-V121 PolarHBondContact O-N 3.12Å; T106-V121 VanDerWaalsContact O-N 3.13Å
107	L	88.6	Confident	91.6	Very high	54 Å²	54	49.8 Å²	49.8	28%	0.283	28%	0.284	S	S	.	.	S	Bend	trans	-82.1	-20.2	175.9	-58	175.4	0	0	0	112.9	M77 Q78 V121 M126 V135 T137	M77-L107 PolarHBondContact O-N 3.16Å; Q78-L107 HydrophobicContact CG-CB 3.77Å; Q78-L107 HydrophobicContact CG-CD1 4.43Å; Q78-L107 HydrophobicContact CG-CG 4.47Å; L107-V121 HydrophobicContact CD2-CB 4.22Å; L107-V121 HydrophobicContact CD2-CG2 3.68Å; L107-V121 HydrophobicContact CG-CG2 4.45Å; L107-M126 HydrophobicContact CD2-CE 3.95Å; L107-M126 HydrophobicContact CD2-SD 3.41Å; L107-M126 WeakPolarHBondContact CD2-SD 3.48Å; L107-V135 HydrophobicContact CD1-CG1 3.45Å; L107-V135 VanDerWaalsContact CD1-CG1 3.45Å; L107-V135 HydrophobicContact CD2-CG1 4.46Å; L107-T137 HydrophobicContact CD1-CG2 3.46Å; L107-T137 VanDerWaalsContact CD1-CG2 3.46Å; L107-T137 HydrophobicContact CG-CG2 4.27Å
108	D	90.3	Very high	91.4	Very high	52 Å²	52	45 Å²	45	28%	0.278	26%	0.262	S	S	.	.	S	Bend	trans	-109.8	5.7	180	67.9	-11	0	0	0	113.4	Q78 G79 H80 T106 Q110	Q78-D108 WeakPolarHBondContact CA-OD1 3.21Å; Q78-D108 HydrophobicContact CB-CB 4.48Å; Q78-D108 HydrophobicContact CG-CB 4.21Å; G79-D108 PolarHBondContact N-OD1 2.99Å; G79-D108 PolarHBondContact N-OD2 3.29Å; H80-D108 IonicContact ND1-OD2 3.71Å; H80-D108 PolarHBondContact ND1-OD2 3.09Å; T106-D108 PolarHBondContact OG1-N 2.91Å; T106-D108 PolarHBondContact OG1-OD1 2.92Å; D108-Q110 PolarHBondContact O-N 2.94Å; D108-Q110 PolarHBondContact OD1-N 3.15Å; D108-Q110 VanDerWaalsContact OD1-N 3.17Å
109	G	87.8	Confident	91.2	Very high	48 Å²	48	45.1 Å²	45.1	50%	0.495	27%	0.266	S	S	.	.	S	Bend	trans	76.5	3	-178.1	0	0	0	0	0	113.8	T106	T106-G109 VanDerWaalsContact CG2-CA 3.44Å; T106-G109 PolarHBondContact OG1-N 2.98Å; T106-G109 VanDerWaalsContact OG1-N 3.14Å
110	Q	89.1	Confident	91.1	Very high	97 Å²	97	47.7 Å²	47.7	45%	0.453	28%	0.278	S	S	.	.			trans	-115.7	135.7	-178.4	-58.9	-170.7	7.7	0	0	111.6	G79 H80 T106 D108	G79-Q110 PolarHBondContact N-O 3.1Å; H80-Q110 PolarHBondContact CE1-OE1 3.49Å; T106-Q110 WeakPolarHBondContact CB-O 3.33Å; T106-Q110 PolarHBondContact OG1-N 3.49Å; T106-Q110 VanDerWaalsContact OG1-N 3.08Å; T106-Q110 PolarHBondContact OG1-O 2.81Å; D108-Q110 PolarHBondContact O-N 2.94Å; D108-Q110 PolarHBondContact OD1-N 3.15Å; D108-Q110 VanDerWaalsContact OD1-N 3.17Å
111	G	90.5	Very high	90.9	Very high	23 Å²	23	48.5 Å²	48.5	24%	0.237	28%	0.284	C	S	.	.			trans	-85.7	178	166.9	0	0	0	0	0	112.3	F115 T118	G111-F115 WeakPolarHBondContact CA-O 3.32Å; G111-T118 PolarHBondContact N-OG1 3.41Å
112	D	92.7	Very high	90.5	Very high	11 Å²	11	47.9 Å²	47.9	6%	0.059	28%	0.279	C	S	.	.			trans	-118	-170.6	174.3	81.3	-14.1	0	0	0	111	M77 D88 A114 F115 P116	M77-D112 HydrophobicContact CE-CB 3.61Å; M77-D112 VanDerWaalsContact CE-CG 3.47Å; D88-D112 WeakPolarHBondContact CB-OD2 3.19Å; D112-A114 VanDerWaalsContact C-N 3.3Å; D112-A114 PolarHBondContact O-N 3.13Å; D112-A114 WeakPolarHBondContact OD1-CA 3.43Å; D112-A114 WeakPolarHBondContact OD1-CB 3.38Å; D112-A114 PolarHBondContact OD1-N 2.89Å; D112-F115 PolarHBondContact N-O 3.46Å; D112-F115 VanDerWaalsContact N-O 3.07Å; D112-F115 CarbonylContact O-C 3.51Å; D112-F115 PolarHBondContact OD1-N 3.22Å; D112-P116 WeakPolarHBondContact O-CA 3.35Å
113	T	92.4	Very high	89.7	Confident	118 Å²	118	51.2 Å²	51.2	72%	0.724	30%	0.301	S	S	*	.	S	Bend	trans	-68.7	-28	179.5	59.9	0	0	0	0	113.4
114	A	94.8	Very high	88.7	Confident	6 Å²	6	53 Å²	53	5%	0.05	31%	0.313	C	S	.	.	S	Bend	trans	-77.8	-44.6	178	0	0	0	0	0	110.8	D88 P89 K92 D112	D88-A114 HydrophobicContact CB-CB 3.84Å; P89-A114 HydrophobicContact CG-CB 4.2Å; K92-A114 HydrophobicContact CD-CB 4.24Å; K92-A114 VanDerWaalsContact CD-O 3.28Å; K92-A114 WeakPolarHBondContact CD-O 3.38Å; K92-A114 WeakPolarHBondContact CE-O 3.35Å; K92-A114 PolarHBondContact NZ-O 3.15Å; D112-A114 VanDerWaalsContact C-N 3.3Å; D112-A114 PolarHBondContact O-N 3.13Å; D112-A114 WeakPolarHBondContact OD1-CA 3.43Å; D112-A114 WeakPolarHBondContact OD1-CB 3.38Å; D112-A114 PolarHBondContact OD1-N 2.89Å
115	F	95.3	Very high	87.9	Confident	26 Å²	26	53.1 Å²	53.1	11%	0.114	31%	0.314	C	S	.	.			trans	-126.8	80.5	179.3	-57.8	-75	0	0	0	109.6	L75 M77 D88 L91 K92 V102 P104 G111 D112 T118	L75-F115 HydrophobicContact CD2-CD2 3.6Å; L75-F115 HydrophobicContact CD2-CE2 3.64Å; L75-F115 HydrophobicContact CD2-CG 4.4Å; L75-F115 HydrophobicContact CD2-CZ 4.46Å; M77-F115 HydrophobicContact SD-CB 3.92Å; M77-F115 HydrophobicContact SD-CD2 4.38Å; D88-F115 HydrophobicContact CB-CD2 3.83Å; D88-F115 HydrophobicContact CB-CE2 3.85Å; D88-F115 WeakPolarHBondContact O-CE2 3.23Å; L91-F115 HydrophobicContact CG-CZ 4.46Å; K92-F115 HydrophobicContact CB-CE1 4.42Å; K92-F115 HydrophobicContact CB-CE2 4.36Å; K92-F115 HydrophobicContact CB-CZ 3.85Å; K92-F115 HydrophobicContact CG-CZ 4.49Å; V102-F115 HydrophobicContact CB-CE1 4.04Å; V102-F115 HydrophobicContact CB-CZ 4.2Å; V102-F115 HydrophobicContact CG1-CE1 3.8Å; V102-F115 HydrophobicContact CG1-CZ 3.74Å; V102-F115 HydrophobicContact CG2-CZ 4.43Å; P104-F115 HydrophobicContact CB-CB 3.95Å; P104-F115 HydrophobicContact CB-CD1 4.24Å; P104-F115 HydrophobicContact CB-CG 4.05Å; P104-F115 HydrophobicContact CG-CB 4.03Å; P104-F115 HydrophobicContact CG-CD1 4.01Å; P104-F115 HydrophobicContact CG-CG 4.21Å; G111-F115 WeakPolarHBondContact CA-O 3.32Å; D112-F115 PolarHBondContact N-O 3.46Å; D112-F115 VanDerWaalsContact N-O 3.07Å; D112-F115 CarbonylContact O-C 3.51Å; D112-F115 PolarHBondContact OD1-N 3.22Å; F115-T118 HydrophobicContact CB-CG2 4.19Å; F115-T118 WeakPolarHBondContact O-CG2 3.44Å
116	P	91.9	Very high	87.2	Confident	89 Å²	89	53.7 Å²	53.7	58%	0.578	32%	0.318	S	S	*	.			trans	-73	-33.2	179	26.5	-33.4	0	0	0	112.1	D112 T118	D112-P116 WeakPolarHBondContact O-CA 3.35Å; P116-T118 PolarHBondContact O-N 2.89Å
117	E	87.5	Confident	86.3	Confident	128 Å²	128	60.7 Å²	60.7	60%	0.598	35%	0.351	S	S	*	.	S	Bend	trans	-92.5	80.5	-179.3	-62.2	175	-171.9	0	0	110.4	R23	R23-E117 IonicContact CZ-OE2 2.77Å; R23-E117 IonicContact NH1-OE2 3.85Å; R23-E117 PolarHBondContact NH1-OE2 3.32Å; R23-E117 PolarHBondContact NH2-O 3.17Å
118	T	86.8	Confident	85.5	Confident	20 Å²	20	62.7 Å²	62.7	12%	0.123	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-103.6	154.4	178	58.4	0	0	0	0	111.6	M77 P104 T106 G111 F115 P116	M77-T118 HydrophobicContact CE-CG2 4.29Å; M77-T118 HydrophobicContact CG-CG2 4.42Å; M77-T118 HydrophobicContact SD-CG2 3.63Å; P104-T118 HydrophobicContact CB-CG2 3.99Å; P104-T118 HydrophobicContact CG-CG2 4.24Å; T106-T118 WeakPolarHBondContact CB-OG1 3.35Å; T106-T118 WeakPolarHBondContact CG2-OG1 3.22Å; G111-T118 PolarHBondContact N-OG1 3.41Å; F115-T118 HydrophobicContact CB-CG2 4.19Å; F115-T118 WeakPolarHBondContact O-CG2 3.44Å; P116-T118 PolarHBondContact O-N 2.89Å
119	L	86	Confident	84.8	Confident	57 Å²	57	61.5 Å²	61.5	30%	0.298	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.9	172	-68.8	172.9	0	0	0	109.9	F103 P104 Y105 T106 V121	F103-L119 HydrophobicContact CE1-CD1 4.12Å; F103-L119 HydrophobicContact CE2-CD1 4.47Å; F103-L119 HydrophobicContact CZ-CD1 3.59Å; P104-L119 PolarHBondContact O-N 2.84Å; Y105-L119 CarbonylContact C-O 3.54Å; Y105-L119 WeakPolarHBondContact CA-O 3.27Å; Y105-L119 HydrophobicContact CD1-CB 4.25Å; Y105-L119 HydrophobicContact CE1-CB 4.3Å; T106-L119 WeakPolarHBondContact CG2-O 3.27Å; T106-L119 PolarHBondContact N-O 3.19Å; L119-V121 PolarHBondContact O-N 3.06Å
120	P	87.6	Confident	83.9	Confident	81 Å²	81	60 Å²	60	53%	0.526	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	134.7	168.4	-23.5	33.7	0	0	0	110.2	T106 P122	T106-P120 WeakPolarHBondContact O-CA 3.42Å; P120-P122 WeakPolarHBondContact O-CD 3.12Å
121	V	86.2	Confident	82.3	Confident	25 Å²	25	59.2 Å²	59.2	15%	0.152	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-72.1	121.6	-176	-166	0	0	0	0	111.1	F76 Y105 T106 L107 L119 V125 M126	F76-V121 HydrophobicContact CD1-CG1 4.25Å; F76-V121 HydrophobicContact CD1-CG2 3.98Å; F76-V121 HydrophobicContact CE1-CG1 3.66Å; F76-V121 HydrophobicContact CE1-CG2 4.18Å; Y105-V121 HydrophobicContact CD1-CB 4.31Å; Y105-V121 HydrophobicContact CD1-CG1 4.32Å; Y105-V121 HydrophobicContact CD1-CG2 4.01Å; Y105-V121 HydrophobicContact CG-CG1 4.35Å; Y105-V121 HydrophobicContact CG-CG2 3.96Å; T106-V121 VanDerWaalsContact O-CG2 3.26Å; T106-V121 WeakPolarHBondContact O-CG2 3.33Å; T106-V121 PolarHBondContact O-N 3.12Å; T106-V121 VanDerWaalsContact O-N 3.13Å; L107-V121 HydrophobicContact CD2-CB 4.22Å; L107-V121 HydrophobicContact CD2-CG2 3.68Å; L107-V121 HydrophobicContact CG-CG2 4.45Å; L119-V121 PolarHBondContact O-N 3.06Å; V121-V125 HydrophobicContact CG1-CB 3.89Å; V121-V125 HydrophobicContact CG1-CG1 3.72Å; V121-M126 HydrophobicContact CB-CG 4.26Å; V121-M126 HydrophobicContact CB-SD 4.2Å; V121-M126 HydrophobicContact CG1-CG 3.69Å; V121-M126 HydrophobicContact CG1-SD 3.71Å
122	P	82.2	Confident	80.7	Confident	36 Å²	36	63 Å²	63	23%	0.234	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-65.4	149.3	172.5	-23.6	36.7	0	0	0	112.6	P120 D124 V125 M126	P120-P122 WeakPolarHBondContact O-CD 3.12Å; P122-D124 VanDerWaalsContact C-N 3.29Å; P122-D124 WeakPolarHBondContact CB-OD1 3.45Å; P122-D124 PolarHBondContact O-N 2.92Å; P122-V125 HydrophobicContact CB-CB 4.44Å; P122-V125 HydrophobicContact CB-CG2 4.08Å; P122-V125 HydrophobicContact CG-CG2 4.04Å; P122-V125 WeakPolarHBondContact O-CB 3.18Å; P122-V125 PolarHBondContact O-N 2.99Å; P122-V125 VanDerWaalsContact O-N 3.13Å; P122-M126 PolarHBondContact O-N 3.12Å
123	P	78.1	Confident	78.8	Confident	99 Å²	99	65.1 Å²	65.1	64%	0.643	37%	0.366	S	S	*	.	H	α-helix	trans	-58.5	-34.2	179.4	-26.1	34.9	0	0	0	114.8	M126 Q127	P123-M126 WeakPolarHBondContact O-CB 3.42Å; P123-M126 PolarHBondContact O-N 2.92Å; P123-Q127 WeakPolarHBondContact O-CG 3.36Å; P123-Q127 PolarHBondContact O-N 2.9Å
124	D	74.6	Confident	77.2	Confident	97 Å²	97	64.3 Å²	64.3	52%	0.519	36%	0.363	S	S	.	.	H	α-helix	trans	-68.7	-36.4	176.6	58.2	-59.3	0	0	0	112.3	P122 Q127 T128	P122-D124 VanDerWaalsContact C-N 3.29Å; P122-D124 WeakPolarHBondContact CB-OD1 3.45Å; P122-D124 PolarHBondContact O-N 2.92Å; D124-Q127 PolarHBondContact O-N 3.42Å; D124-T128 WeakPolarHBondContact O-CB 3.48Å; D124-T128 PolarHBondContact O-N 2.91Å; D124-T128 PolarHBondContact O-OG1 3.48Å
125	V	78.5	Confident	76.3	Confident	14 Å²	14	67.6 Å²	67.6	9%	0.085	38%	0.382	C	S	.	.	H	α-helix	trans	-66	-42	171.7	176.2	0	0	0	0	110	F76 Y105 V121 P122 Q127 T128 F129	F76-V125 HydrophobicContact CE1-CG1 3.92Å; F76-V125 HydrophobicContact CZ-CG1 3.85Å; Y105-V125 HydrophobicContact CD2-CG1 4.03Å; Y105-V125 HydrophobicContact CE2-CG1 3.6Å; V121-V125 HydrophobicContact CG1-CB 3.89Å; V121-V125 HydrophobicContact CG1-CG1 3.72Å; P122-V125 HydrophobicContact CB-CB 4.44Å; P122-V125 HydrophobicContact CB-CG2 4.08Å; P122-V125 HydrophobicContact CG-CG2 4.04Å; P122-V125 WeakPolarHBondContact O-CB 3.18Å; P122-V125 PolarHBondContact O-N 2.99Å; P122-V125 VanDerWaalsContact O-N 3.13Å; V125-Q127 VanDerWaalsContact C-N 3.33Å; V125-Q127 PolarHBondContact O-N 2.97Å; V125-T128 PolarHBondContact O-N 3.28Å; V125-F129 HydrophobicContact CG1-CD2 3.65Å; V125-F129 HydrophobicContact CG1-CE2 3.96Å; V125-F129 WeakPolarHBondContact O-CD2 3.06Å; V125-F129 PolarHBondContact O-N 3.05Å
126	M	79.5	Confident	75.5	Confident	46 Å²	46	68 Å²	68	23%	0.227	39%	0.391	C	S	.	.	H	α-helix	trans	-57.9	-44.9	174	-73.6	-61.3	-66.2	0	0	112	L107 V121 P122 P123 T128 F130 V135	L107-M126 HydrophobicContact CD2-CE 3.95Å; L107-M126 HydrophobicContact CD2-SD 3.41Å; L107-M126 WeakPolarHBondContact CD2-SD 3.48Å; V121-M126 HydrophobicContact CB-CG 4.26Å; V121-M126 HydrophobicContact CB-SD 4.2Å; V121-M126 HydrophobicContact CG1-CG 3.69Å; V121-M126 HydrophobicContact CG1-SD 3.71Å; P122-M126 PolarHBondContact O-N 3.12Å; P123-M126 WeakPolarHBondContact O-CB 3.42Å; P123-M126 PolarHBondContact O-N 2.92Å; M126-T128 VanDerWaalsContact C-N 3.33Å; M126-T128 PolarHBondContact O-N 2.67Å; M126-F130 HydrophobicContact CE-CD2 3.93Å; M126-F130 HydrophobicContact CE-CE2 4.43Å; M126-F130 HydrophobicContact CE-CG 4.43Å; M126-F130 CarbonylContact O-C 3.6Å; M126-F130 WeakPolarHBondContact O-CA 3.22Å; M126-F130 WeakPolarHBondContact O-CB 3.36Å; M126-F130 PolarHBondContact O-N 3.01Å; M126-F130 HydrophobicContact SD-CD2 3.87Å; M126-F130 HydrophobicContact SD-CE2 4.06Å; M126-V135 HydrophobicContact CE-CB 4.35Å; M126-V135 HydrophobicContact CE-CG1 3.81Å; M126-V135 HydrophobicContact CE-CG2 3.54Å
127	Q	72.3	Confident	75	Confident	147 Å²	147	64.6 Å²	64.6	69%	0.687	37%	0.368	S	S	*	.	H	α-helix	trans	-64.8	-36.8	177.2	-72	176.4	8	0	0	112.8	P123 D124 V125 P131	P123-Q127 WeakPolarHBondContact O-CG 3.36Å; P123-Q127 PolarHBondContact O-N 2.9Å; D124-Q127 PolarHBondContact O-N 3.42Å; V125-Q127 VanDerWaalsContact C-N 3.33Å; V125-Q127 PolarHBondContact O-N 2.97Å; Q127-P131 WeakPolarHBondContact O-CB 3.34Å; Q127-P131 WeakPolarHBondContact O-CD 3.46Å
128	T	71.8	Confident	75	Confident	97 Å²	97	58.5 Å²	58.5	60%	0.595	34%	0.34	S	S	*	.	H	α-helix	trans	-72.6	-43	-177.8	-57.3	0	0	0	0	112	D124 V125 M126	D124-T128 WeakPolarHBondContact O-CB 3.48Å; D124-T128 PolarHBondContact O-N 2.91Å; D124-T128 PolarHBondContact O-OG1 3.48Å; V125-T128 PolarHBondContact O-N 3.28Å; M126-T128 VanDerWaalsContact C-N 3.33Å; M126-T128 PolarHBondContact O-N 2.67Å
129	F	74.9	Confident	75	Confident	27 Å²	27	57.8 Å²	57.8	12%	0.118	34%	0.335	C	S	.	.	H	α-helix	trans	-92.6	-26.7	-174.7	-74.6	-91.2	0	0	0	113.4	V74 F76 V125 F141 V143 A150	V74-F129 HydrophobicContact CB-CE1 4.26Å; V74-F129 HydrophobicContact CB-CZ 4.49Å; V74-F129 HydrophobicContact CG1-CE1 4.29Å; V74-F129 HydrophobicContact CG1-CZ 4.34Å; V74-F129 HydrophobicContact CG2-CE1 4.37Å; V74-F129 HydrophobicContact CG2-CZ 4.21Å; F76-F129 HydrophobicContact CE2-CB 3.78Å; F76-F129 AromaticContact CE2-CD1 3.8Å; F76-F129 HydrophobicContact CE2-CD1 3.8Å; F76-F129 HydrophobicContact CE2-CD2 4.39Å; F76-F129 HydrophobicContact CE2-CE1 4.46Å; F76-F129 AromaticContact CE2-CG 3.73Å; F76-F129 HydrophobicContact CE2-CG 3.73Å; F76-F129 HydrophobicContact CZ-CB 3.63Å; F76-F129 HydrophobicContact CZ-CD1 4.09Å; F76-F129 AromaticContact CZ-CD2 3.84Å; F76-F129 HydrophobicContact CZ-CD2 3.84Å; F76-F129 AromaticContact CZ-CG 3.58Å; F76-F129 HydrophobicContact CZ-CG 3.58Å; V125-F129 HydrophobicContact CG1-CD2 3.65Å; V125-F129 HydrophobicContact CG1-CE2 3.96Å; V125-F129 WeakPolarHBondContact O-CD2 3.06Å; V125-F129 PolarHBondContact O-N 3.05Å; F129-F141 HydrophobicContact CB-CE2 4.03Å; F129-F141 HydrophobicContact CB-CZ 4.06Å; F129-F141 HydrophobicContact CD1-CB 3.9Å; F129-F141 AromaticContact CD1-CD1 3.74Å; F129-F141 HydrophobicContact CD1-CD1 3.74Å; F129-F141 AromaticContact CD1-CD2 3.56Å; F129-F141 HydrophobicContact CD1-CD2 3.56Å; F129-F141 HydrophobicContact CD1-CE1 4.1Å; F129-F141 AromaticContact CD1-CE2 3.91Å; F129-F141 HydrophobicContact CD1-CE2 3.91Å; F129-F141 AromaticContact CD1-CG 3.47Å; F129-F141 HydrophobicContact CD1-CG 3.47Å; F129-F141 VanDerWaalsContact CD1-CG 3.47Å; F129-F141 HydrophobicContact CD1-CZ 4.19Å; F129-F141 HydrophobicContact CE1-CB 3.76Å; F129-F141 HydrophobicContact CE1-CD1 4.32Å; F129-F141 HydrophobicContact CE1-CD2 4.24Å; F129-F141 AromaticContact CE1-CG 3.89Å; F129-F141 HydrophobicContact CE1-CG 3.89Å; F129-F141 HydrophobicContact CG-CD2 4.45Å; F129-F141 HydrophobicContact CG-CE2 4.45Å; F129-F141 WeakPolarHBondContact O-CZ 3.46Å; F129-V143 HydrophobicContact CE1-CG2 3.92Å; F129-V143 HydrophobicContact CZ-CG2 3.96Å; F129-A150 HydrophobicContact CD1-CB 4.32Å; F129-A150 HydrophobicContact CE1-CB 3.66Å; F129-A150 HydrophobicContact CZ-CB 4.1Å
130	F	69.9	Low	75.1	Confident	17 Å²	17	55.1 Å²	55.1	8%	0.075	32%	0.321	C	S	.	.			trans	-124.7	47.8	179.9	-54.8	-89.1	0	0	0	113.2	F76 M126 N132 I133 V135 T139 F141	F76-F130 HydrophobicContact CB-CE2 4.35Å; F76-F130 HydrophobicContact CB-CZ 3.91Å; F76-F130 AromaticContact CD1-CE2 3.55Å; F76-F130 HydrophobicContact CD1-CE2 3.55Å; F76-F130 AromaticContact CD1-CZ 3.98Å; F76-F130 HydrophobicContact CD1-CZ 3.98Å; F76-F130 AromaticContact CD2-CE2 3.71Å; F76-F130 HydrophobicContact CD2-CE2 3.71Å; F76-F130 AromaticContact CD2-CZ 3.6Å; F76-F130 HydrophobicContact CD2-CZ 3.6Å; F76-F130 AromaticContact CE1-CE2 3.64Å; F76-F130 HydrophobicContact CE1-CE2 3.64Å; F76-F130 HydrophobicContact CE1-CZ 4.43Å; F76-F130 AromaticContact CE2-CE2 3.78Å; F76-F130 HydrophobicContact CE2-CE2 3.78Å; F76-F130 HydrophobicContact CE2-CZ 4.07Å; F76-F130 AromaticContact CG-CE2 3.59Å; F76-F130 HydrophobicContact CG-CE2 3.59Å; F76-F130 AromaticContact CG-CZ 3.54Å; F76-F130 HydrophobicContact CG-CZ 3.54Å; F76-F130 AromaticContact CZ-CE2 3.75Å; F76-F130 HydrophobicContact CZ-CE2 3.75Å; F76-F130 HydrophobicContact CZ-CZ 4.47Å; M126-F130 HydrophobicContact CE-CD2 3.93Å; M126-F130 HydrophobicContact CE-CE2 4.43Å; M126-F130 HydrophobicContact CE-CG 4.43Å; M126-F130 CarbonylContact O-C 3.6Å; M126-F130 WeakPolarHBondContact O-CA 3.22Å; M126-F130 WeakPolarHBondContact O-CB 3.36Å; M126-F130 PolarHBondContact O-N 3.01Å; M126-F130 HydrophobicContact SD-CD2 3.87Å; M126-F130 HydrophobicContact SD-CE2 4.06Å; F130-N132 PolarHBondContact O-N 3.24Å; F130-I133 HydrophobicContact CD1-CB 4.34Å; F130-I133 HydrophobicContact CD1-CG2 4.45Å; F130-V135 HydrophobicContact CB-CG2 3.94Å; F130-V135 HydrophobicContact CD1-CG2 4.04Å; F130-V135 HydrophobicContact CG-CG2 3.95Å; F130-T139 HydrophobicContact CE1-CG2 4.01Å; F130-T139 HydrophobicContact CZ-CG2 4.25Å; F130-F141 HydrophobicContact CE1-CE2 4.27Å; F130-F141 HydrophobicContact CE1-CZ 4.46Å; F130-F141 HydrophobicContact CZ-CE2 4.05Å
131	P	55.9	Low	75.1	Confident	80 Å²	80	51.5 Å²	51.5	52%	0.519	30%	0.297	S	S	.	.	S	Bend	trans	-60.6	-37.5	-179.8	23.8	-31.7	0	0	0	111.6	Q127	Q127-P131 WeakPolarHBondContact O-CB 3.34Å; Q127-P131 WeakPolarHBondContact O-CD 3.46Å
132	N	55.9	Low	75.1	Confident	101 Å²	101	50.4 Å²	50.4	54%	0.54	29%	0.29	S	S	.	.	S	Bend	trans	-144.4	12.1	-177.5	-63.4	-49.2	0	0	0	113.4	F130 T546	F130-N132 PolarHBondContact O-N 3.24Å; N132-T546 PolarHBondContact ND2-O 2.83Å
133	I	52.5	Low	75.3	Confident	57 Å²	57	49.5 Å²	49.5	29%	0.292	28%	0.284	S	S	.	.	S	Bend	trans	-98.1	130.3	177.8	-59.7	175	0	0	0	107.6	F130 V135 F141 P152	F130-I133 HydrophobicContact CD1-CB 4.34Å; F130-I133 HydrophobicContact CD1-CG2 4.45Å; I133-V135 PolarHBondContact O-N 3.22Å; I133-F141 HydrophobicContact CD1-CE1 4.36Å; I133-F141 HydrophobicContact CD1-CZ 4.36Å; I133-P152 HydrophobicContact CD1-CG 4.45Å
134	P	59.5	Low	75.6	Confident	100 Å²	100	45.2 Å²	45.2	65%	0.649	26%	0.256	S	S	*	.			trans	-52.5	125.5	173.3	-25.5	33.9	0	0	0	110.6	A136 Q155	P134-A136 PolarHBondContact O-N 3.44Å; P134-A136 VanDerWaalsContact O-N 3.08Å; P134-Q155 PolarHBondContact O-NE2 2.97Å
135	V	75.3	Confident	76.1	Confident	75 Å²	75	43.4 Å²	43.4	46%	0.455	25%	0.248	S	C	.	.			trans	-68.8	109	176.6	-177.6	0	0	0	0	108	L107 M126 F130 I133	L107-V135 HydrophobicContact CD1-CG1 3.45Å; L107-V135 VanDerWaalsContact CD1-CG1 3.45Å; L107-V135 HydrophobicContact CD2-CG1 4.46Å; M126-V135 HydrophobicContact CE-CB 4.35Å; M126-V135 HydrophobicContact CE-CG1 3.81Å; M126-V135 HydrophobicContact CE-CG2 3.54Å; F130-V135 HydrophobicContact CB-CG2 3.94Å; F130-V135 HydrophobicContact CD1-CG2 4.04Å; F130-V135 HydrophobicContact CG-CG2 3.95Å; I133-V135 PolarHBondContact O-N 3.22Å
136	A	78.7	Confident	76.3	Confident	35 Å²	35	47.4 Å²	47.4	29%	0.289	27%	0.269	S	S	.	.			trans	-139	161.1	170.4	0	0	0	0	0	109.9	P134 T139 Q155	P134-A136 PolarHBondContact O-N 3.44Å; P134-A136 VanDerWaalsContact O-N 3.08Å; A136-T139 WeakPolarHBondContact O-CB 3.44Å; A136-T139 PolarHBondContact O-OG1 3.41Å; A136-Q155 HydrophobicContact CB-CG 4.22Å
137	T	80.5	Confident	76.3	Confident	17 Å²	17	48.9 Å²	48.9	10%	0.104	28%	0.281	C	S	.	.	S	Bend	trans	-128.3	142.6	-175	52.6	0	0	0	0	110.3	Q78 C81 C84 L107	Q78-T137 HydrophobicContact CG-CG2 4.12Å; Q78-T137 PolarHBondContact OE1-OG1 3.33Å; C81-T137 VanDerWaalsContact SG-C 3.58Å; C81-T137 PolarHBondContact SG-O 3.43Å; C81-T137 VanDerWaalsContact SG-O 3.35Å; C81-T137 PolarHBondContact SG-OG1 3.18Å; C81-T137 VanDerWaalsContact SG-OG1 3.42Å; C84-T137 VanDerWaalsContact SG-CB 3.58Å; L107-T137 HydrophobicContact CD1-CG2 3.46Å; L107-T137 VanDerWaalsContact CD1-CG2 3.46Å; L107-T137 HydrophobicContact CG-CG2 4.27Å
138	P	87.7	Confident	76.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.283	C	S	.	.	S	Bend	cis	-74.6	144.2	-4.7	31.8	-33.5	0	0	0	111.3	L75 F76 C84 F87 Q155 G156	L75-P138 HydrophobicContact CD1-CB 3.92Å; F76-P138 CarbonylContact O-C 3.57Å; F76-P138 VanDerWaalsContact O-CA 3.3Å; F76-P138 WeakPolarHBondContact O-CA 3.37Å; C84-P138 VanDerWaalsContact SG-N 3.4Å; F87-P138 HydrophobicContact CB-CG 3.98Å; F87-P138 HydrophobicContact CD1-CB 3.81Å; F87-P138 HydrophobicContact CD1-CG 3.65Å; F87-P138 HydrophobicContact CE1-CB 4.46Å; F87-P138 HydrophobicContact CG-CG 4.12Å; P138-Q155 WeakPolarHBondContact O-CA 3.4Å; P138-G156 PolarHBondContact O-N 3.31Å
139	T	86.5	Confident	76.7	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.6	168.2	-64.3	0	0	0	0	109.6	L75 F76 F130 A136 F141 L154 Q155	L75-T139 CarbonylContact C-O 3.55Å; F76-T139 PolarHBondContact N-O 3.39Å; F76-T139 PolarHBondContact O-N 2.9Å; F130-T139 HydrophobicContact CE1-CG2 4.01Å; F130-T139 HydrophobicContact CZ-CG2 4.25Å; A136-T139 WeakPolarHBondContact O-CB 3.44Å; A136-T139 PolarHBondContact O-OG1 3.41Å; T139-F141 HydrophobicContact CG2-CD2 4.12Å; T139-F141 HydrophobicContact CG2-CE2 3.46Å; T139-F141 VanDerWaalsContact CG2-CE2 3.46Å; T139-F141 HydrophobicContact CG2-CZ 4.05Å; T139-L154 CarbonylContact C-O 3.4Å; T139-L154 WeakPolarHBondContact CA-O 3.36Å; T139-Q155 HydrophobicContact CG2-CB 4.41Å; T139-Q155 WeakPolarHBondContact OG1-CG 3.25Å; T139-Q155 PolarHBondContact OG1-NE2 2.67Å
140	T	88.8	Confident	76.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.3	-179	53.9	0	0	0	0	111.9	V73 V74 L75 F87 L91 L153 L154 F163	V73-T140 HydrophobicContact CG1-CG2 4.02Å; V74-T140 CarbonylContact O-C 3.54Å; V74-T140 VanDerWaalsContact O-CA 3.25Å; V74-T140 WeakPolarHBondContact O-CA 3.43Å; L75-T140 HydrophobicContact CB-CG2 4.49Å; L75-T140 HydrophobicContact CD1-CG2 3.76Å; F87-T140 HydrophobicContact CE1-CG2 3.72Å; F87-T140 HydrophobicContact CZ-CG2 4.17Å; L91-T140 HydrophobicContact CD2-CG2 4.06Å; T140-L153 WeakPolarHBondContact O-CA 3.4Å; T140-L153 WeakPolarHBondContact O-CB 3.43Å; T140-L153 PolarHBondContact O-N 2.99Å; T140-L153 WeakPolarHBondContact OG1-CB 3.21Å; T140-L154 PolarHBondContact N-O 2.77Å; T140-L154 PolarHBondContact O-N 3.13Å; T140-L154 PolarHBondContact OG1-N 2.55Å; T140-L154 PolarHBondContact OG1-O 3.12Å; T140-F163 HydrophobicContact CG2-CE2 4.25Å
141	F	87.1	Confident	77.2	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.1	172.6	-65.5	-101.2	0	0	0	109.7	V73 V74 F76 F129 F130 I133 T139 L151 P152	V73-F141 CarbonylContact C-O 3.56Å; V73-F141 VanDerWaalsContact CA-O 3.3Å; V73-F141 WeakPolarHBondContact CA-O 3.36Å; V74-F141 HydrophobicContact CB-CB 4.45Å; V74-F141 PolarHBondContact N-O 3.31Å; V74-F141 PolarHBondContact O-N 3.28Å; F76-F141 AromaticContact CD2-CD2 3.86Å; F76-F141 HydrophobicContact CD2-CD2 3.86Å; F76-F141 AromaticContact CD2-CE2 3.84Å; F76-F141 HydrophobicContact CD2-CE2 3.84Å; F76-F141 AromaticContact CE2-CD2 3.62Å; F76-F141 HydrophobicContact CE2-CD2 3.62Å; F76-F141 AromaticContact CE2-CE2 3.71Å; F76-F141 HydrophobicContact CE2-CE2 3.71Å; F129-F141 HydrophobicContact CB-CE2 4.03Å; F129-F141 HydrophobicContact CB-CZ 4.06Å; F129-F141 HydrophobicContact CD1-CB 3.9Å; F129-F141 AromaticContact CD1-CD1 3.74Å; F129-F141 HydrophobicContact CD1-CD1 3.74Å; F129-F141 AromaticContact CD1-CD2 3.56Å; F129-F141 HydrophobicContact CD1-CD2 3.56Å; F129-F141 HydrophobicContact CD1-CE1 4.1Å; F129-F141 AromaticContact CD1-CE2 3.91Å; F129-F141 HydrophobicContact CD1-CE2 3.91Å; F129-F141 AromaticContact CD1-CG 3.47Å; F129-F141 HydrophobicContact CD1-CG 3.47Å; F129-F141 VanDerWaalsContact CD1-CG 3.47Å; F129-F141 HydrophobicContact CD1-CZ 4.19Å; F129-F141 HydrophobicContact CE1-CB 3.76Å; F129-F141 HydrophobicContact CE1-CD1 4.32Å; F129-F141 HydrophobicContact CE1-CD2 4.24Å; F129-F141 AromaticContact CE1-CG 3.89Å; F129-F141 HydrophobicContact CE1-CG 3.89Å; F129-F141 HydrophobicContact CG-CD2 4.45Å; F129-F141 HydrophobicContact CG-CE2 4.45Å; F129-F141 WeakPolarHBondContact O-CZ 3.46Å; F130-F141 HydrophobicContact CE1-CE2 4.27Å; F130-F141 HydrophobicContact CE1-CZ 4.46Å; F130-F141 HydrophobicContact CZ-CE2 4.05Å; I133-F141 HydrophobicContact CD1-CE1 4.36Å; I133-F141 HydrophobicContact CD1-CZ 4.36Å; T139-F141 HydrophobicContact CG2-CD2 4.12Å; T139-F141 HydrophobicContact CG2-CE2 3.46Å; T139-F141 VanDerWaalsContact CG2-CE2 3.46Å; T139-F141 HydrophobicContact CG2-CZ 4.05Å; F141-L151 CarbonylContact C-O 3.55Å; F141-L151 VanDerWaalsContact CA-O 3.3Å; F141-L151 WeakPolarHBondContact CA-O 3.29Å; F141-P152 HydrophobicContact CD1-CB 4.17Å; F141-P152 HydrophobicContact CD1-CG 4.17Å; F141-P152 HydrophobicContact CE1-CB 4.05Å; F141-P152 HydrophobicContact CE1-CG 3.93Å
142	L	87.5	Confident	78.2	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.1	171.5	-167.1	60.9	0	0	0	109.1	W71 V73 L151 L153 M167 V170 L171	W71-L142 HydrophobicContact CB-CD1 3.84Å; W71-L142 HydrophobicContact CB-CG 4.47Å; W71-L142 HydrophobicContact CD2-CD1 4.45Å; W71-L142 HydrophobicContact CD2-CD2 4.13Å; W71-L142 HydrophobicContact CD2-CG 4.14Å; W71-L142 HydrophobicContact CE3-CD1 4.14Å; W71-L142 HydrophobicContact CE3-CD2 3.76Å; W71-L142 HydrophobicContact CE3-CG 3.49Å; W71-L142 VanDerWaalsContact CE3-CG 3.49Å; W71-L142 HydrophobicContact CG-CD1 4.38Å; W71-L142 HydrophobicContact CZ3-CD2 4Å; W71-L142 HydrophobicContact CZ3-CG 3.97Å; V73-L142 HydrophobicContact CG2-CD1 4.12Å; L142-L151 HydrophobicContact CB-CB 4.4Å; L142-L151 PolarHBondContact N-O 2.79Å; L142-L151 PolarHBondContact O-N 3.48Å; L142-L153 HydrophobicContact CB-CD1 3.68Å; L142-L153 HydrophobicContact CB-CD2 4Å; L142-L153 HydrophobicContact CB-CG 3.67Å; L142-L153 HydrophobicContact CD1-CD1 4.24Å; L142-L153 HydrophobicContact CD2-CD2 4.46Å; L142-L153 HydrophobicContact CG-CD1 4.47Å; L142-M167 HydrophobicContact CD1-CE 4.18Å; L142-M167 HydrophobicContact CD1-SD 3.45Å; L142-M167 WeakPolarHBondContact CD1-SD 3.47Å; L142-M167 HydrophobicContact CD2-SD 3.69Å; L142-M167 HydrophobicContact CG-SD 4.11Å; L142-V170 HydrophobicContact CD2-CG1 4.12Å; L142-L171 HydrophobicContact CD2-CD1 4.37Å; L142-L171 HydrophobicContact CD2-CD2 3.57Å; L142-L171 HydrophobicContact CD2-CG 3.68Å
143	V	85.5	Confident	79.3	Confident	17 Å²	17	41.9 Å²	41.9	10%	0.103	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.3	179.8	-178.1	0	0	0	0	109.8	W71 K72 V74 F129 E149 A150	W71-V143 CarbonylContact C-O 3.58Å; W71-V143 WeakPolarHBondContact CA-O 3.49Å; K72-V143 PolarHBondContact N-O 3.19Å; K72-V143 PolarHBondContact O-N 2.89Å; V74-V143 HydrophobicContact CB-CG2 4.39Å; V74-V143 HydrophobicContact CG2-CB 4.35Å; V74-V143 HydrophobicContact CG2-CG2 3.54Å; F129-V143 HydrophobicContact CE1-CG2 3.92Å; F129-V143 HydrophobicContact CZ-CG2 3.96Å; V143-E149 VanDerWaalsContact CA-O 3.28Å; V143-E149 WeakPolarHBondContact CA-O 3.37Å; V143-A150 HydrophobicContact CG2-CB 3.91Å
144	N	84	Confident	80.7	Confident	10 Å²	10	41 Å²	41	5%	0.053	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.7	172.3	-170.3	-66.6	0	0	0	109.7	D70 W71 N146 T147 L148 E149	D70-N144 WeakPolarHBondContact O-CA 2.92Å; W71-N144 HydrophobicContact CD2-CB 4.5Å; W71-N144 HydrophobicContact CE3-CB 3.81Å; W71-N144 HydrophobicContact CH2-CB 3.98Å; W71-N144 WeakPolarHBondContact CZ2-ND2 3.43Å; W71-N144 HydrophobicContact CZ3-CB 3.56Å; N144-N146 PolarHBondContact O-N 3.36Å; N144-N146 WeakPolarHBondContact OD1-CB 3.49Å; N144-N146 PolarHBondContact OD1-N 2.89Å; N144-T147 VanDerWaalsContact CB-OG1 3.28Å; N144-T147 WeakPolarHBondContact CB-OG1 3.31Å; N144-T147 PolarHBondContact O-N 3.23Å; N144-T147 PolarHBondContact OD1-N 2.78Å; N144-L148 VanDerWaalsContact O-CA 3.24Å; N144-L148 WeakPolarHBondContact O-CA 3.32Å; N144-L148 PolarHBondContact O-N 2.78Å; N144-E149 PolarHBondContact N-O 3.34Å
145	V	85.2	Confident	81.6	Confident	59 Å²	59	40.5 Å²	40.5	36%	0.358	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-19.8	-174.2	-54.7	0	0	0	0	113.1	D70 K72	D70-V145 WeakPolarHBondContact O-CG2 3.39Å; D70-V145 PolarHBondContact O-N 3.43Å; K72-V145 HydrophobicContact CB-CG1 4.02Å
146	N	83.3	Confident	81.9	Confident	97 Å²	97	38 Å²	38	52%	0.519	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-30.3	-178.8	-58.2	-63.5	0	0	0	112.2	D70 N144	D70-N146 PolarHBondContact OD1-ND2 3.08Å; N144-N146 PolarHBondContact O-N 3.36Å; N144-N146 WeakPolarHBondContact OD1-CB 3.49Å; N144-N146 PolarHBondContact OD1-N 2.89Å
147	T	79.8	Confident	82	Confident	77 Å²	77	38.1 Å²	38.1	47%	0.472	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-11.2	-177.3	62.9	0	0	0	0	113.9	N144 E149 Y174	N144-T147 VanDerWaalsContact CB-OG1 3.28Å; N144-T147 WeakPolarHBondContact CB-OG1 3.31Å; N144-T147 PolarHBondContact O-N 3.23Å; N144-T147 PolarHBondContact OD1-N 2.78Å; T147-E149 PolarHBondContact O-N 2.94Å; T147-E149 VanDerWaalsContact O-N 3.13Å; T147-E149 WeakPolarHBondContact OG1-CB 3.31Å; T147-Y174 PolarHBondContact OG1-OH 3.05Å
148	L	77.5	Confident	81.7	Confident	139 Å²	139	39 Å²	39	73%	0.728	23%	0.229	S	C	*	.			trans	57.5	15	-171.9	-56.8	176	0	0	0	114.3	N144	N144-L148 VanDerWaalsContact O-CA 3.24Å; N144-L148 WeakPolarHBondContact O-CA 3.32Å; N144-L148 PolarHBondContact O-N 2.78Å
149	E	74.1	Confident	81.3	Confident	42 Å²	42	44 Å²	44	20%	0.196	26%	0.256	C	S	.	.			trans	-73.6	130.4	176.8	-171.7	172.1	169.4	0	0	110.6	V143 N144 T147 R387	V143-E149 VanDerWaalsContact CA-O 3.28Å; V143-E149 WeakPolarHBondContact CA-O 3.37Å; N144-E149 PolarHBondContact N-O 3.34Å; T147-E149 PolarHBondContact O-N 2.94Å; T147-E149 VanDerWaalsContact O-N 3.13Å; T147-E149 WeakPolarHBondContact OG1-CB 3.31Å; E149-R387 IonicContact OE1-CZ 3.83Å; E149-R387 IonicContact OE1-NE 2.95Å; E149-R387 IonicContact OE1-NH1 2.81Å; E149-R387 PolarHBondContact OE1-NH1 3.14Å; E149-R387 IonicContact OE1-NH2 3.56Å; E149-R387 IonicContact OE2-CZ 2.91Å; E149-R387 IonicContact OE2-NH1 3.24Å; E149-R387 PolarHBondContact OE2-NH1 2.76Å; E149-R387 IonicContact OE2-NH2 2.7Å
150	A	77.7	Confident	81.1	Confident	39 Å²	39	45.6 Å²	45.6	32%	0.322	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.7	-177.7	0	0	0	0	0	111.6	F129 V143	F129-A150 HydrophobicContact CD1-CB 4.32Å; F129-A150 HydrophobicContact CE1-CB 3.66Å; F129-A150 HydrophobicContact CZ-CB 4.1Å; V143-A150 HydrophobicContact CG2-CB 3.91Å
151	L	77.6	Confident	80.5	Confident	31 Å²	31	47.5 Å²	47.5	16%	0.162	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.4	-178.7	-56.3	172	0	0	0	109.5	W71 F141 L142 L153 V170 Y174	W71-L151 HydrophobicContact CH2-CD1 4.22Å; W71-L151 HydrophobicContact CZ3-CD1 4.1Å; F141-L151 CarbonylContact C-O 3.55Å; F141-L151 VanDerWaalsContact CA-O 3.3Å; F141-L151 WeakPolarHBondContact CA-O 3.29Å; L142-L151 HydrophobicContact CB-CB 4.4Å; L142-L151 PolarHBondContact N-O 2.79Å; L142-L151 PolarHBondContact O-N 3.48Å; L151-L153 PolarHBondContact O-N 2.85Å; L151-V170 HydrophobicContact CB-CG1 3.65Å; L151-V170 HydrophobicContact CD1-CG1 3.63Å; L151-V170 HydrophobicContact CG-CG1 4.28Å; L151-Y174 HydrophobicContact CD1-CD2 3.79Å; L151-Y174 HydrophobicContact CD1-CG 4.29Å
152	P	77.8	Confident	80	Confident	68 Å²	68	48.4 Å²	48.4	44%	0.442	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	126.1	175.3	-21.4	31.2	0	0	0	111.5	I133 F141	I133-P152 HydrophobicContact CD1-CG 4.45Å; F141-P152 HydrophobicContact CD1-CB 4.17Å; F141-P152 HydrophobicContact CD1-CG 4.17Å; F141-P152 HydrophobicContact CE1-CB 4.05Å; F141-P152 HydrophobicContact CE1-CG 3.93Å
153	L	79.2	Confident	79.9	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-73.6	172.6	-77.4	170.8	0	0	0	110	V73 T140 L142 L151 F163 R166 M167 V170	V73-L153 HydrophobicContact CG1-CD1 4.26Å; V73-L153 HydrophobicContact CG2-CD1 4.2Å; T140-L153 WeakPolarHBondContact O-CA 3.4Å; T140-L153 WeakPolarHBondContact O-CB 3.43Å; T140-L153 PolarHBondContact O-N 2.99Å; T140-L153 WeakPolarHBondContact OG1-CB 3.21Å; L142-L153 HydrophobicContact CB-CD1 3.68Å; L142-L153 HydrophobicContact CB-CD2 4Å; L142-L153 HydrophobicContact CB-CG 3.67Å; L142-L153 HydrophobicContact CD1-CD1 4.24Å; L142-L153 HydrophobicContact CD2-CD2 4.46Å; L142-L153 HydrophobicContact CG-CD1 4.47Å; L151-L153 PolarHBondContact O-N 2.85Å; L153-F163 HydrophobicContact CD1-CE2 4.25Å; L153-F163 HydrophobicContact CD1-CZ 4.1Å; L153-R166 WeakPolarHBondContact O-CD 3.37Å; L153-R166 WeakPolarHBondContact O-CG 3.4Å; L153-R166 PolarHBondContact O-NE 3.44Å; L153-M167 HydrophobicContact CD1-CE 3.98Å; L153-M167 HydrophobicContact CD1-SD 4.03Å; L153-M167 HydrophobicContact CD2-SD 3.96Å; L153-V170 HydrophobicContact CD2-CB 3.93Å; L153-V170 HydrophobicContact CD2-CG1 4.23Å; L153-V170 HydrophobicContact CD2-CG2 3.91Å
154	L	80.8	Confident	80.1	Confident	38 Å²	38	48.4 Å²	48.4	20%	0.199	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	142.6	-165.9	-177.1	117.1	0	0	0	111.3	F87 T139 T140 G156 T158	F87-L154 HydrophobicContact CE2-CD2 4.31Å; F87-L154 HydrophobicContact CZ-CD2 4.23Å; T139-L154 CarbonylContact C-O 3.4Å; T139-L154 WeakPolarHBondContact CA-O 3.36Å; T140-L154 PolarHBondContact N-O 2.77Å; T140-L154 PolarHBondContact O-N 3.13Å; T140-L154 PolarHBondContact OG1-N 2.55Å; T140-L154 PolarHBondContact OG1-O 3.12Å; L154-G156 WeakPolarHBondContact CD2-O 3.46Å; L154-T158 HydrophobicContact CD1-CG2 3.92Å; L154-T158 HydrophobicContact CD2-CG2 3.49Å; L154-T158 VanDerWaalsContact CD2-CG2 3.49Å; L154-T158 HydrophobicContact CG-CG2 4.37Å
155	Q	79.1	Confident	79.8	Confident	90 Å²	90	50.4 Å²	50.4	42%	0.421	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.1	171.4	-179.9	168.2	46.9	0	0	109.4	P134 A136 P138 T139	P134-Q155 PolarHBondContact O-NE2 2.97Å; A136-Q155 HydrophobicContact CB-CG 4.22Å; P138-Q155 WeakPolarHBondContact O-CA 3.4Å; T139-Q155 HydrophobicContact CG2-CB 4.41Å; T139-Q155 WeakPolarHBondContact OG1-CG 3.25Å; T139-Q155 PolarHBondContact OG1-NE2 2.67Å
156	G	81.1	Confident	79.6	Confident	23 Å²	23	52.4 Å²	52.4	24%	0.237	32%	0.315	C	S	.	.	S	Bend	trans	100.8	177.1	-174.1	0	0	0	0	0	113.8	P138 L154	P138-G156 PolarHBondContact O-N 3.31Å; L154-G156 WeakPolarHBondContact CD2-O 3.46Å
157	A	80.7	Confident	79.7	Confident	37 Å²	37	47.8 Å²	47.8	31%	0.306	29%	0.291	S	S	.	.			trans	-83.2	141.7	179.3	0	0	0	0	0	112.3	Y83 Q86 F87	Y83-A157 HydrophobicContact CD1-CB 4.1Å; Q86-A157 HydrophobicContact CB-CB 4.28Å; Q86-A157 HydrophobicContact CG-CB 4.34Å; F87-A157 HydrophobicContact CB-CB 3.97Å
158	T	74.9	Confident	79.9	Confident	34 Å²	34	44.6 Å²	44.6	21%	0.209	27%	0.271	C	S	.	.			trans	-142.8	161.9	174.5	-176.4	0	0	0	0	110.1	F87 L154 G162 F163	F87-T158 HydrophobicContact CD2-CG2 3.84Å; F87-T158 WeakPolarHBondContact CD2-O 3.48Å; F87-T158 HydrophobicContact CE2-CG2 3.47Å; F87-T158 VanDerWaalsContact CE2-CG2 3.47Å; F87-T158 HydrophobicContact CZ-CG2 4.43Å; L154-T158 HydrophobicContact CD1-CG2 3.92Å; L154-T158 HydrophobicContact CD2-CG2 3.49Å; L154-T158 VanDerWaalsContact CD2-CG2 3.49Å; L154-T158 HydrophobicContact CG-CG2 4.37Å; T158-G162 WeakPolarHBondContact OG1-CA 3.3Å; T158-F163 HydrophobicContact CG2-CB 3.83Å
159	D	78.7	Confident	79.7	Confident	105 Å²	105	40.3 Å²	40.3	56%	0.561	25%	0.25	S	S	*	.			trans	-76.3	175.3	166.5	67.6	11	0	0	0	112.1	A161 G162 F163	D159-A161 VanDerWaalsContact C-N 3.27Å; D159-A161 PolarHBondContact O-N 2.73Å; D159-A161 PolarHBondContact OD1-N 2.73Å; D159-G162 PolarHBondContact O-N 3.46Å; D159-G162 PolarHBondContact OD1-N 3.24Å; D159-F163 PolarHBondContact O-N 3.28Å; D159-F163 VanDerWaalsContact O-N 3.15Å
160	A	83.2	Confident	80	Confident	40 Å²	40	38.6 Å²	38.6	33%	0.331	24%	0.243	S	C	.	.	H	α-helix	trans	-59.6	-38.1	-177.3	0	0	0	0	0	112.9	V90 L94 M164	V90-A160 HydrophobicContact CG1-CB 3.88Å; L94-A160 HydrophobicContact CD1-CB 4.26Å; L94-A160 HydrophobicContact CD2-CB 4.01Å; L94-A160 HydrophobicContact CG-CB 4.27Å; A160-M164 WeakPolarHBondContact O-CG 3.44Å; A160-M164 PolarHBondContact O-N 3.33Å; A160-M164 VanDerWaalsContact O-N 3.1Å
161	A	76.9	Confident	80.4	Confident	40 Å²	40	36.8 Å²	36.8	33%	0.331	23%	0.228	S	C	.	.	H	α-helix	trans	-68.8	-46.6	-179.1	0	0	0	0	0	111.3	D159 F163 M164 A165	D159-A161 VanDerWaalsContact C-N 3.27Å; D159-A161 PolarHBondContact O-N 2.73Å; D159-A161 PolarHBondContact OD1-N 2.73Å; A161-F163 VanDerWaalsContact C-N 3.33Å; A161-F163 PolarHBondContact O-N 2.84Å; A161-M164 PolarHBondContact O-N 2.78Å; A161-A165 WeakPolarHBondContact O-CB 3.48Å; A161-A165 PolarHBondContact O-N 3.44Å
162	G	75.9	Confident	80.3	Confident	26 Å²	26	35.9 Å²	35.9	27%	0.268	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-39.3	178	0	0	0	0	0	112.6	T158 D159 R166	T158-G162 WeakPolarHBondContact OG1-CA 3.3Å; D159-G162 PolarHBondContact O-N 3.46Å; D159-G162 PolarHBondContact OD1-N 3.24Å; G162-R166 WeakPolarHBondContact O-CB 3.46Å; G162-R166 PolarHBondContact O-N 3.24Å; G162-R166 VanDerWaalsContact O-N 3.12Å
163	F	85.8	Confident	79.9	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-48	174.8	-175.2	-96.8	0	0	0	112.3	V73 F87 L91 L94 F100 T140 L153 T158 D159 A161 A165 R166 M167	V73-F163 HydrophobicContact CG1-CZ 4.07Å; V73-F163 HydrophobicContact CG2-CZ 4.1Å; F87-F163 HydrophobicContact CE2-CB 4.31Å; F87-F163 AromaticContact CE2-CD2 3.87Å; F87-F163 HydrophobicContact CE2-CD2 3.87Å; F87-F163 HydrophobicContact CE2-CG 4.32Å; F87-F163 AromaticContact CZ-CD2 3.5Å; F87-F163 HydrophobicContact CZ-CD2 3.5Å; F87-F163 AromaticContact CZ-CE2 3.82Å; F87-F163 HydrophobicContact CZ-CE2 3.82Å; F87-F163 HydrophobicContact CZ-CG 4.3Å; L91-F163 HydrophobicContact CD1-CD1 4.4Å; L91-F163 HydrophobicContact CD1-CE1 3.66Å; L91-F163 HydrophobicContact CD1-CE2 3.9Å; L91-F163 HydrophobicContact CD1-CZ 3.37Å; L94-F163 HydrophobicContact CD1-CB 3.92Å; L94-F163 HydrophobicContact CD1-CD1 3.49Å; L94-F163 VanDerWaalsContact CD1-CD1 3.49Å; L94-F163 HydrophobicContact CD1-CE1 4.33Å; L94-F163 HydrophobicContact CD1-CG 4.01Å; F100-F163 HydrophobicContact CE2-CE1 4.26Å; F100-F163 AromaticContact CZ-CE1 3.79Å; F100-F163 HydrophobicContact CZ-CE1 3.79Å; T140-F163 HydrophobicContact CG2-CE2 4.25Å; L153-F163 HydrophobicContact CD1-CE2 4.25Å; L153-F163 HydrophobicContact CD1-CZ 4.1Å; T158-F163 HydrophobicContact CG2-CB 3.83Å; D159-F163 PolarHBondContact O-N 3.28Å; D159-F163 VanDerWaalsContact O-N 3.15Å; A161-F163 VanDerWaalsContact C-N 3.33Å; A161-F163 PolarHBondContact O-N 2.84Å; F163-A165 PolarHBondContact O-N 2.84Å; F163-R166 PolarHBondContact O-N 2.73Å; F163-M167 HydrophobicContact CD1-CE 4.31Å; F163-M167 HydrophobicContact CE1-CE 3.3Å; F163-M167 HydrophobicContact CZ-CE 3.52Å; F163-M167 PolarHBondContact O-N 2.83Å
164	M	88.1	Confident	79.5	Confident	18 Å²	18	39.4 Å²	39.4	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-33.4	-179.4	-70.4	-55.6	-61.2	0	0	112.7	F58 L94 Y98 F100 A160 A161 R166 M167 D168	F58-M164 HydrophobicContact CD2-CE 4.32Å; F58-M164 HydrophobicContact CE1-CE 4.3Å; F58-M164 HydrophobicContact CE2-CE 3.56Å; F58-M164 HydrophobicContact CZ-CE 3.56Å; L94-M164 HydrophobicContact CD1-CG 4.14Å; L94-M164 HydrophobicContact CD1-SD 4.34Å; L94-M164 HydrophobicContact CD2-CG 3.76Å; L94-M164 HydrophobicContact CD2-SD 4.15Å; Y98-M164 HydrophobicContact CD1-CE 4.1Å; Y98-M164 HydrophobicContact CD2-CE 3.92Å; Y98-M164 HydrophobicContact CD2-SD 3.86Å; Y98-M164 HydrophobicContact CE1-CE 4.1Å; Y98-M164 HydrophobicContact CE2-CE 3.92Å; Y98-M164 HydrophobicContact CE2-CG 3.99Å; Y98-M164 HydrophobicContact CE2-SD 3.91Å; Y98-M164 HydrophobicContact CG-CE 4.01Å; Y98-M164 HydrophobicContact CG-SD 4.46Å; F100-M164 HydrophobicContact CE1-SD 4.27Å; A160-M164 WeakPolarHBondContact O-CG 3.44Å; A160-M164 PolarHBondContact O-N 3.33Å; A160-M164 VanDerWaalsContact O-N 3.1Å; A161-M164 PolarHBondContact O-N 2.78Å; M164-R166 VanDerWaalsContact C-N 3.33Å; M164-M167 WeakPolarHBondContact O-CB 3.26Å; M164-M167 PolarHBondContact O-N 2.94Å; M164-D168 WeakPolarHBondContact O-CB 2.87Å; M164-D168 PolarHBondContact O-N 2.83Å
165	A	78.3	Confident	78.5	Confident	52 Å²	52	39.2 Å²	39.2	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-39.5	172.7	0	0	0	0	0	111.7	A161 F163 T169	A161-A165 WeakPolarHBondContact O-CB 3.48Å; A161-A165 PolarHBondContact O-N 3.44Å; F163-A165 PolarHBondContact O-N 2.84Å; A165-T169 WeakPolarHBondContact O-CB 3.26Å; A165-T169 PolarHBondContact O-N 3.35Å; A165-T169 PolarHBondContact O-OG1 2.97Å
166	R	81.3	Confident	77.2	Confident	100 Å²	100	37.4 Å²	37.4	38%	0.377	24%	0.243	S	C	.	.	H	α-helix	trans	-68.5	-41.7	175.4	-170.5	58.9	177.5	180	4.1	111.9	L153 G162 F163 M164 T169 V170	L153-R166 WeakPolarHBondContact O-CD 3.37Å; L153-R166 WeakPolarHBondContact O-CG 3.4Å; L153-R166 PolarHBondContact O-NE 3.44Å; G162-R166 WeakPolarHBondContact O-CB 3.46Å; G162-R166 PolarHBondContact O-N 3.24Å; G162-R166 VanDerWaalsContact O-N 3.12Å; F163-R166 PolarHBondContact O-N 2.73Å; M164-R166 VanDerWaalsContact C-N 3.33Å; R166-T169 PolarHBondContact O-N 2.9Å; R166-V170 WeakPolarHBondContact O-CG2 3.25Å; R166-V170 PolarHBondContact O-N 2.88Å
167	M	86.3	Confident	75.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-58.3	-48.6	173.5	-170.5	76.3	77.5	0	0	111.7	V73 F100 L142 L153 F163 M164 T169 V170 L171	V73-M167 HydrophobicContact CG2-CE 3.57Å; F100-M167 HydrophobicContact CZ-CE 4.46Å; L142-M167 HydrophobicContact CD1-CE 4.18Å; L142-M167 HydrophobicContact CD1-SD 3.45Å; L142-M167 WeakPolarHBondContact CD1-SD 3.47Å; L142-M167 HydrophobicContact CD2-SD 3.69Å; L142-M167 HydrophobicContact CG-SD 4.11Å; L153-M167 HydrophobicContact CD1-CE 3.98Å; L153-M167 HydrophobicContact CD1-SD 4.03Å; L153-M167 HydrophobicContact CD2-SD 3.96Å; F163-M167 HydrophobicContact CD1-CE 4.31Å; F163-M167 HydrophobicContact CE1-CE 3.3Å; F163-M167 HydrophobicContact CZ-CE 3.52Å; F163-M167 PolarHBondContact O-N 2.83Å; M164-M167 WeakPolarHBondContact O-CB 3.26Å; M164-M167 PolarHBondContact O-N 2.94Å; M167-T169 VanDerWaalsContact C-N 3.35Å; M167-T169 PolarHBondContact O-N 3.4Å; M167-V170 PolarHBondContact O-N 3.49Å; M167-L171 HydrophobicContact CG-CD1 3.74Å; M167-L171 HydrophobicContact CG-CG 4.5Å; M167-L171 WeakPolarHBondContact O-CB 3.24Å; M167-L171 WeakPolarHBondContact O-CG 3.48Å; M167-L171 PolarHBondContact O-N 3.18Å; M167-L171 HydrophobicContact SD-CD1 4.27Å
168	D	82.6	Confident	73	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.053	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-48.6	176.5	179	66.2	0	0	0	111	L60 S61 M164 V170 L171 Q172	L60-D168 WeakPolarHBondContact CA-OD1 3.36Å; L60-D168 VanDerWaalsContact CB-OD1 3.26Å; L60-D168 WeakPolarHBondContact CB-OD1 3.38Å; L60-D168 HydrophobicContact CD2-CB 4.43Å; L60-D168 VanDerWaalsContact CD2-OD1 3.24Å; L60-D168 WeakPolarHBondContact CD2-OD1 3.22Å; S61-D168 WeakPolarHBondContact CB-OD2 3.48Å; S61-D168 PolarHBondContact N-OD1 2.88Å; S61-D168 PolarHBondContact OG-OD2 3.41Å; M164-D168 WeakPolarHBondContact O-CB 2.87Å; M164-D168 PolarHBondContact O-N 2.83Å; D168-V170 PolarHBondContact O-N 3.39Å; D168-L171 PolarHBondContact O-N 3.1Å; D168-Q172 VanDerWaalsContact CG-NE2 3.26Å; D168-Q172 WeakPolarHBondContact O-CB 3.48Å; D168-Q172 VanDerWaalsContact O-CG 3.22Å; D168-Q172 WeakPolarHBondContact O-CG 3.2Å; D168-Q172 PolarHBondContact O-N 3.42Å; D168-Q172 PolarHBondContact OD1-NE2 2.83Å; D168-Q172 PolarHBondContact OD2-NE2 3.33Å
169	T	74.8	Confident	71.3	Confident	48 Å²	48	55.2 Å²	55.2	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-57.2	-52.4	178.2	-59.3	0	0	0	0	111.7	A165 R166 M167 Q172 M173	A165-T169 WeakPolarHBondContact O-CB 3.26Å; A165-T169 PolarHBondContact O-N 3.35Å; A165-T169 PolarHBondContact O-OG1 2.97Å; R166-T169 PolarHBondContact O-N 2.9Å; M167-T169 VanDerWaalsContact C-N 3.35Å; M167-T169 PolarHBondContact O-N 3.4Å; T169-Q172 PolarHBondContact O-N 3.34Å; T169-M173 HydrophobicContact CG2-CE 3.95Å; T169-M173 HydrophobicContact CG2-SD 4.4Å; T169-M173 VanDerWaalsContact O-CG 3.31Å; T169-M173 WeakPolarHBondContact O-CG 3.43Å; T169-M173 PolarHBondContact O-N 3.3Å
170	V	78.7	Confident	69.6	Low	7 Å²	7	55.9 Å²	55.9	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-44.9	-178.6	172.1	0	0	0	0	111.6	L142 L151 L153 R166 M167 D168 Q172 M173 Y174	L142-V170 HydrophobicContact CD2-CG1 4.12Å; L151-V170 HydrophobicContact CB-CG1 3.65Å; L151-V170 HydrophobicContact CD1-CG1 3.63Å; L151-V170 HydrophobicContact CG-CG1 4.28Å; L153-V170 HydrophobicContact CD2-CB 3.93Å; L153-V170 HydrophobicContact CD2-CG1 4.23Å; L153-V170 HydrophobicContact CD2-CG2 3.91Å; R166-V170 WeakPolarHBondContact O-CG2 3.25Å; R166-V170 PolarHBondContact O-N 2.88Å; M167-V170 PolarHBondContact O-N 3.49Å; D168-V170 PolarHBondContact O-N 3.39Å; V170-Q172 PolarHBondContact O-N 2.72Å; V170-M173 HydrophobicContact CB-CE 4.5Å; V170-M173 HydrophobicContact CG2-CE 4.17Å; V170-M173 PolarHBondContact O-N 2.65Å; V170-Y174 PolarHBondContact O-N 3.37Å; V170-Y174 VanDerWaalsContact O-N 3.15Å
171	L	86.4	Confident	68.2	Low	1 Å²	1	55.3 Å²	55.3	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-44.6	178.3	-76.7	168.6	0	0	0	111.5	L60 R64 V66 L68 W71 L142 M167 D168 M173 Y174 G175	L60-L171 HydrophobicContact CD1-CB 4.06Å; L60-L171 HydrophobicContact CD2-CB 3.66Å; L60-L171 HydrophobicContact CD2-CD1 4.09Å; R64-L171 VanDerWaalsContact NH2-C 3.34Å; R64-L171 PolarHBondContact NH2-O 3.01Å; V66-L171 HydrophobicContact CG2-CD1 3.94Å; L68-L171 HydrophobicContact CD2-CD1 3.9Å; W71-L171 HydrophobicContact CD2-CD2 3.75Å; W71-L171 HydrophobicContact CE3-CD2 4.36Å; W71-L171 HydrophobicContact CG-CD2 4.17Å; W71-L171 HydrophobicContact CH2-CD2 4.07Å; W71-L171 HydrophobicContact CZ2-CD2 3.47Å; W71-L171 VanDerWaalsContact CZ2-CD2 3.47Å; W71-L171 HydrophobicContact CZ3-CD2 4.48Å; L142-L171 HydrophobicContact CD2-CD1 4.37Å; L142-L171 HydrophobicContact CD2-CD2 3.57Å; L142-L171 HydrophobicContact CD2-CG 3.68Å; M167-L171 HydrophobicContact CG-CD1 3.74Å; M167-L171 HydrophobicContact CG-CG 4.5Å; M167-L171 WeakPolarHBondContact O-CB 3.24Å; M167-L171 WeakPolarHBondContact O-CG 3.48Å; M167-L171 PolarHBondContact O-N 3.18Å; M167-L171 HydrophobicContact SD-CD1 4.27Å; D168-L171 PolarHBondContact O-N 3.1Å; L171-M173 VanDerWaalsContact C-N 3.29Å; L171-M173 PolarHBondContact O-N 3.26Å; L171-Y174 WeakPolarHBondContact O-CB 3.47Å; L171-Y174 PolarHBondContact O-N 3.44Å; L171-Y174 VanDerWaalsContact O-N 3.12Å; L171-G175 PolarHBondContact O-N 2.86Å
172	Q	76.7	Confident	68.1	Low	12 Å²	12	56.2 Å²	56.2	6%	0.056	33%	0.326	C	S	.	.	H	α-helix	trans	-55.8	-45.4	178.2	-77.4	-172.9	28.7	0	0	112.8	L60 S61 N62 R64 D168 T169 V170 Y174 G175 G176	L60-Q172 HydrophobicContact CB-CG 3.96Å; L60-Q172 HydrophobicContact CD1-CG 3.75Å; L60-Q172 HydrophobicContact CD2-CG 4.43Å; L60-Q172 HydrophobicContact CG-CG 4.27Å; S61-Q172 PolarHBondContact OG-NE2 3.19Å; N62-Q172 VanDerWaalsContact N-NE2 3.18Å; N62-Q172 WeakPolarHBondContact ND2-CG 3.24Å; R64-Q172 PolarHBondContact NH1-O 2.9Å; D168-Q172 VanDerWaalsContact CG-NE2 3.26Å; D168-Q172 WeakPolarHBondContact O-CB 3.48Å; D168-Q172 VanDerWaalsContact O-CG 3.22Å; D168-Q172 WeakPolarHBondContact O-CG 3.2Å; D168-Q172 PolarHBondContact O-N 3.42Å; D168-Q172 PolarHBondContact OD1-NE2 2.83Å; D168-Q172 PolarHBondContact OD2-NE2 3.33Å; T169-Q172 PolarHBondContact O-N 3.34Å; V170-Q172 PolarHBondContact O-N 2.72Å; Q172-Y174 VanDerWaalsContact C-N 3.32Å; Q172-Y174 PolarHBondContact O-N 3.12Å; Q172-G175 PolarHBondContact O-N 3.08Å; Q172-G176 PolarHBondContact O-N 3.08Å
173	M	68.2	Low	68.2	Low	69 Å²	69	55 Å²	55	34%	0.34	31%	0.313	S	S	.	.	H	α-helix	trans	-61.3	-40.5	177.6	-67	-175.5	-59.1	0	0	111.6	T169 V170 L171 G175 M388	T169-M173 HydrophobicContact CG2-CE 3.95Å; T169-M173 HydrophobicContact CG2-SD 4.4Å; T169-M173 VanDerWaalsContact O-CG 3.31Å; T169-M173 WeakPolarHBondContact O-CG 3.43Å; T169-M173 PolarHBondContact O-N 3.3Å; V170-M173 HydrophobicContact CB-CE 4.5Å; V170-M173 HydrophobicContact CG2-CE 4.17Å; V170-M173 PolarHBondContact O-N 2.65Å; L171-M173 VanDerWaalsContact C-N 3.29Å; L171-M173 PolarHBondContact O-N 3.26Å; M173-G175 VanDerWaalsContact C-N 3.3Å; M173-G175 PolarHBondContact O-N 2.91Å; M173-M388 HydrophobicContact SD-CE 4.25Å; M173-M388 HydrophobicContact SD-CG 4.19Å; M173-M388 HydrophobicContact SD-SD 3.67Å; M173-M388 VanDerWaalsContact SD-SD 3.67Å
174	Y	70.6	Confident	68	Low	77 Å²	77	56.2 Å²	56.2	30%	0.302	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-32.9	-179	-175.5	-100.9	0	0	0	114.5	W71 T147 L151 V170 L171 Q172	W71-Y174 AromaticContact CH2-CD1 3.39Å; W71-Y174 HydrophobicContact CH2-CD1 3.39Å; W71-Y174 AromaticContact CH2-CD2 3.82Å; W71-Y174 HydrophobicContact CH2-CD2 3.82Å; W71-Y174 AromaticContact CH2-CE1 3.51Å; W71-Y174 HydrophobicContact CH2-CE1 3.51Å; W71-Y174 AromaticContact CH2-CE2 3.92Å; W71-Y174 HydrophobicContact CH2-CE2 3.92Å; W71-Y174 AromaticContact CH2-CG 3.53Å; W71-Y174 HydrophobicContact CH2-CG 3.53Å; W71-Y174 AromaticContact CH2-CZ 3.77Å; W71-Y174 AromaticContact CZ2-CD1 3.43Å; W71-Y174 HydrophobicContact CZ2-CD1 3.43Å; W71-Y174 VanDerWaalsContact CZ2-CD1 3.43Å; W71-Y174 AromaticContact CZ2-CE1 3.59Å; W71-Y174 HydrophobicContact CZ2-CE1 3.59Å; W71-Y174 HydrophobicContact CZ2-CG 4.01Å; T147-Y174 PolarHBondContact OG1-OH 3.05Å; L151-Y174 HydrophobicContact CD1-CD2 3.79Å; L151-Y174 HydrophobicContact CD1-CG 4.29Å; V170-Y174 PolarHBondContact O-N 3.37Å; V170-Y174 VanDerWaalsContact O-N 3.15Å; L171-Y174 WeakPolarHBondContact O-CB 3.47Å; L171-Y174 PolarHBondContact O-N 3.44Å; L171-Y174 VanDerWaalsContact O-N 3.12Å; Q172-Y174 VanDerWaalsContact C-N 3.32Å; Q172-Y174 PolarHBondContact O-N 3.12Å
175	G	61	Low	67.7	Low	33 Å²	33	57.2 Å²	57.2	34%	0.34	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	14.1	-173.2	0	0	0	0	0	115.5	R64 L171 Q172 M173 K177	R64-G175 PolarHBondContact NH1-O 3.42Å; L171-G175 PolarHBondContact O-N 2.86Å; Q172-G175 PolarHBondContact O-N 3.08Å; M173-G175 VanDerWaalsContact C-N 3.3Å; M173-G175 PolarHBondContact O-N 2.91Å; G175-K177 PolarHBondContact O-N 3.45Å
176	G	50.4	Low	67.7	Low	52 Å²	52	55.5 Å²	55.5	54%	0.536	31%	0.312	S	S	.	.			trans	-59.2	118.6	179.5	0	0	0	0	0	110	Q172 K178	Q172-G176 PolarHBondContact O-N 3.08Å; G176-K178 PolarHBondContact O-N 3.26Å
177	K	37	Very low	67.6	Low	199 Å²	199	50.8 Å²	50.8	87%	0.865	30%	0.295	S	S	*	.			trans	-56.5	136.6	166.4	-75	-175.7	176.8	-179.9	0	107.5	G175 A179	G175-K177 PolarHBondContact O-N 3.45Å; K177-A179 PolarHBondContact O-N 3.29Å
178	K	38.4	Very low	67.3	Low	195 Å²	195	51.7 Å²	51.7	85%	0.848	30%	0.299	S	S	*	.			trans	-60.4	64.8	168.5	-62.4	179.6	178.5	-177.4	0	110.7	G176	G176-K178 PolarHBondContact O-N 3.26Å
179	A	38.9	Very low	67	Low	74 Å²	74	55.3 Å²	55.3	61%	0.612	32%	0.316	S	S	*	.			trans	-70.4	139.6	159.4	0	0	0	0	0	106	K177 A181	K177-A179 PolarHBondContact O-N 3.29Å; A179-A181 PolarHBondContact O-N 2.85Å
180	S	42.8	Very low	67.1	Low	119 Å²	119	54.6 Å²	54.6	83%	0.832	31%	0.309	S	S	*	.			trans	-56.8	90.7	171.6	-176.1	0	0	0	0	107.8
181	A	52.7	Low	66.7	Low	28 Å²	28	54.3 Å²	54.3	23%	0.231	31%	0.307	C	S	.	.			trans	-86.3	121.3	-178.6	0	0	0	0	0	105.8	A179 S185 N392	A179-A181 PolarHBondContact O-N 2.85Å; A181-S185 WeakPolarHBondContact CA-OG 3.49Å; A181-S185 WeakPolarHBondContact CB-OG 3.27Å; A181-N392 HydrophobicContact CB-CB 4.08Å; A181-N392 WeakPolarHBondContact CB-ND2 3.25Å; A181-N392 PolarHBondContact O-ND2 2.77Å; A181-N392 PolarHBondContact O-OD1 2.88Å
182	D	75.5	Confident	65.8	Low	59 Å²	59	57.5 Å²	57.5	32%	0.316	32%	0.324	S	S	.	.			trans	-106.3	174.7	170	60.1	11.8	0	0	0	108.4	N184 S185 D186 E394	D182-N184 PolarHBondContact O-N 3.44Å; D182-N184 WeakPolarHBondContact OD1-CB 3.42Å; D182-N184 PolarHBondContact OD1-N 2.86Å; D182-S185 PolarHBondContact N-OG 3.43Å; D182-S185 PolarHBondContact O-N 3.19Å; D182-S185 VanDerWaalsContact O-N 3.1Å; D182-S185 PolarHBondContact O-OG 3.42Å; D182-S185 VanDerWaalsContact OD1-CB 3.32Å; D182-S185 WeakPolarHBondContact OD1-CB 3.07Å; D182-S185 PolarHBondContact OD1-N 2.8Å; D182-S185 PolarHBondContact OD1-OG 3.49Å; D182-D186 PolarHBondContact O-N 2.93Å; D182-E394 WeakPolarHBondContact CB-OE1 3.49Å
183	V	78.4	Confident	65.2	Low	1 Å²	1	60.3 Å²	60.3	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-57	-33.9	177.3	172.9	0	0	0	0	110.7	D186 M187 E394 F398 V456 I458	V183-D186 PolarHBondContact O-N 3.42Å; V183-M187 VanDerWaalsContact O-CB 3.25Å; V183-M187 WeakPolarHBondContact O-CB 3.38Å; V183-M187 PolarHBondContact O-N 2.88Å; V183-E394 WeakPolarHBondContact CB-OE1 3.41Å; V183-E394 HydrophobicContact CG2-CB 4.48Å; V183-E394 HydrophobicContact CG2-CG 3.92Å; V183-E394 WeakPolarHBondContact CG2-OE1 3.41Å; V183-E394 PolarHBondContact N-OE1 2.86Å; V183-F398 HydrophobicContact CG1-CD1 4.11Å; V183-F398 HydrophobicContact CG1-CE1 4.26Å; V183-F398 HydrophobicContact CG1-CG 4.28Å; V183-F398 HydrophobicContact CG2-CB 3.55Å; V183-F398 HydrophobicContact CG2-CD1 4.12Å; V183-F398 HydrophobicContact CG2-CD2 4.39Å; V183-F398 HydrophobicContact CG2-CG 3.77Å; V183-V456 HydrophobicContact CB-CG2 4.3Å; V183-V456 HydrophobicContact CG2-CG2 4.4Å; V183-I458 HydrophobicContact CG1-CD1 4.4Å
184	N	81.2	Confident	64.7	Low	25 Å²	25	58.6 Å²	58.6	13%	0.134	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-48.1	176.1	-173.6	-0.6	0	0	0	111.3	D182 D186 N188 K462	D182-N184 PolarHBondContact O-N 3.44Å; D182-N184 WeakPolarHBondContact OD1-CB 3.42Å; D182-N184 PolarHBondContact OD1-N 2.86Å; N184-D186 PolarHBondContact O-N 2.86Å; N184-N188 WeakPolarHBondContact O-CB 3.48Å; N184-N188 VanDerWaalsContact O-CG 3.24Å; N184-N188 PolarHBondContact O-N 3.41Å; N184-N188 PolarHBondContact O-ND2 3.42Å; N184-N188 PolarHBondContact OD1-ND2 3.03Å; N184-K462 WeakPolarHBondContact OD1-CB 3.46Å; N184-K462 VanDerWaalsContact OD1-CG 3.29Å; N184-K462 WeakPolarHBondContact OD1-CG 3.39Å
185	S	80.9	Confident	63.7	Low	39 Å²	39	55.8 Å²	55.8	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-64.2	-39.8	178.3	77.3	0	0	0	0	112.3	A181 D182 N188 Q189	A181-S185 WeakPolarHBondContact CA-OG 3.49Å; A181-S185 WeakPolarHBondContact CB-OG 3.27Å; D182-S185 PolarHBondContact N-OG 3.43Å; D182-S185 PolarHBondContact O-N 3.19Å; D182-S185 VanDerWaalsContact O-N 3.1Å; D182-S185 PolarHBondContact O-OG 3.42Å; D182-S185 VanDerWaalsContact OD1-CB 3.32Å; D182-S185 WeakPolarHBondContact OD1-CB 3.07Å; D182-S185 PolarHBondContact OD1-N 2.8Å; D182-S185 PolarHBondContact OD1-OG 3.49Å; S185-N188 PolarHBondContact O-N 3.24Å; S185-Q189 VanDerWaalsContact O-CB 3.31Å; S185-Q189 WeakPolarHBondContact O-CB 3.27Å; S185-Q189 PolarHBondContact O-N 2.85Å
186	D	79.4	Confident	62.9	Low	17 Å²	17	56.4 Å²	56.4	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-45.4	-179.7	-177.3	67.9	0	0	0	111.1	D182 V183 N184 N188 Q189 F190 L395 Y532	D182-D186 PolarHBondContact O-N 2.93Å; V183-D186 PolarHBondContact O-N 3.42Å; N184-D186 PolarHBondContact O-N 2.86Å; D186-N188 VanDerWaalsContact C-N 3.31Å; D186-N188 PolarHBondContact O-N 2.88Å; D186-Q189 CarbonylContact O-C 3.22Å; D186-Q189 WeakPolarHBondContact O-CA 3.33Å; D186-Q189 WeakPolarHBondContact O-CB 3.42Å; D186-Q189 PolarHBondContact O-N 3.01Å; D186-Q189 VanDerWaalsContact O-N 3.07Å; D186-F190 WeakPolarHBondContact O-CB 3.32Å; D186-F190 PolarHBondContact O-N 3.3Å; D186-L395 HydrophobicContact CB-CD1 4.27Å; D186-L395 HydrophobicContact CB-CD2 4.16Å; D186-L395 WeakPolarHBondContact OD2-CD1 3.29Å; D186-Y532 WeakPolarHBondContact OD2-CE2 3.02Å; D186-Y532 VanDerWaalsContact OD2-CZ 3.29Å; D186-Y532 PolarHBondContact OD2-OH 2.93Å
187	M	78.3	Confident	62.2	Low	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-41.4	174.3	-173.8	-172	64.4	0	0	111.5	V183 F190 F191 I430 I458 K462 L464 Y532	V183-M187 VanDerWaalsContact O-CB 3.25Å; V183-M187 WeakPolarHBondContact O-CB 3.38Å; V183-M187 PolarHBondContact O-N 2.88Å; M187-F190 PolarHBondContact O-N 2.92Å; M187-F191 WeakPolarHBondContact O-CB 3.39Å; M187-F191 PolarHBondContact O-N 3.26Å; M187-I430 HydrophobicContact SD-CB 4.34Å; M187-I430 HydrophobicContact SD-CG2 3.78Å; M187-I458 HydrophobicContact CE-CG2 3.56Å; M187-I458 HydrophobicContact SD-CD1 4.37Å; M187-K462 WeakPolarHBondContact CE-O 3.3Å; M187-L464 HydrophobicContact CG-CD2 4.39Å; M187-L464 HydrophobicContact SD-CG 4.31Å; M187-Y532 HydrophobicContact CB-CE1 4.38Å; M187-Y532 HydrophobicContact CG-CE1 4.45Å
188	N	80.7	Confident	62	Low	20 Å²	20	50.1 Å²	50.1	11%	0.107	29%	0.292	C	S	.	.	H	α-helix	trans	-65.8	-39	174	-73.9	-53.8	0	0	0	112.1	N184 S185 D186 N192 K462 Q467	N184-N188 WeakPolarHBondContact O-CB 3.48Å; N184-N188 VanDerWaalsContact O-CG 3.24Å; N184-N188 PolarHBondContact O-N 3.41Å; N184-N188 PolarHBondContact O-ND2 3.42Å; N184-N188 PolarHBondContact OD1-ND2 3.03Å; S185-N188 PolarHBondContact O-N 3.24Å; D186-N188 VanDerWaalsContact C-N 3.31Å; D186-N188 PolarHBondContact O-N 2.88Å; N188-N192 VanDerWaalsContact O-CB 3.31Å; N188-N192 WeakPolarHBondContact O-CB 3.27Å; N188-N192 PolarHBondContact O-N 3.26Å; N188-N192 PolarHBondContact O-ND2 3.18Å; N188-K462 WeakPolarHBondContact ND2-CD 3.42Å; N188-Q467 PolarHBondContact OD1-NE2 3.31Å
189	Q	76.8	Confident	61.7	Low	86 Å²	86	46.4 Å²	46.4	40%	0.402	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-42.7	176.7	-176.8	178.5	-1.8	0	0	111	S185 D186 N192 K193	S185-Q189 VanDerWaalsContact O-CB 3.31Å; S185-Q189 WeakPolarHBondContact O-CB 3.27Å; S185-Q189 PolarHBondContact O-N 2.85Å; D186-Q189 CarbonylContact O-C 3.22Å; D186-Q189 WeakPolarHBondContact O-CA 3.33Å; D186-Q189 WeakPolarHBondContact O-CB 3.42Å; D186-Q189 PolarHBondContact O-N 3.01Å; D186-Q189 VanDerWaalsContact O-N 3.07Å; Q189-N192 PolarHBondContact O-N 3.42Å; Q189-K193 HydrophobicContact CG-CD 4.31Å; Q189-K193 VanDerWaalsContact NE2-NZ 3.15Å; Q189-K193 VanDerWaalsContact O-CG 3.24Å; Q189-K193 WeakPolarHBondContact O-CG 3.47Å; Q189-K193 PolarHBondContact O-N 3.19Å; Q189-K193 VanDerWaalsContact O-N 3.09Å
190	F	75.5	Confident	61.1	Low	32 Å²	32	47.1 Å²	47.1	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-51.1	173.6	178.4	-96.9	0	0	0	111.1	D186 M187 N192 K193 L194 I528 Q531 Y532 E535	D186-F190 WeakPolarHBondContact O-CB 3.32Å; D186-F190 PolarHBondContact O-N 3.3Å; M187-F190 PolarHBondContact O-N 2.92Å; F190-N192 VanDerWaalsContact C-N 3.26Å; F190-N192 PolarHBondContact O-N 2.78Å; F190-K193 WeakPolarHBondContact O-CA 3.49Å; F190-K193 WeakPolarHBondContact O-CB 3.26Å; F190-K193 PolarHBondContact O-N 2.85Å; F190-L194 HydrophobicContact CD1-CD1 4.14Å; F190-L194 HydrophobicContact CD1-CG 4.38Å; F190-L194 HydrophobicContact CE1-CD1 3.76Å; F190-L194 HydrophobicContact CE1-CD2 3.88Å; F190-L194 HydrophobicContact CE1-CG 3.99Å; F190-L194 HydrophobicContact CE2-CD2 4.49Å; F190-L194 HydrophobicContact CZ-CD1 4.49Å; F190-L194 HydrophobicContact CZ-CD2 3.76Å; F190-L194 HydrophobicContact CZ-CG 4.3Å; F190-L194 PolarHBondContact O-N 3.18Å; F190-I528 HydrophobicContact CE1-CG2 4.19Å; F190-Q531 HydrophobicContact CZ-CB 4.05Å; F190-Y532 HydrophobicContact CB-CD2 3.74Å; F190-Y532 HydrophobicContact CB-CE2 3.95Å; F190-Y532 AromaticContact CD1-CD2 3.67Å; F190-Y532 HydrophobicContact CD1-CD2 3.67Å; F190-Y532 HydrophobicContact CD1-CG 4.01Å; F190-Y532 AromaticContact CD2-CD2 3.82Å; F190-Y532 HydrophobicContact CD2-CD2 3.82Å; F190-Y532 HydrophobicContact CE1-CD2 4.21Å; F190-Y532 HydrophobicContact CE1-CG 4.29Å; F190-Y532 HydrophobicContact CE2-CD2 4.35Å; F190-Y532 AromaticContact CG-CD2 3.45Å; F190-Y532 HydrophobicContact CG-CD2 3.45Å; F190-Y532 VanDerWaalsContact CG-CD2 3.45Å; F190-Y532 HydrophobicContact CG-CE2 4.17Å; F190-Y532 HydrophobicContact CG-CG 4.26Å; F190-E535 HydrophobicContact CE2-CB 4.36Å; F190-E535 HydrophobicContact CE2-CG 4.42Å
191	F	70.6	Confident	60.6	Low	1 Å²	1	46.4 Å²	46.4	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-39.8	177.7	-172.4	-97.6	0	0	0	112.4	M187 K193 L194 L464 Q467 I468 L471 I528	M187-F191 WeakPolarHBondContact O-CB 3.39Å; M187-F191 PolarHBondContact O-N 3.26Å; F191-K193 PolarHBondContact O-N 3.44Å; F191-L194 HydrophobicContact CD2-CD1 4.31Å; F191-L464 HydrophobicContact CD2-CD2 3.69Å; F191-L464 HydrophobicContact CE2-CD2 4.34Å; F191-L464 HydrophobicContact CG-CD2 4.43Å; F191-Q467 HydrophobicContact CD1-CB 3.94Å; F191-Q467 HydrophobicContact CD1-CG 4.41Å; F191-Q467 HydrophobicContact CE1-CB 3.47Å; F191-Q467 VanDerWaalsContact CE1-CB 3.47Å; F191-Q467 HydrophobicContact CE1-CG 4.38Å; F191-Q467 HydrophobicContact CE2-CB 4.26Å; F191-Q467 HydrophobicContact CG-CB 4.5Å; F191-Q467 HydrophobicContact CZ-CB 3.64Å; F191-I468 HydrophobicContact CE2-CD1 4.34Å; F191-I468 HydrophobicContact CE2-CG1 3.62Å; F191-I468 HydrophobicContact CZ-CG1 3.87Å; F191-L471 HydrophobicContact CE1-CD1 3.65Å; F191-L471 HydrophobicContact CZ-CD1 3.63Å; F191-I528 HydrophobicContact CD2-CD1 4.28Å; F191-I528 HydrophobicContact CD2-CG2 4.18Å; F191-I528 HydrophobicContact CE2-CD1 3.82Å
192	N	68.2	Low	59.7	Low	68 Å²	68	53 Å²	53	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-71.3	-16.2	175.1	-69.1	-32.6	0	0	0	113.6	N188 Q189 F190 F196 R488	N188-N192 VanDerWaalsContact O-CB 3.31Å; N188-N192 WeakPolarHBondContact O-CB 3.27Å; N188-N192 PolarHBondContact O-N 3.26Å; N188-N192 PolarHBondContact O-ND2 3.18Å; Q189-N192 PolarHBondContact O-N 3.42Å; F190-N192 VanDerWaalsContact C-N 3.26Å; F190-N192 PolarHBondContact O-N 2.78Å; N192-F196 VanDerWaalsContact C-CD2 3.48Å; N192-F196 HydrophobicContact CB-CD2 4.16Å; N192-F196 VanDerWaalsContact O-CB 3.22Å; N192-F196 WeakPolarHBondContact O-CB 3.43Å; N192-F196 WeakPolarHBondContact O-CD2 3.27Å; N192-F196 VanDerWaalsContact O-CG 3.24Å; N192-F196 WeakPolarHBondContact O-CG 3.38Å; N192-R488 PolarHBondContact OD1-NH2 3.45Å
193	K	64.4	Low	57.9	Low	71 Å²	71	52 Å²	52	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-90	-24.1	178.3	-77.6	170.5	179.2	175	0	113.5	Q189 F190 F191 G195	Q189-K193 HydrophobicContact CG-CD 4.31Å; Q189-K193 VanDerWaalsContact NE2-NZ 3.15Å; Q189-K193 VanDerWaalsContact O-CG 3.24Å; Q189-K193 WeakPolarHBondContact O-CG 3.47Å; Q189-K193 PolarHBondContact O-N 3.19Å; Q189-K193 VanDerWaalsContact O-N 3.09Å; F190-K193 WeakPolarHBondContact O-CA 3.49Å; F190-K193 WeakPolarHBondContact O-CB 3.26Å; F190-K193 PolarHBondContact O-N 2.85Å; F191-K193 PolarHBondContact O-N 3.44Å; K193-G195 PolarHBondContact O-N 3.09Å
194	L	57.8	Low	56.3	Low	33 Å²	33	53.9 Å²	53.9	17%	0.173	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-19.3	-178.5	-71.7	166.3	0	0	0	113.6	F190 F191 S495 I528	F190-L194 HydrophobicContact CD1-CD1 4.14Å; F190-L194 HydrophobicContact CD1-CG 4.38Å; F190-L194 HydrophobicContact CE1-CD1 3.76Å; F190-L194 HydrophobicContact CE1-CD2 3.88Å; F190-L194 HydrophobicContact CE1-CG 3.99Å; F190-L194 HydrophobicContact CE2-CD2 4.49Å; F190-L194 HydrophobicContact CZ-CD1 4.49Å; F190-L194 HydrophobicContact CZ-CD2 3.76Å; F190-L194 HydrophobicContact CZ-CG 4.3Å; F190-L194 PolarHBondContact O-N 3.18Å; F191-L194 HydrophobicContact CD2-CD1 4.31Å; L194-S495 WeakPolarHBondContact O-CB 3.43Å; L194-I528 HydrophobicContact CD1-CB 4.18Å; L194-I528 HydrophobicContact CD1-CD1 3.85Å; L194-I528 HydrophobicContact CD1-CG1 3.81Å; L194-I528 HydrophobicContact CD1-CG2 3.45Å; L194-I528 VanDerWaalsContact CD1-CG2 3.45Å
195	G	48	Very low	54.6	Low	19 Å²	19	54.6 Å²	54.6	20%	0.196	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.7	-7.2	174.5	0	0	0	0	0	118.6	K193 G491	K193-G195 PolarHBondContact O-N 3.09Å; G195-G491 VanDerWaalsContact CA-C 3.49Å; G195-G491 VanDerWaalsContact CA-CA 3.42Å; G195-G491 VanDerWaalsContact O-CA 3.31Å; G195-G491 WeakPolarHBondContact O-CA 3.34Å
196	F	45.5	Very low	52.8	Low	45 Å²	45	56.2 Å²	56.2	20%	0.197	32%	0.317	C	S	.	.	S	Bend	trans	-110.3	27.3	-151.6	-43.6	-30.1	0	0	0	114.6	N192 L471 R488 F492	N192-F196 VanDerWaalsContact C-CD2 3.48Å; N192-F196 HydrophobicContact CB-CD2 4.16Å; N192-F196 VanDerWaalsContact O-CB 3.22Å; N192-F196 WeakPolarHBondContact O-CB 3.43Å; N192-F196 WeakPolarHBondContact O-CD2 3.27Å; N192-F196 VanDerWaalsContact O-CG 3.24Å; N192-F196 WeakPolarHBondContact O-CG 3.38Å; F196-L471 HydrophobicContact CZ-CD1 4.37Å; F196-R488 HydrophobicContact CD1-CB 3.94Å; F196-R488 HydrophobicContact CD1-CG 3.55Å; F196-R488 WeakPolarHBondContact CD1-O 3.41Å; F196-R488 HydrophobicContact CD2-CB 4.47Å; F196-R488 HydrophobicContact CD2-CG 3.42Å; F196-R488 VanDerWaalsContact CD2-CG 3.42Å; F196-R488 HydrophobicContact CE1-CB 4.05Å; F196-R488 HydrophobicContact CE1-CG 3.42Å; F196-R488 VanDerWaalsContact CE1-CG 3.42Å; F196-R488 WeakPolarHBondContact CE1-O 3.36Å; F196-R488 HydrophobicContact CE2-CB 4.49Å; F196-R488 HydrophobicContact CE2-CG 3.2Å; F196-R488 HydrophobicContact CG-CB 4.24Å; F196-R488 HydrophobicContact CG-CG 3.62Å; F196-R488 HydrophobicContact CZ-CB 4.27Å; F196-R488 HydrophobicContact CZ-CG 3.2Å; F196-R488 WeakPolarHBondContact CZ-O 3.35Å; F196-F492 HydrophobicContact CE1-CB 4.29Å; F196-F492 HydrophobicContact CZ-CB 4.27Å
197	A	35.3	Very low	51.2	Low	37 Å²	37	58.3 Å²	58.3	31%	0.306	33%	0.326	S	S	.	.			trans	-132.8	-6.2	-168.7	0	0	0	0	0	118.3	S61 N199	S61-A197 WeakPolarHBondContact OG-CB 3.45Å; A197-N199 PolarHBondContact O-N 3.12Å
198	S	33.6	Very low	49.7	Very low	83 Å²	83	58.6 Å²	58.6	58%	0.58	33%	0.329	S	S	*	.			trans	-85.4	120.7	-178.9	-169.4	0	0	0	0	110.1	T200	S198-T200 PolarHBondContact O-N 2.95Å
199	N	31.1	Very low	47.9	Very low	116 Å²	116	58.9 Å²	58.9	62%	0.62	33%	0.329	S	S	*	.			trans	-57.8	110.6	160.1	-151.7	6.3	0	0	0	106.3	A197 T201	A197-N199 PolarHBondContact O-N 3.12Å; N199-T201 PolarHBondContact O-N 2.91Å; N199-T201 PolarHBondContact O-OG1 3.08Å
200	T	26.5	Very low	46.6	Very low	89 Å²	89	57.6 Å²	57.6	55%	0.546	33%	0.334	S	S	.	.			trans	-52.7	100.3	-164.3	62.5	0	0	0	0	111.8	S198	S198-T200 PolarHBondContact O-N 2.95Å
201	T	31.8	Very low	45.3	Very low	104 Å²	104	59.3 Å²	59.3	64%	0.638	35%	0.354	S	S	*	.			trans	-118.8	97.9	164.1	33.1	0	0	0	0	107.4	N199	N199-T201 PolarHBondContact O-N 2.91Å; N199-T201 PolarHBondContact O-OG1 3.08Å
202	Q	33.3	Very low	43.8	Very low	166 Å²	166	62.2 Å²	62.2	78%	0.776	38%	0.384	S	S	*	.			trans	46.9	74.1	171.1	-61.3	-71.2	-6.7	0	0	115.3	G204	Q202-G204 PolarHBondContact O-N 3.21Å; Q202-G204 VanDerWaalsContact O-N 3.13Å
203	P	37.6	Very low	42.2	Very low	38 Å²	38	67 Å²	67	25%	0.247	40%	0.398	C	S	.	.			trans	-58.4	122.7	148	29.6	-31	0	0	0	105.4	W206 Q207	P203-W206 VanDerWaalsContact CB-CD1 3.43Å; P203-W206 VanDerWaalsContact CG-NE1 3.27Å; P203-Q207 VanDerWaalsContact C-OE1 3.23Å; P203-Q207 PolarHBondContact O-NE2 3.03Å; P203-Q207 PolarHBondContact O-OE1 3.11Å
204	G	45	Very low	40.8	Very low	41 Å²	41	67.3 Å²	67.3	42%	0.423	41%	0.414	S	S	.	.			trans	-104.1	-12.7	165.9	0	0	0	0	0	111.2	Q202 G208	Q202-G204 PolarHBondContact O-N 3.21Å; Q202-G204 VanDerWaalsContact O-N 3.13Å; G204-G208 PolarHBondContact O-N 2.77Å
205	V	46.4	Very low	39.8	Very low	41 Å²	41	73.5 Å²	73.5	25%	0.248	44%	0.436	C	S	.	.	H	α-helix	trans	-70	-45.7	-178	-179	0	0	0	0	110.9	G208 Q209	V205-G208 PolarHBondContact O-N 2.84Å; V205-Q209 WeakPolarHBondContact O-CB 3.27Å; V205-Q209 WeakPolarHBondContact O-CG 3.24Å; V205-Q209 PolarHBondContact O-N 2.87Å
206	W	43.5	Very low	39.2	Very low	73 Å²	73	76.4 Å²	76.4	28%	0.277	47%	0.466	S	S	.	.	H	α-helix	trans	-69.7	-40.7	178.3	85.7	-110.3	0	0	0	111.5	P203 G208 Q209 A210 K490 F501	P203-W206 VanDerWaalsContact CB-CD1 3.43Å; P203-W206 VanDerWaalsContact CG-NE1 3.27Å; W206-G208 VanDerWaalsContact C-N 3.33Å; W206-Q209 PolarHBondContact O-N 2.79Å; W206-A210 HydrophobicContact CE3-CB 4.02Å; W206-A210 HydrophobicContact CZ3-CB 4.15Å; W206-A210 WeakPolarHBondContact O-CB 3.28Å; W206-A210 PolarHBondContact O-N 3.48Å; W206-K490 HydrophobicContact CG-CG 4.45Å; W206-F501 HydrophobicContact CB-CE2 4.34Å
207	Q	44.5	Very low	38.5	Very low	61 Å²	61	76.2 Å²	76.2	29%	0.285	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-39.7	177	-69.9	85.7	-28.8	0	0	110.3	P203 A211	P203-Q207 VanDerWaalsContact C-OE1 3.23Å; P203-Q207 PolarHBondContact O-NE2 3.03Å; P203-Q207 PolarHBondContact O-OE1 3.11Å; Q207-A211 WeakPolarHBondContact O-CB 3.45Å; Q207-A211 PolarHBondContact O-N 2.87Å
208	G	48.6	Very low	38.2	Very low	6 Å²	6	78.7 Å²	78.7	6%	0.062	49%	0.492	C	S	.	.	H	α-helix	trans	-59.1	-54.2	172.8	0	0	0	0	0	111	G204 V205 W206 A210 A211 G212 Y213	G204-G208 PolarHBondContact O-N 2.77Å; V205-G208 PolarHBondContact O-N 2.84Å; W206-G208 VanDerWaalsContact C-N 3.33Å; G208-A210 PolarHBondContact O-N 3.48Å; G208-A211 CarbonylContact O-C 3.51Å; G208-A211 PolarHBondContact O-N 2.83Å; G208-A211 VanDerWaalsContact O-N 3.15Å; G208-G212 PolarHBondContact O-N 3.45Å; G208-G212 VanDerWaalsContact O-N 3.1Å; G208-Y213 CarbonylContact C-O 3.58Å; G208-Y213 WeakPolarHBondContact CA-O 3.11Å; G208-Y213 CarbonylContact O-C 3.49Å; G208-Y213 PolarHBondContact O-N 3.16Å
209	Q	41.3	Very low	37.9	Very low	27 Å²	27	80.9 Å²	80.9	13%	0.126	50%	0.496	C	S	.	.	H	α-helix	trans	-60.6	-42.3	179.6	-74.3	-172	37.7	0	0	112.5	V205 W206 A211 G212 Y213 F501	V205-Q209 WeakPolarHBondContact O-CB 3.27Å; V205-Q209 WeakPolarHBondContact O-CG 3.24Å; V205-Q209 PolarHBondContact O-N 2.87Å; W206-Q209 PolarHBondContact O-N 2.79Å; Q209-A211 VanDerWaalsContact C-N 3.35Å; Q209-G212 PolarHBondContact O-N 3.31Å; Q209-Y213 PolarHBondContact N-O 3.39Å; Q209-F501 HydrophobicContact CB-CB 4.08Å; Q209-F501 HydrophobicContact CB-CD2 3.74Å; Q209-F501 HydrophobicContact CB-CG 4.36Å
210	A	49.4	Very low	37.7	Very low	59 Å²	59	82.8 Å²	82.8	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-68.3	-31.8	176.4	0	0	0	0	0	112.7	W206 G208 G212	W206-A210 HydrophobicContact CE3-CB 4.02Å; W206-A210 HydrophobicContact CZ3-CB 4.15Å; W206-A210 WeakPolarHBondContact O-CB 3.28Å; W206-A210 PolarHBondContact O-N 3.48Å; G208-A210 PolarHBondContact O-N 3.48Å; A210-G212 VanDerWaalsContact C-N 3.27Å; A210-G212 PolarHBondContact O-N 3.15Å
211	A	48.8	Very low	37.6	Very low	68 Å²	68	82 Å²	82	56%	0.562	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	0.9	174.6	0	0	0	0	0	113.7	Q207 G208 Q209 Y213	Q207-A211 WeakPolarHBondContact O-CB 3.45Å; Q207-A211 PolarHBondContact O-N 2.87Å; G208-A211 CarbonylContact O-C 3.51Å; G208-A211 PolarHBondContact O-N 2.83Å; G208-A211 VanDerWaalsContact O-N 3.15Å; Q209-A211 VanDerWaalsContact C-N 3.35Å; A211-Y213 HydrophobicContact CB-CD2 4.4Å
212	G	39.7	Very low	37.2	Very low	62 Å²	62	85.5 Å²	85.5	64%	0.639	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	4.8	178.5	0	0	0	0	0	115.8	G208 Q209 A210	G208-G212 PolarHBondContact O-N 3.45Å; G208-G212 VanDerWaalsContact O-N 3.1Å; Q209-G212 PolarHBondContact O-N 3.31Å; A210-G212 VanDerWaalsContact C-N 3.27Å; A210-G212 PolarHBondContact O-N 3.15Å
213	Y	33.9	Very low	36.8	Very low	168 Å²	168	83 Å²	83	66%	0.659	50%	0.497	S	S	*	.			trans	-106.9	116.2	175.6	-62.3	-80	0	0	0	110.9	G208 Q209 A211 Y215	G208-Y213 CarbonylContact C-O 3.58Å; G208-Y213 WeakPolarHBondContact CA-O 3.11Å; G208-Y213 CarbonylContact O-C 3.49Å; G208-Y213 PolarHBondContact O-N 3.16Å; Q209-Y213 PolarHBondContact N-O 3.39Å; A211-Y213 HydrophobicContact CB-CD2 4.4Å; Y213-Y215 PolarHBondContact O-N 3.43Å
214	A	34.3	Very low	36.1	Very low	77 Å²	77	87 Å²	87	64%	0.636	51%	0.512	S	S	*	.			trans	-82.5	101.1	171.3	0	0	0	0	0	109.8	G216	A214-G216 PolarHBondContact O-N 3.06Å
215	Y	37.1	Very low	35.3	Very low	163 Å²	163	90.5 Å²	90.5	64%	0.639	53%	0.525	S	S	*	.			trans	-74.6	116.3	156.5	-63.6	-85.4	0	0	0	106.4	Y213 G217	Y213-Y215 PolarHBondContact O-N 3.43Å; Y215-G217 PolarHBondContact O-N 3.25Å
216	G	35.3	Very low	34.4	Very low	81 Å²	81	95.7 Å²	95.7	84%	0.835	54%	0.544	S	S	*	.			trans	-64.8	83.1	162.9	0	0	0	0	0	107.6	A214 S218	A214-G216 PolarHBondContact O-N 3.06Å; G216-S218 PolarHBondContact O-N 3.22Å
217	G	32.1	Very low	33.5	Very low	41 Å²	41	99.3 Å²	99.3	42%	0.423	57%	0.569	S	S	.	*			trans	-60.8	107.8	175.6	0	0	0	0	0	107.7	Y215 L219	Y215-G217 PolarHBondContact O-N 3.25Å; G217-L219 PolarHBondContact O-N 2.93Å
218	S	28	Very low	32.6	Very low	88 Å²	88	101.4 Å²	101.4	62%	0.615	59%	0.586	S	S	*	*			trans	-66	114.5	165.7	58.2	0	0	0	0	106.9	G216 Y220	G216-S218 PolarHBondContact O-N 3.22Å; S218-Y220 PolarHBondContact O-N 3.2Å
219	L	28	Very low	31.5	Very low	130 Å²	130	108.3 Å²	108.3	68%	0.681	62%	0.616	S	S	*	*			trans	-66.3	94.2	157.8	-166.2	100.2	0	0	0	106	G217 A221	G217-L219 PolarHBondContact O-N 2.93Å; L219-A221 HydrophobicContact CD2-CB 3.97Å; L219-A221 PolarHBondContact O-N 3.43Å
220	Y	26.3	Very low	30.9	Very low	155 Å²	155	114.6 Å²	114.6	61%	0.608	65%	0.65	S	S	*	*			trans	-81.9	59.9	179.3	-130.9	-58.3	0	0	0	109.7	S218 R222	S218-Y220 PolarHBondContact O-N 3.2Å; Y220-R222 VanDerWaalsContact C-N 3.3Å; Y220-R222 HydrophobicContact CD1-CG 3.68Å; Y220-R222 HydrophobicContact CE1-CG 3.52Å; Y220-R222 VanDerWaalsContact CE1-NH2 3.3Å; Y220-R222 PolarHBondContact O-N 2.96Å; Y220-R222 VanDerWaalsContact O-N 3.12Å; Y220-R222 PolarHBondContact OH-NH2 3.36Å
221	A	24.6	Very low	29.8	Very low	74 Å²	74	118.5 Å²	118.5	61%	0.612	66%	0.661	S	S	*	*			trans	-81.1	82	165.9	0	0	0	0	0	108.1	L219 T223	L219-A221 HydrophobicContact CD2-CB 3.97Å; L219-A221 PolarHBondContact O-N 3.43Å; A221-T223 PolarHBondContact O-N 3.3Å
222	R	24.6	Very low	28.7	Very low	176 Å²	176	119.6 Å²	119.6	66%	0.664	67%	0.665	S	S	*	*			trans	-68.5	97.1	166.5	-84.2	174.9	-172.8	119.3	1.7	107.7	Y220 Q224	Y220-R222 VanDerWaalsContact C-N 3.3Å; Y220-R222 HydrophobicContact CD1-CG 3.68Å; Y220-R222 HydrophobicContact CE1-CG 3.52Å; Y220-R222 VanDerWaalsContact CE1-NH2 3.3Å; Y220-R222 PolarHBondContact O-N 2.96Å; Y220-R222 VanDerWaalsContact O-N 3.12Å; Y220-R222 PolarHBondContact OH-NH2 3.36Å; R222-Q224 PolarHBondContact O-N 3.13Å
223	T	24	Very low	28.3	Very low	114 Å²	114	123.6 Å²	123.6	70%	0.699	67%	0.669	S	S	*	*			trans	-71.2	119.5	145	63.3	0	0	0	0	105.2	A221 V225	A221-T223 PolarHBondContact O-N 3.3Å; T223-V225 VanDerWaalsContact C-N 3.3Å; T223-V225 PolarHBondContact O-N 3.48Å
224	Q	23.7	Very low	28	Very low	121 Å²	121	122 Å²	122	57%	0.565	68%	0.677	S	S	*	*			trans	-69.2	96.7	172.2	-74.7	-135.2	-9.2	0	0	107.7	R222 K226	R222-Q224 PolarHBondContact O-N 3.13Å; Q224-K226 HydrophobicContact CB-CG 4.46Å; Q224-K226 PolarHBondContact O-N 2.89Å; Q224-K226 VanDerWaalsContact OE1-CE 3.29Å
225	V	26.7	Very low	27.8	Very low	116 Å²	116	124.2 Å²	124.2	70%	0.703	68%	0.677	S	S	*	*			trans	-71.1	84.7	153.8	-165.7	0	0	0	0	105.4	T223 N227	T223-V225 VanDerWaalsContact C-N 3.3Å; T223-V225 PolarHBondContact O-N 3.48Å; V225-N227 PolarHBondContact O-N 3.32Å
226	K	28	Very low	27.3	Very low	149 Å²	149	121.7 Å²	121.7	65%	0.648	68%	0.681	S	S	*	*			trans	-68.4	104.5	164.6	-83.8	-162.7	177.6	-176.3	0	106.5	Q224 V228	Q224-K226 HydrophobicContact CB-CG 4.46Å; Q224-K226 PolarHBondContact O-N 2.89Å; Q224-K226 VanDerWaalsContact OE1-CE 3.29Å; K226-V228 PolarHBondContact O-N 3.46Å
227	N	25.1	Very low	26.9	Very low	149 Å²	149	124.8 Å²	124.8	80%	0.797	68%	0.678	S	S	*	*			trans	-62.4	94.3	158.6	-75.3	-28.4	0	0	0	106.8	V225 Q229	V225-N227 PolarHBondContact O-N 3.32Å; N227-Q229 VanDerWaalsContact C-N 3.3Å; N227-Q229 PolarHBondContact O-N 2.7Å
228	V	26.2	Very low	26.7	Very low	106 Å²	106	130 Å²	130	64%	0.642	70%	0.695	S	S	*	*			trans	-71.7	98.1	165.7	-177.6	0	0	0	0	105.3	K226 L230	K226-V228 PolarHBondContact O-N 3.46Å; V228-L230 VanDerWaalsContact C-N 3.32Å; V228-L230 HydrophobicContact CG1-CD2 4.01Å; V228-L230 HydrophobicContact CG1-CG 4.34Å; V228-L230 PolarHBondContact O-N 2.91Å
229	Q	23.8	Very low	26.4	Very low	150 Å²	150	132.7 Å²	132.7	70%	0.701	70%	0.702	S	S	*	*			trans	-67.4	96.6	169.8	-172.5	162.5	7.5	0	0	106.9	N227 I231	N227-Q229 VanDerWaalsContact C-N 3.3Å; N227-Q229 PolarHBondContact O-N 2.7Å; Q229-I231 WeakPolarHBondContact CG-O 3.46Å; Q229-I231 PolarHBondContact O-N 3.35Å; Q229-I231 VanDerWaalsContact O-N 3.11Å
230	L	29.5	Very low	26.4	Very low	159 Å²	159	130.7 Å²	130.7	83%	0.832	70%	0.704	S	S	*	*	S	Bend	trans	-64.6	-15.7	-173.9	-73	162.8	0	0	0	112.5	V228	V228-L230 VanDerWaalsContact C-N 3.32Å; V228-L230 HydrophobicContact CG1-CD2 4.01Å; V228-L230 HydrophobicContact CG1-CG 4.34Å; V228-L230 PolarHBondContact O-N 2.91Å
231	I	26.8	Very low	26.2	Very low	141 Å²	141	126.5 Å²	126.5	72%	0.723	71%	0.709	S	S	*	*			trans	-146.3	115	174.8	-56.8	177.6	0	0	0	108.6	Q229	Q229-I231 WeakPolarHBondContact CG-O 3.46Å; Q229-I231 PolarHBondContact O-N 3.35Å; Q229-I231 VanDerWaalsContact O-N 3.11Å
232	S	25.9	Very low	26.4	Very low	91 Å²	91	129.4 Å²	129.4	64%	0.636	72%	0.723	S	S	*	*			trans	-98.6	97.1	168.5	66.9	0	0	0	0	109.4
233	M	29.7	Very low	26.4	Very low	147 Å²	147	124.7 Å²	124.7	72%	0.724	73%	0.729	S	S	*	*			trans	-95.4	98.9	166.3	-170.4	172.1	170.2	0	0	107.7	L235	M233-L235 HydrophobicContact CE-CD1 4.44Å; M233-L235 HydrophobicContact CE-CG 4.36Å; M233-L235 HydrophobicContact CG-CD1 4.45Å; M233-L235 PolarHBondContact O-N 2.76Å; M233-L235 VanDerWaalsContact O-N 3.12Å
234	T	28.7	Very low	26.4	Very low	134 Å²	134	122.8 Å²	122.8	82%	0.822	73%	0.732	S	S	*	*			trans	-77.4	93.4	175.6	-46.2	0	0	0	0	108.4
235	L	29.3	Very low	26.4	Very low	123 Å²	123	124.9 Å²	124.9	64%	0.644	75%	0.745	S	S	*	*			trans	-72.9	147.4	168.4	-83	130.5	0	0	0	110.1	M233	M233-L235 HydrophobicContact CE-CD1 4.44Å; M233-L235 HydrophobicContact CE-CG 4.36Å; M233-L235 HydrophobicContact CG-CD1 4.45Å; M233-L235 PolarHBondContact O-N 2.76Å; M233-L235 VanDerWaalsContact O-N 3.12Å
236	P	26.4	Very low	26.1	Very low	111 Å²	111	125.9 Å²	125.9	72%	0.721	75%	0.747	S	S	*	*			trans	-58.6	140.1	179.5	-18.8	29.8	0	0	0	111.9	I238	P236-I238 PolarHBondContact O-N 3.27Å
237	D	27.1	Very low	26	Very low	146 Å²	146	123 Å²	123	78%	0.781	75%	0.75	S	S	*	*			trans	-58.3	114.6	177.1	-174	60.6	0	0	0	110.6
238	I	28.3	Very low	26	Very low	151 Å²	151	125.5 Å²	125.5	77%	0.774	75%	0.75	S	S	*	*			trans	-110.1	98.2	165	-59	177	0	0	0	106.4	P236 A240	P236-I238 PolarHBondContact O-N 3.27Å; I238-A240 PolarHBondContact O-N 2.88Å
239	N	22.9	Very low	26	Very low	144 Å²	144	128.6 Å²	128.6	77%	0.77	76%	0.762	S	S	*	*			trans	-71.1	88	175.8	-163.2	-3.9	0	0	0	109.6
240	A	26.5	Very low	26	Very low	87 Å²	87	124.6 Å²	124.6	72%	0.719	76%	0.762	S	S	*	*			trans	-109.7	81.9	172.1	0	0	0	0	0	109.4	I238 C242	I238-A240 PolarHBondContact O-N 2.88Å; A240-C242 PolarHBondContact O-N 2.88Å
241	G	23.5	Very low	25.7	Very low	68 Å²	68	122.4 Å²	122.4	70%	0.701	76%	0.76	S	S	*	*			trans	-66.7	122.3	165.8	0	0	0	0	0	110.7
242	C	27.5	Very low	25.6	Very low	134 Å²	134	123.2 Å²	123.2	91%	0.905	76%	0.758	S	S	*	*			trans	-131.8	120.5	151.2	-93.8	0	0	0	0	107.5	A240	A240-C242 PolarHBondContact O-N 2.88Å
243	G	25.6	Very low	25.6	Very low	78 Å²	78	123.6 Å²	123.6	80%	0.804	76%	0.761	S	S	*	*			trans	-64.3	156.3	-167.5	0	0	0	0	0	114.4
244	G	22.9	Very low	25.5	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	77%	0.767	S	S	*	*			trans	50.1	99.7	150.5	0	0	0	0	0	116.7
245	I	24.5	Very low	25.7	Very low	166 Å²	166	124.1 Å²	124.1	85%	0.851	75%	0.752	S	S	*	*			trans	-109	93.3	148	-58.1	-179.1	0	0	0	106.9	A247	I245-A247 PolarHBondContact O-N 3.49Å
246	D	20.5	Very low	26	Very low	136 Å²	136	123.4 Å²	123.4	73%	0.727	75%	0.748	S	S	*	*			trans	-71	109.2	159.9	-87.7	-50.3	0	0	0	108.1	Y248	D246-Y248 HydrophobicContact CB-CD2 4.42Å
247	A	25.4	Very low	26.6	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	74%	0.736	S	S	*	*			trans	-109.9	83.9	168.4	0	0	0	0	0	109.2	I245	I245-A247 PolarHBondContact O-N 3.49Å
248	Y	25.6	Very low	27.6	Very low	202 Å²	202	118.6 Å²	118.6	79%	0.792	72%	0.724	S	S	*	*			trans	-87.7	100.5	161.1	-76.3	-86.2	0	0	0	108.6	D246	D246-Y248 HydrophobicContact CB-CD2 4.42Å
249	L	25.5	Very low	28.3	Very low	171 Å²	171	116.9 Å²	116.9	90%	0.895	71%	0.712	S	S	*	*			trans	-133.6	101.4	164.7	-77.5	172.2	0	0	0	110
250	G	23.1	Very low	29.7	Very low	67 Å²	67	113.3 Å²	113.3	69%	0.691	69%	0.693	S	S	*	*			trans	-73.3	167.8	166.5	0	0	0	0	0	113
251	S	24.2	Very low	30.7	Very low	113 Å²	113	112.6 Å²	112.6	79%	0.79	68%	0.675	S	S	*	*	S	Bend	trans	68.2	119.2	166.7	63.4	0	0	0	0	118.7
252	F	24.7	Very low	32	Very low	157 Å²	157	116.8 Å²	116.8	69%	0.689	67%	0.669	S	S	*	*			trans	-17.3	126.9	164.9	-58	-88.8	0	0	0	116.8	V577	F252-V577 HydrophobicContact CD1-CG1 4.41Å; F252-V577 HydrophobicContact CE1-CG1 3.45Å; F252-V577 VanDerWaalsContact CE1-CG1 3.45Å; F252-V577 HydrophobicContact CZ-CG1 4.12Å
253	S	25.3	Very low	33.2	Very low	100 Å²	100	116.3 Å²	116.3	70%	0.699	65%	0.652	S	S	*	*			trans	-133.1	117.5	146.2	-64.2	0	0	0	0	107.1	I255	S253-I255 PolarHBondContact O-N 2.81Å
254	F	29.1	Very low	34.3	Very low	192 Å²	192	115.2 Å²	115.2	84%	0.842	63%	0.63	S	S	*	*			trans	-59.5	93.1	158.9	-69.4	-87.4	0	0	0	106.3	N256	F254-N256 PolarHBondContact O-N 3.45Å
255	I	32.4	Very low	35.6	Very low	99 Å²	99	118 Å²	118	51%	0.508	62%	0.621	S	S	.	*			trans	-72.5	93.1	169.3	-55.6	180	0	0	0	104.8	S253 G257 Q259 L260	S253-I255 PolarHBondContact O-N 2.81Å; I255-G257 PolarHBondContact O-N 3.3Å; I255-Q259 HydrophobicContact CG2-CB 3.9Å; I255-L260 HydrophobicContact CG2-CB 3.5Å; I255-L260 HydrophobicContact CG2-CD1 4.24Å; I255-L260 HydrophobicContact CG2-CG 4.42Å
256	N	36	Very low	36.7	Very low	108 Å²	108	115.7 Å²	115.7	58%	0.578	61%	0.607	S	S	*	*			trans	-52.4	138.6	167.8	-168.1	-5.3	0	0	0	107	F254 E258 Q259 L260	F254-N256 PolarHBondContact O-N 3.45Å; N256-E258 CarbonylContact O-C 3.55Å; N256-E258 PolarHBondContact O-N 2.93Å; N256-Q259 WeakPolarHBondContact O-CA 3.31Å; N256-Q259 PolarHBondContact O-N 3.48Å; N256-L260 PolarHBondContact O-N 2.94Å
257	G	38.5	Very low	38.1	Very low	45 Å²	45	113.9 Å²	113.9	46%	0.464	60%	0.596	S	S	.	*	H	α-helix	trans	-51	-29	-173.9	0	0	0	0	0	113.2	I255 Q261	I255-G257 PolarHBondContact O-N 3.3Å; G257-Q261 VanDerWaalsContact O-CB 3.26Å; G257-Q261 WeakPolarHBondContact O-CB 3.38Å; G257-Q261 WeakPolarHBondContact O-CG 3.09Å; G257-Q261 PolarHBondContact O-N 3.36Å
258	E	48	Very low	38.9	Very low	112 Å²	112	114.4 Å²	114.4	52%	0.523	59%	0.585	S	S	.	*	H	α-helix	trans	-65.6	-37.9	171.3	-70.9	-170.8	-175.3	0	0	115	N256 R262	N256-E258 CarbonylContact O-C 3.55Å; N256-E258 PolarHBondContact O-N 2.93Å; E258-R262 WeakPolarHBondContact O-CB 3.35Å; E258-R262 VanDerWaalsContact O-CG 3.27Å; E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.39Å; E258-R262 IonicContact OE2-NH2 3.36Å
259	Q	43	Very low	40	Very low	114 Å²	114	108.9 Å²	108.9	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-72.4	-37.5	176.5	-80	171.5	-16.5	0	0	111.3	I255 N256 R262 F263	I255-Q259 HydrophobicContact CG2-CB 3.9Å; N256-Q259 WeakPolarHBondContact O-CA 3.31Å; N256-Q259 PolarHBondContact O-N 3.48Å; Q259-R262 PolarHBondContact O-N 3.11Å; Q259-F263 WeakPolarHBondContact O-CB 3.34Å; Q259-F263 PolarHBondContact O-N 2.95Å
260	L	52	Low	40.8	Very low	69 Å²	69	106.8 Å²	106.8	36%	0.361	57%	0.566	S	S	.	*	H	α-helix	trans	-65.2	-45.2	171.9	-167.6	63.3	0	0	0	110	I255 N256 R262 F263 V264	I255-L260 HydrophobicContact CG2-CB 3.5Å; I255-L260 HydrophobicContact CG2-CD1 4.24Å; I255-L260 HydrophobicContact CG2-CG 4.42Å; N256-L260 PolarHBondContact O-N 2.94Å; L260-R262 VanDerWaalsContact C-N 3.32Å; L260-R262 PolarHBondContact O-N 3.29Å; L260-F263 PolarHBondContact O-N 3.36Å; L260-V264 WeakPolarHBondContact O-CB 3.45Å; L260-V264 WeakPolarHBondContact O-CG2 3.25Å; L260-V264 PolarHBondContact O-N 2.95Å
261	Q	46.7	Very low	41.3	Very low	72 Å²	72	106.1 Å²	106.1	34%	0.336	55%	0.553	S	S	.	*	H	α-helix	trans	-60.1	-40.9	173.7	-87	-171.6	-9	0	0	111.8	G257 K265 N302	G257-Q261 VanDerWaalsContact O-CB 3.26Å; G257-Q261 WeakPolarHBondContact O-CB 3.38Å; G257-Q261 WeakPolarHBondContact O-CG 3.09Å; G257-Q261 PolarHBondContact O-N 3.36Å; Q261-K265 WeakPolarHBondContact O-CA 3.11Å; Q261-K265 WeakPolarHBondContact O-CB 3.34Å; Q261-K265 WeakPolarHBondContact O-CG 3.5Å; Q261-K265 PolarHBondContact O-N 3.12Å; Q261-N302 PolarHBondContact NE2-OD1 2.76Å
262	R	50.8	Low	41.8	Very low	156 Å²	156	104.6 Å²	104.6	59%	0.589	55%	0.548	S	S	*	.	H	α-helix	trans	-66.6	-40.5	175.8	-79.5	-174.4	-141.9	-179.5	6.3	111.5	E258 Q259 L260 Q266	E258-R262 WeakPolarHBondContact O-CB 3.35Å; E258-R262 VanDerWaalsContact O-CG 3.27Å; E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.39Å; E258-R262 IonicContact OE2-NH2 3.36Å; Q259-R262 PolarHBondContact O-N 3.11Å; L260-R262 VanDerWaalsContact C-N 3.32Å; L260-R262 PolarHBondContact O-N 3.29Å; R262-Q266 WeakPolarHBondContact O-CB 2.95Å; R262-Q266 WeakPolarHBondContact O-CG 3.36Å; R262-Q266 PolarHBondContact O-N 2.82Å
263	F	53.7	Low	42.5	Very low	124 Å²	124	99.5 Å²	99.5	54%	0.544	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-49.6	176.4	-178.8	-110.1	0	0	0	111.2	Q259 L260 Q266 I267	Q259-F263 WeakPolarHBondContact O-CB 3.34Å; Q259-F263 PolarHBondContact O-N 2.95Å; L260-F263 PolarHBondContact O-N 3.36Å; F263-Q266 PolarHBondContact O-N 3.47Å; F263-I267 HydrophobicContact CD1-CD1 3.89Å; F263-I267 HydrophobicContact CE1-CD1 3.53Å; F263-I267 HydrophobicContact CE2-CD1 4.26Å; F263-I267 HydrophobicContact CG-CD1 4.4Å; F263-I267 HydrophobicContact CZ-CD1 3.74Å; F263-I267 VanDerWaalsContact O-CG1 3.31Å; F263-I267 WeakPolarHBondContact O-CG1 3.22Å; F263-I267 PolarHBondContact O-N 3.41Å
264	V	49.2	Very low	43.2	Very low	56 Å²	56	104.4 Å²	104.4	34%	0.339	54%	0.544	S	S	.	.	H	α-helix	trans	-65.3	-43.8	176	174.7	0	0	0	0	111.3	L260 Q266 I267 M268	L260-V264 WeakPolarHBondContact O-CB 3.45Å; L260-V264 WeakPolarHBondContact O-CG2 3.25Å; L260-V264 PolarHBondContact O-N 2.95Å; V264-Q266 VanDerWaalsContact C-N 3.33Å; V264-Q266 PolarHBondContact O-N 2.85Å; V264-I267 PolarHBondContact O-N 3.17Å; V264-M268 HydrophobicContact CG1-CG 4.34Å; V264-M268 WeakPolarHBondContact O-CB 3.4Å; V264-M268 VanDerWaalsContact O-CG 3.22Å; V264-M268 WeakPolarHBondContact O-CG 3.44Å; V264-M268 PolarHBondContact O-N 2.97Å
265	K	48.8	Very low	43.5	Very low	131 Å²	131	103.4 Å²	103.4	57%	0.57	54%	0.54	S	S	*	.	H	α-helix	trans	-62.4	-38.3	174.3	-79.5	176.9	177.1	173.2	0	111.4	Q261 M268 S269	Q261-K265 WeakPolarHBondContact O-CA 3.11Å; Q261-K265 WeakPolarHBondContact O-CB 3.34Å; Q261-K265 WeakPolarHBondContact O-CG 3.5Å; Q261-K265 PolarHBondContact O-N 3.12Å; K265-M268 CarbonylContact O-C 3.49Å; K265-M268 PolarHBondContact O-N 3.32Å; K265-S269 WeakPolarHBondContact O-CA 3.48Å; K265-S269 WeakPolarHBondContact O-CB 3.45Å; K265-S269 PolarHBondContact O-N 3.29Å; K265-S269 PolarHBondContact O-OG 2.98Å
266	Q	48.2	Very low	44.3	Very low	117 Å²	117	105 Å²	105	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-66.6	-40.3	175.8	-91.2	179.7	-43	0	0	111.8	R262 F263 V264 M268 S269 N270	R262-Q266 WeakPolarHBondContact O-CB 2.95Å; R262-Q266 WeakPolarHBondContact O-CG 3.36Å; R262-Q266 PolarHBondContact O-N 2.82Å; F263-Q266 PolarHBondContact O-N 3.47Å; V264-Q266 VanDerWaalsContact C-N 3.33Å; V264-Q266 PolarHBondContact O-N 2.85Å; Q266-M268 VanDerWaalsContact C-N 3.32Å; Q266-S269 WeakPolarHBondContact CA-OG 3.17Å; Q266-S269 PolarHBondContact O-OG 3.31Å; Q266-N270 WeakPolarHBondContact O-CB 3.19Å; Q266-N270 PolarHBondContact O-N 2.67Å; Q266-N270 PolarHBondContact O-ND2 3.11Å; Q266-N270 VanDerWaalsContact O-ND2 3.12Å
267	I	50.3	Low	44.5	Very low	99 Å²	99	102.2 Å²	102.2	51%	0.508	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-45.8	172.5	-68.2	165.7	0	0	0	109.6	F263 V264 A271	F263-I267 HydrophobicContact CD1-CD1 3.89Å; F263-I267 HydrophobicContact CE1-CD1 3.53Å; F263-I267 HydrophobicContact CE2-CD1 4.26Å; F263-I267 HydrophobicContact CG-CD1 4.4Å; F263-I267 HydrophobicContact CZ-CD1 3.74Å; F263-I267 VanDerWaalsContact O-CG1 3.31Å; F263-I267 WeakPolarHBondContact O-CG1 3.22Å; F263-I267 PolarHBondContact O-N 3.41Å; V264-I267 PolarHBondContact O-N 3.17Å; I267-A271 PolarHBondContact O-N 2.65Å; I267-A271 VanDerWaalsContact O-N 3.15Å
268	M	41.6	Very low	45	Very low	98 Å²	98	104.6 Å²	104.6	48%	0.483	53%	0.53	S	S	.	.	H	α-helix	trans	-73.1	-33.7	-178.4	-70.4	-70.2	-70.4	0	0	113.9	V264 K265 Q266	V264-M268 HydrophobicContact CG1-CG 4.34Å; V264-M268 WeakPolarHBondContact O-CB 3.4Å; V264-M268 VanDerWaalsContact O-CG 3.22Å; V264-M268 WeakPolarHBondContact O-CG 3.44Å; V264-M268 PolarHBondContact O-N 2.97Å; K265-M268 CarbonylContact O-C 3.49Å; K265-M268 PolarHBondContact O-N 3.32Å; Q266-M268 VanDerWaalsContact C-N 3.32Å
269	S	49.8	Very low	45	Very low	86 Å²	86	101.5 Å²	101.5	60%	0.601	52%	0.523	S	S	*	.	H	α-helix	trans	-83.5	-24.9	-179	68.1	0	0	0	0	112.2	K265 Q266	K265-S269 WeakPolarHBondContact O-CA 3.48Å; K265-S269 WeakPolarHBondContact O-CB 3.45Å; K265-S269 PolarHBondContact O-N 3.29Å; K265-S269 PolarHBondContact O-OG 2.98Å; Q266-S269 WeakPolarHBondContact CA-OG 3.17Å; Q266-S269 PolarHBondContact O-OG 3.31Å
270	N	41.1	Very low	45.4	Very low	128 Å²	128	96.9 Å²	96.9	68%	0.684	50%	0.502	S	S	*	.	H	α-helix	trans	-87	-11.2	171.3	-71.7	-37	0	0	0	113	Q266 A272	Q266-N270 WeakPolarHBondContact O-CB 3.19Å; Q266-N270 PolarHBondContact O-N 2.67Å; Q266-N270 PolarHBondContact O-ND2 3.11Å; Q266-N270 VanDerWaalsContact O-ND2 3.12Å; N270-A272 PolarHBondContact O-N 2.87Å
271	A	34.5	Very low	45.4	Very low	52 Å²	52	99 Å²	99	43%	0.43	51%	0.511	S	S	.	.	S	Bend	trans	-73.1	84.9	166.8	0	0	0	0	0	108.8	I267 G273	I267-A271 PolarHBondContact O-N 2.65Å; I267-A271 VanDerWaalsContact O-N 3.15Å; A271-G273 PolarHBondContact O-N 2.95Å
272	A	34.9	Very low	45.8	Very low	82 Å²	82	101 Å²	101	68%	0.678	53%	0.528	S	S	*	.			trans	-54.4	107.9	178.7	0	0	0	0	0	111.8	N270	N270-A272 PolarHBondContact O-N 2.87Å
273	G	39.1	Very low	46.3	Very low	50 Å²	50	98.6 Å²	98.6	52%	0.515	53%	0.53	S	S	.	.	S	Bend	trans	76.6	152.6	146.6	0	0	0	0	0	117.9	A271 F275 F276	A271-G273 PolarHBondContact O-N 2.95Å; G273-F275 PolarHBondContact O-N 2.55Å; G273-F276 PolarHBondContact O-N 2.91Å
274	Y	39.9	Very low	46.3	Very low	203 Å²	203	95.5 Å²	95.5	80%	0.796	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.4	-21	174.7	-156.6	-98.4	0	0	0	115.1	F276 D277 L278	Y274-F276 PolarHBondContact O-N 3.06Å; Y274-D277 PolarHBondContact O-N 3.05Å; Y274-L278 PolarHBondContact O-N 2.97Å
275	F	35.2	Very low	46.4	Very low	171 Å²	171	97.1 Å²	97.1	75%	0.75	53%	0.533	S	S	*	.	H	α-helix	trans	-64.4	-31.6	173.7	-75.7	-80.1	0	0	0	114.1	G273 L278 A279	G273-F275 PolarHBondContact O-N 2.55Å; F275-L278 PolarHBondContact O-N 3.45Å; F275-A279 VanDerWaalsContact O-CB 3.3Å; F275-A279 WeakPolarHBondContact O-CB 3.45Å; F275-A279 PolarHBondContact O-N 3.44Å
276	F	49.2	Very low	46.4	Very low	131 Å²	131	98.1 Å²	98.1	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-69.8	-34.1	179.8	-134.9	-88.1	0	0	0	111.9	G273 Y274 L280	G273-F276 PolarHBondContact O-N 2.91Å; Y274-F276 PolarHBondContact O-N 3.06Å; F276-L280 HydrophobicContact CD1-CD1 3.91Å; F276-L280 HydrophobicContact CD1-CG 4.18Å; F276-L280 HydrophobicContact CE1-CD1 4.39Å; F276-L280 WeakPolarHBondContact O-CB 3.34Å; F276-L280 WeakPolarHBondContact O-CG 3.38Å; F276-L280 PolarHBondContact O-N 3.41Å
277	D	40.6	Very low	46.9	Very low	51 Å²	51	96.9 Å²	96.9	27%	0.273	54%	0.536	S	S	.	.	H	α-helix	trans	-72	-36.9	176.4	-149.4	45.6	0	0	0	111.3	Y274 Q281 K291	Y274-D277 PolarHBondContact O-N 3.05Å; D277-Q281 VanDerWaalsContact O-CG 3.32Å; D277-Q281 WeakPolarHBondContact O-CG 3.29Å; D277-Q281 PolarHBondContact O-N 3.2Å; D277-Q281 VanDerWaalsContact O-N 3.08Å; D277-K291 IonicContact OD1-NZ 3.46Å; D277-K291 PolarHBondContact OD1-NZ 3.36Å
278	L	48.5	Very low	46.8	Very low	95 Å²	95	95 Å²	95	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-69.9	-38.4	175.2	-145.8	87.4	0	0	0	112.3	Y274 F275 T282	Y274-L278 PolarHBondContact O-N 2.97Å; F275-L278 PolarHBondContact O-N 3.45Å; L278-T282 PolarHBondContact O-N 3.35Å; L278-T282 PolarHBondContact O-OG1 3.38Å
279	A	48.6	Very low	47.6	Very low	46 Å²	46	94.8 Å²	94.8	38%	0.38	53%	0.529	S	S	.	.	H	α-helix	trans	-69.2	-38	175.3	0	0	0	0	0	111.8	F275 T282 T283	F275-A279 VanDerWaalsContact O-CB 3.3Å; F275-A279 WeakPolarHBondContact O-CB 3.45Å; F275-A279 PolarHBondContact O-N 3.44Å; A279-T282 WeakPolarHBondContact CA-OG1 3.25Å; A279-T282 PolarHBondContact O-N 3.03Å; A279-T282 PolarHBondContact O-OG1 3.49Å; A279-T282 VanDerWaalsContact O-OG1 3.05Å; A279-T283 WeakPolarHBondContact O-CB 3.37Å; A279-T283 PolarHBondContact O-N 2.82Å; A279-T283 PolarHBondContact O-OG1 3.06Å
280	L	51	Low	48	Very low	18 Å²	18	93.1 Å²	93.1	9%	0.094	52%	0.52	C	S	.	.	H	α-helix	trans	-68.4	-37.4	176.3	-77	173.4	0	0	0	112.7	F276 T282 V284 I287	F276-L280 HydrophobicContact CD1-CD1 3.91Å; F276-L280 HydrophobicContact CD1-CG 4.18Å; F276-L280 HydrophobicContact CE1-CD1 4.39Å; F276-L280 WeakPolarHBondContact O-CB 3.34Å; F276-L280 WeakPolarHBondContact O-CG 3.38Å; F276-L280 PolarHBondContact O-N 3.41Å; L280-T282 PolarHBondContact O-N 2.81Å; L280-V284 HydrophobicContact CD2-CG2 3.95Å; L280-V284 CarbonylContact O-C 2.87Å; L280-V284 PolarHBondContact O-N 3.17Å; L280-I287 HydrophobicContact CD1-CG2 4.35Å; L280-I287 HydrophobicContact CD2-CB 3.8Å; L280-I287 HydrophobicContact CD2-CD1 4.44Å; L280-I287 HydrophobicContact CD2-CG2 3.68Å
281	Q	51.4	Low	48.9	Very low	114 Å²	114	89.8 Å²	89.8	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-28.3	173.7	-77.1	177	28.8	0	0	113	D277 K288	D277-Q281 VanDerWaalsContact O-CG 3.32Å; D277-Q281 WeakPolarHBondContact O-CG 3.29Å; D277-Q281 PolarHBondContact O-N 3.2Å; D277-Q281 VanDerWaalsContact O-N 3.08Å; Q281-K288 HydrophobicContact CG-CD 4.35Å
282	T	56.1	Low	50.4	Low	114 Å²	114	90.1 Å²	90.1	70%	0.699	49%	0.494	S	S	*	.	H	α-helix	trans	-100.3	-28.2	-174	46.5	0	0	0	0	113.9	L278 A279 L280	L278-T282 PolarHBondContact O-N 3.35Å; L278-T282 PolarHBondContact O-OG1 3.38Å; A279-T282 WeakPolarHBondContact CA-OG1 3.25Å; A279-T282 PolarHBondContact O-N 3.03Å; A279-T282 PolarHBondContact O-OG1 3.49Å; A279-T282 VanDerWaalsContact O-OG1 3.05Å; L280-T282 PolarHBondContact O-N 2.81Å
283	T	59.8	Low	51.7	Low	104 Å²	104	93.5 Å²	93.5	64%	0.638	49%	0.49	S	S	*	.	H	α-helix	trans	-111.5	-33.3	-166.6	-27.7	0	0	0	0	114.2	A279	A279-T283 WeakPolarHBondContact O-CB 3.37Å; A279-T283 PolarHBondContact O-N 2.82Å; A279-T283 PolarHBondContact O-OG1 3.06Å
284	V	54.7	Low	52.5	Low	59 Å²	59	96.3 Å²	96.3	36%	0.358	49%	0.493	S	S	.	.			trans	-156.4	85.5	-176.5	-99.2	0	0	0	0	110.6	L280 E286 I287	L280-V284 HydrophobicContact CD2-CG2 3.95Å; L280-V284 CarbonylContact O-C 2.87Å; L280-V284 PolarHBondContact O-N 3.17Å; V284-E286 PolarHBondContact O-N 2.9Å; V284-I287 HydrophobicContact CB-CD1 4.21Å; V284-I287 HydrophobicContact CB-CG1 4.31Å; V284-I287 HydrophobicContact CG2-CD1 3.9Å; V284-I287 HydrophobicContact CG2-CG1 4.43Å; V284-I287 PolarHBondContact O-N 2.95Å
285	P	50.5	Low	53.3	Low	90 Å²	90	90.1 Å²	90.1	58%	0.584	47%	0.471	S	S	*	.	H	α-helix	trans	-63.4	-20.9	-178.3	21.9	-31	0	0	0	114.1	K288 T289	P285-K288 WeakPolarHBondContact O-CB 3.45Å; P285-K288 PolarHBondContact O-N 2.89Å; P285-T289 PolarHBondContact O-N 3.12Å
286	E	50.2	Low	54.2	Low	152 Å²	152	88.8 Å²	88.8	71%	0.71	47%	0.465	S	S	*	.	H	α-helix	trans	-69.7	-30.6	179.2	-65.4	168.4	173.6	0	0	113.3	V284 K288 T289 A290	V284-E286 PolarHBondContact O-N 2.9Å; E286-K288 VanDerWaalsContact C-N 3.29Å; E286-T289 PolarHBondContact O-OG1 2.99Å; E286-A290 PolarHBondContact O-N 3.11Å
287	I	57.8	Low	54.2	Low	92 Å²	92	86 Å²	86	47%	0.472	46%	0.456	S	S	.	.	H	α-helix	trans	-73.5	-28.8	175.7	-62.4	-178.7	0	0	0	110.2	L280 V284 A290 K291	L280-I287 HydrophobicContact CD1-CG2 4.35Å; L280-I287 HydrophobicContact CD2-CB 3.8Å; L280-I287 HydrophobicContact CD2-CD1 4.44Å; L280-I287 HydrophobicContact CD2-CG2 3.68Å; V284-I287 HydrophobicContact CB-CD1 4.21Å; V284-I287 HydrophobicContact CB-CG1 4.31Å; V284-I287 HydrophobicContact CG2-CD1 3.9Å; V284-I287 HydrophobicContact CG2-CG1 4.43Å; V284-I287 PolarHBondContact O-N 2.95Å; I287-A290 PolarHBondContact O-N 3.03Å; I287-K291 VanDerWaalsContact O-CB 3.31Å; I287-K291 WeakPolarHBondContact O-CB 3.22Å; I287-K291 PolarHBondContact O-N 2.86Å
288	K	48.6	Very low	54.5	Low	58 Å²	58	84.9 Å²	84.9	25%	0.252	45%	0.454	S	S	.	.	H	α-helix	trans	-64.5	-44.3	175.5	174.7	170.8	170.6	46.3	0	111.7	Q281 P285 E286 A290 K291 D292	Q281-K288 HydrophobicContact CG-CD 4.35Å; P285-K288 WeakPolarHBondContact O-CB 3.45Å; P285-K288 PolarHBondContact O-N 2.89Å; E286-K288 VanDerWaalsContact C-N 3.29Å; K288-A290 VanDerWaalsContact C-N 3.34Å; K288-A290 PolarHBondContact O-N 3.05Å; K288-K291 PolarHBondContact O-N 3.44Å; K288-D292 WeakPolarHBondContact CE-OD2 3.38Å; K288-D292 IonicContact NZ-OD1 2.86Å; K288-D292 PolarHBondContact NZ-OD1 3.33Å; K288-D292 IonicContact NZ-OD2 2.73Å; K288-D292 PolarHBondContact NZ-OD2 3.29Å; K288-D292 WeakPolarHBondContact O-CB 3.26Å; K288-D292 PolarHBondContact O-N 2.95Å
289	T	58.1	Low	54.7	Low	95 Å²	95	83.8 Å²	83.8	58%	0.583	45%	0.454	S	S	*	.	H	α-helix	trans	-65.3	-37.9	177.2	45.9	0	0	0	0	111.9	P285 E286 D292 Y293	P285-T289 PolarHBondContact O-N 3.12Å; E286-T289 PolarHBondContact O-OG1 2.99Å; T289-D292 PolarHBondContact O-N 3.15Å; T289-Y293 VanDerWaalsContact O-CB 3.25Å; T289-Y293 WeakPolarHBondContact O-CB 3.25Å; T289-Y293 PolarHBondContact O-N 3.05Å
290	A	58.7	Low	54.4	Low	51 Å²	51	85.4 Å²	85.4	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-64.5	-43.1	172.8	0	0	0	0	0	112.4	E286 I287 K288 Y293 L294	E286-A290 PolarHBondContact O-N 3.11Å; I287-A290 PolarHBondContact O-N 3.03Å; K288-A290 VanDerWaalsContact C-N 3.34Å; K288-A290 PolarHBondContact O-N 3.05Å; A290-Y293 PolarHBondContact O-N 3.46Å; A290-L294 WeakPolarHBondContact O-CB 3.21Å; A290-L294 VanDerWaalsContact O-CG 3.29Å; A290-L294 WeakPolarHBondContact O-CG 3.39Å; A290-L294 PolarHBondContact O-N 3.12Å
291	K	59.6	Low	54.1	Low	58 Å²	58	88.8 Å²	88.8	25%	0.252	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-49.3	173.6	177.8	-147.3	172.7	-152.3	0	111.2	D277 I287 K288 Y293 L294 Q295	D277-K291 IonicContact OD1-NZ 3.46Å; D277-K291 PolarHBondContact OD1-NZ 3.36Å; I287-K291 VanDerWaalsContact O-CB 3.31Å; I287-K291 WeakPolarHBondContact O-CB 3.22Å; I287-K291 PolarHBondContact O-N 2.86Å; K288-K291 PolarHBondContact O-N 3.44Å; K291-Y293 VanDerWaalsContact C-N 3.32Å; K291-Y293 PolarHBondContact O-N 3.04Å; K291-L294 PolarHBondContact O-N 2.79Å; K291-Q295 VanDerWaalsContact CE-OE1 3.25Å; K291-Q295 WeakPolarHBondContact O-CB 3.22Å; K291-Q295 WeakPolarHBondContact O-CG 3.16Å; K291-Q295 PolarHBondContact O-N 3.14Å
292	D	65.9	Low	53.7	Low	59 Å²	59	87.5 Å²	87.5	32%	0.316	47%	0.47	S	S	.	.	H	α-helix	trans	-64.2	-38.1	-179.7	-68.4	-15.5	0	0	0	110.5	K288 T289 K296	K288-D292 WeakPolarHBondContact CE-OD2 3.38Å; K288-D292 IonicContact NZ-OD1 2.86Å; K288-D292 PolarHBondContact NZ-OD1 3.33Å; K288-D292 IonicContact NZ-OD2 2.73Å; K288-D292 PolarHBondContact NZ-OD2 3.29Å; K288-D292 WeakPolarHBondContact O-CB 3.26Å; K288-D292 PolarHBondContact O-N 2.95Å; T289-D292 PolarHBondContact O-N 3.15Å; D292-K296 VanDerWaalsContact O-CB 3.27Å; D292-K296 WeakPolarHBondContact O-CB 3.33Å; D292-K296 PolarHBondContact O-N 3.37Å
293	Y	62.6	Low	53.1	Low	153 Å²	153	83.9 Å²	83.9	60%	0.6	45%	0.45	S	S	*	.	H	α-helix	trans	-63.9	-46.9	172.3	176.9	-99.1	0	0	0	112.3	T289 A290 K291 K296 L297	T289-Y293 VanDerWaalsContact O-CB 3.25Å; T289-Y293 WeakPolarHBondContact O-CB 3.25Å; T289-Y293 PolarHBondContact O-N 3.05Å; A290-Y293 PolarHBondContact O-N 3.46Å; K291-Y293 VanDerWaalsContact C-N 3.32Å; K291-Y293 PolarHBondContact O-N 3.04Å; Y293-K296 PolarHBondContact O-N 3.04Å; Y293-L297 HydrophobicContact CE1-CD1 4.27Å; Y293-L297 WeakPolarHBondContact O-CB 3.49Å; Y293-L297 PolarHBondContact O-N 2.06Å
294	L	54.6	Low	52.4	Low	109 Å²	109	86 Å²	86	57%	0.571	45%	0.454	S	S	*	.	H	α-helix	trans	-65.6	-38.4	177.2	-74.3	172	0	0	0	112	A290 K291 L297 A298	A290-L294 WeakPolarHBondContact O-CB 3.21Å; A290-L294 VanDerWaalsContact O-CG 3.29Å; A290-L294 WeakPolarHBondContact O-CG 3.39Å; A290-L294 PolarHBondContact O-N 3.12Å; K291-L294 PolarHBondContact O-N 2.79Å; L294-L297 PolarHBondContact O-N 3.37Å; L294-A298 VanDerWaalsContact O-CB 3.22Å; L294-A298 WeakPolarHBondContact O-CB 3.3Å; L294-A298 PolarHBondContact O-N 3.18Å
295	Q	56.8	Low	51.6	Low	73 Å²	73	90.5 Å²	90.5	34%	0.341	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-42.8	173.7	-77.8	-176.8	-64.2	0	0	111.1	K291 A298 S299	K291-Q295 VanDerWaalsContact CE-OE1 3.25Å; K291-Q295 WeakPolarHBondContact O-CB 3.22Å; K291-Q295 WeakPolarHBondContact O-CG 3.16Å; K291-Q295 PolarHBondContact O-N 3.14Å; Q295-A298 PolarHBondContact O-N 2.81Å; Q295-S299 VanDerWaalsContact O-CB 3.26Å; Q295-S299 WeakPolarHBondContact O-CB 3.39Å; Q295-S299 PolarHBondContact O-N 3.1Å
296	K	54.4	Low	51.1	Low	142 Å²	142	90.2 Å²	90.2	62%	0.617	47%	0.469	S	S	*	.	H	α-helix	trans	-62.7	-48	175	-171.5	172.9	-180	-179.8	0	110.9	D292 Y293 A298 S299 D300	D292-K296 VanDerWaalsContact O-CB 3.27Å; D292-K296 WeakPolarHBondContact O-CB 3.33Å; D292-K296 PolarHBondContact O-N 3.37Å; Y293-K296 PolarHBondContact O-N 3.04Å; K296-A298 PolarHBondContact O-N 3.02Å; K296-S299 CarbonylContact O-C 3.59Å; K296-S299 WeakPolarHBondContact O-CB 3.27Å; K296-S299 PolarHBondContact O-N 2.93Å; K296-D300 WeakPolarHBondContact O-CB 3.32Å; K296-D300 PolarHBondContact O-N 2.98Å
297	L	49.4	Very low	50.9	Low	73 Å²	73	86.1 Å²	86.1	38%	0.382	46%	0.457	S	S	.	.	H	α-helix	trans	-61.7	-42.9	176.9	-168.3	118.2	0	0	0	112.5	Y293 L294 S299 D300 I301	Y293-L297 HydrophobicContact CE1-CD1 4.27Å; Y293-L297 WeakPolarHBondContact O-CB 3.49Å; Y293-L297 PolarHBondContact O-N 2.06Å; L294-L297 PolarHBondContact O-N 3.37Å; L297-S299 VanDerWaalsContact C-N 3.34Å; L297-D300 PolarHBondContact O-N 3.42Å; L297-I301 HydrophobicContact CD2-CD1 3.77Å; L297-I301 HydrophobicContact CG-CD1 4.23Å; L297-I301 WeakPolarHBondContact O-CB 2.66Å; L297-I301 VanDerWaalsContact O-CG1 3.24Å; L297-I301 WeakPolarHBondContact O-CG1 2.84Å; L297-I301 PolarHBondContact O-N 3.23Å
298	A	47.8	Very low	50.7	Low	27 Å²	27	85.5 Å²	85.5	22%	0.223	46%	0.461	C	S	.	.	H	α-helix	trans	-67	-35	175.9	0	0	0	0	0	112.4	L294 Q295 K296 N302	L294-A298 VanDerWaalsContact O-CB 3.22Å; L294-A298 WeakPolarHBondContact O-CB 3.3Å; L294-A298 PolarHBondContact O-N 3.18Å; Q295-A298 PolarHBondContact O-N 2.81Å; K296-A298 PolarHBondContact O-N 3.02Å; A298-N302 WeakPolarHBondContact O-CB 3.16Å; A298-N302 PolarHBondContact O-N 3.08Å; A298-N302 VanDerWaalsContact O-N 3.11Å; A298-N302 PolarHBondContact O-ND2 2.73Å
299	S	52	Low	51.1	Low	72 Å²	72	86.5 Å²	86.5	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-68.1	-42.8	172	-172.1	0	0	0	0	111.1	Q295 K296 L297 I301 N302 S303	Q295-S299 VanDerWaalsContact O-CB 3.26Å; Q295-S299 WeakPolarHBondContact O-CB 3.39Å; Q295-S299 PolarHBondContact O-N 3.1Å; K296-S299 CarbonylContact O-C 3.59Å; K296-S299 WeakPolarHBondContact O-CB 3.27Å; K296-S299 PolarHBondContact O-N 2.93Å; L297-S299 VanDerWaalsContact C-N 3.34Å; S299-I301 VanDerWaalsContact C-N 3.35Å; S299-I301 PolarHBondContact O-N 3.46Å; S299-N302 CarbonylContact O-C 3.48Å; S299-N302 PolarHBondContact O-N 3.19Å; S299-S303 WeakPolarHBondContact O-CB 3.32Å; S299-S303 PolarHBondContact O-N 2.73Å; S299-S303 PolarHBondContact O-OG 2.93Å
300	D	42.7	Very low	51	Low	81 Å²	81	87.6 Å²	87.6	43%	0.433	47%	0.473	S	S	.	.	H	α-helix	trans	-66.4	-35.2	179.4	-68.3	-14.3	0	0	0	111.5	K296 L297 S303 M304	K296-D300 WeakPolarHBondContact O-CB 3.32Å; K296-D300 PolarHBondContact O-N 2.98Å; L297-D300 PolarHBondContact O-N 3.42Å; D300-S303 VanDerWaalsContact CA-OG 3.25Å; D300-S303 WeakPolarHBondContact CA-OG 3.49Å; D300-S303 PolarHBondContact O-N 2.93Å; D300-S303 PolarHBondContact O-OG 3.43Å; D300-M304 WeakPolarHBondContact O-CG 3.39Å; D300-M304 PolarHBondContact O-N 3.07Å
301	I	45.4	Very low	51.2	Low	88 Å²	88	88.7 Å²	88.7	45%	0.451	48%	0.475	S	S	.	.	H	α-helix	trans	-68.8	-43.4	172.1	-69.8	166.4	0	0	0	111.1	L297 S299 S303 M304	L297-I301 HydrophobicContact CD2-CD1 3.77Å; L297-I301 HydrophobicContact CG-CD1 4.23Å; L297-I301 WeakPolarHBondContact O-CB 2.66Å; L297-I301 VanDerWaalsContact O-CG1 3.24Å; L297-I301 WeakPolarHBondContact O-CG1 2.84Å; L297-I301 PolarHBondContact O-N 3.23Å; S299-I301 VanDerWaalsContact C-N 3.35Å; S299-I301 PolarHBondContact O-N 3.46Å; I301-S303 VanDerWaalsContact C-N 3.26Å; I301-S303 PolarHBondContact O-N 3.44Å; I301-M304 PolarHBondContact O-N 3.24Å
302	N	43.2	Very low	51.7	Low	87 Å²	87	87.3 Å²	87.3	47%	0.465	47%	0.474	S	S	.	.	H	α-helix	trans	-69.6	-25.8	175.8	-78.5	-46.1	0	0	0	112.5	Q261 A298 S299 M304	Q261-N302 PolarHBondContact NE2-OD1 2.76Å; A298-N302 WeakPolarHBondContact O-CB 3.16Å; A298-N302 PolarHBondContact O-N 3.08Å; A298-N302 VanDerWaalsContact O-N 3.11Å; A298-N302 PolarHBondContact O-ND2 2.73Å; S299-N302 CarbonylContact O-C 3.48Å; S299-N302 PolarHBondContact O-N 3.19Å; N302-M304 VanDerWaalsContact C-N 3.29Å
303	S	41.9	Very low	51.9	Low	39 Å²	39	91.4 Å²	91.4	27%	0.273	49%	0.491	S	S	.	.	H	α-helix	trans	-81.4	-6.9	-179.9	76.6	0	0	0	0	113.4	S299 D300 I301 N305 L306	S299-S303 WeakPolarHBondContact O-CB 3.32Å; S299-S303 PolarHBondContact O-N 2.73Å; S299-S303 PolarHBondContact O-OG 2.93Å; D300-S303 VanDerWaalsContact CA-OG 3.25Å; D300-S303 WeakPolarHBondContact CA-OG 3.49Å; D300-S303 PolarHBondContact O-N 2.93Å; D300-S303 PolarHBondContact O-OG 3.43Å; I301-S303 VanDerWaalsContact C-N 3.26Å; I301-S303 PolarHBondContact O-N 3.44Å; S303-N305 PolarHBondContact O-N 3.46Å; S303-N305 VanDerWaalsContact O-N 3.11Å; S303-L306 VanDerWaalsContact O-CB 3.28Å; S303-L306 WeakPolarHBondContact O-CB 3.37Å; S303-L306 WeakPolarHBondContact O-CG 3.24Å; S303-L306 PolarHBondContact O-N 2.76Å
304	M	44.7	Very low	52.7	Low	149 Å²	149	86.6 Å²	86.6	73%	0.734	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.2	169.6	-61	-170	78.9	0	0	113.2	D300 I301 N302	D300-M304 WeakPolarHBondContact O-CG 3.39Å; D300-M304 PolarHBondContact O-N 3.07Å; I301-M304 PolarHBondContact O-N 3.24Å; N302-M304 VanDerWaalsContact C-N 3.29Å
305	N	39.8	Very low	53.8	Low	153 Å²	153	83 Å²	83	82%	0.818	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	16.2	170.6	-159.2	18.7	0	0	0	113	S303 S307	S303-N305 PolarHBondContact O-N 3.46Å; S303-N305 VanDerWaalsContact O-N 3.11Å; N305-S307 PolarHBondContact O-N 3.44Å
306	L	39.3	Very low	55.2	Low	84 Å²	84	81.5 Å²	81.5	44%	0.44	47%	0.465	S	S	.	.	S	Bend	trans	-63.7	133.2	166.6	-73.1	175.1	0	0	0	108.6	S303 S308 V311	S303-L306 VanDerWaalsContact O-CB 3.28Å; S303-L306 WeakPolarHBondContact O-CB 3.37Å; S303-L306 WeakPolarHBondContact O-CG 3.24Å; S303-L306 PolarHBondContact O-N 2.76Å; L306-S308 PolarHBondContact O-N 3.24Å; L306-V311 HydrophobicContact CB-CG2 3.75Å; L306-V311 HydrophobicContact CD1-CG2 3.9Å
307	S	46	Very low	56.5	Low	65 Å²	65	77.1 Å²	77.1	46%	0.455	46%	0.461	S	S	.	.			trans	-55.1	128.8	169.8	176.1	0	0	0	0	108.6	N305 C309 Q310 V311	N305-S307 PolarHBondContact O-N 3.44Å; S307-C309 PolarHBondContact O-N 3.44Å; S307-Q310 PolarHBondContact O-N 2.81Å; S307-V311 PolarHBondContact O-N 2.75Å
308	S	53.2	Low	58.2	Low	80 Å²	80	75.8 Å²	75.8	56%	0.559	46%	0.464	S	S	*	.	H	α-helix	trans	-51	-28.9	179.8	52	0	0	0	0	112.7	L306 A312	L306-S308 PolarHBondContact O-N 3.24Å; S308-A312 VanDerWaalsContact O-CB 3.27Å; S308-A312 WeakPolarHBondContact O-CB 3.24Å; S308-A312 PolarHBondContact O-N 2.91Å
309	C	57.6	Low	60	Low	78 Å²	78	74.6 Å²	74.6	53%	0.527	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-40.1	174.5	-60.6	0	0	0	0	113.5	S307 A312 Q313	S307-C309 PolarHBondContact O-N 3.44Å; C309-A312 PolarHBondContact O-N 3.33Å; C309-Q313 VanDerWaalsContact O-CG 3.31Å; C309-Q313 WeakPolarHBondContact O-CG 3.22Å; C309-Q313 PolarHBondContact O-N 3.49Å
310	Q	55.4	Low	61.6	Low	118 Å²	118	75.8 Å²	75.8	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-69.6	-40.9	179.4	-74.4	179.5	-19.6	0	0	111.3	S307 Q313 G314	S307-Q310 PolarHBondContact O-N 2.81Å; Q310-Q313 PolarHBondContact O-N 2.68Å; Q310-G314 PolarHBondContact O-N 3.05Å; Q310-G314 VanDerWaalsContact O-N 3.07Å
311	V	63.5	Low	63.7	Low	75 Å²	75	75.1 Å²	75.1	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-63	-45.2	174	178.9	0	0	0	0	110.3	L306 S307 Q313 G314 L315	L306-V311 HydrophobicContact CB-CG2 3.75Å; L306-V311 HydrophobicContact CD1-CG2 3.9Å; S307-V311 PolarHBondContact O-N 2.75Å; V311-Q313 PolarHBondContact O-N 3.45Å; V311-G314 PolarHBondContact O-N 3.11Å; V311-L315 VanDerWaalsContact O-CB 3.28Å; V311-L315 WeakPolarHBondContact O-CB 3.04Å; V311-L315 PolarHBondContact O-N 3.19Å
312	A	68.7	Low	65.5	Low	29 Å²	29	76.4 Å²	76.4	24%	0.24	45%	0.454	C	S	.	.	H	α-helix	trans	-59.3	-44.8	177.1	0	0	0	0	0	112.2	S308 C309 L315 V316 P416	S308-A312 VanDerWaalsContact O-CB 3.27Å; S308-A312 WeakPolarHBondContact O-CB 3.24Å; S308-A312 PolarHBondContact O-N 2.91Å; C309-A312 PolarHBondContact O-N 3.33Å; A312-L315 PolarHBondContact O-N 2.89Å; A312-V316 WeakPolarHBondContact O-CB 3.32Å; A312-V316 VanDerWaalsContact O-CG2 3.22Å; A312-V316 WeakPolarHBondContact O-CG2 3.38Å; A312-V316 PolarHBondContact O-N 3.3Å; A312-P416 HydrophobicContact CB-CG 3.75Å
313	Q	71.2	Confident	67.6	Low	144 Å²	144	72.6 Å²	72.6	67%	0.673	43%	0.434	S	S	*	.	H	α-helix	trans	-62.6	-43.5	177.6	-75.4	174.6	-13.1	0	0	112.6	C309 Q310 V311 G317	C309-Q313 VanDerWaalsContact O-CG 3.31Å; C309-Q313 WeakPolarHBondContact O-CG 3.22Å; C309-Q313 PolarHBondContact O-N 3.49Å; Q310-Q313 PolarHBondContact O-N 2.68Å; V311-Q313 PolarHBondContact O-N 3.45Å; Q313-G317 PolarHBondContact O-N 2.88Å
314	G	78.6	Confident	69.6	Low	53 Å²	53	74.3 Å²	74.3	55%	0.546	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-43.1	177	0	0	0	0	0	112.5	Q310 V311 G317 G318	Q310-G314 PolarHBondContact O-N 3.05Å; Q310-G314 VanDerWaalsContact O-N 3.07Å; V311-G314 PolarHBondContact O-N 3.11Å; G314-G317 PolarHBondContact O-N 3.29Å; G314-G318 PolarHBondContact O-N 3.36Å
315	L	79.2	Confident	71.6	Confident	33 Å²	33	71.9 Å²	71.9	17%	0.173	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-48.1	177.2	176.4	56.5	0	0	0	112	V311 A312 G317 G318 L319 L406 P416 N556	V311-L315 VanDerWaalsContact O-CB 3.28Å; V311-L315 WeakPolarHBondContact O-CB 3.04Å; V311-L315 PolarHBondContact O-N 3.19Å; A312-L315 PolarHBondContact O-N 2.89Å; L315-G317 VanDerWaalsContact C-N 3.33Å; L315-G317 PolarHBondContact O-N 3.15Å; L315-G318 PolarHBondContact O-N 3.38Å; L315-L319 HydrophobicContact CD1-CD1 3.64Å; L315-L319 HydrophobicContact CD1-CG 4.05Å; L315-L319 HydrophobicContact CG-CD1 4.05Å; L315-L319 WeakPolarHBondContact O-CB 3.47Å; L315-L319 PolarHBondContact O-N 2.95Å; L315-L406 HydrophobicContact CD2-CD2 4.09Å; L315-P416 HydrophobicContact CD2-CB 3.36Å; L315-P416 HydrophobicContact CD2-CG 3.93Å; L315-P416 HydrophobicContact CG-CB 4.27Å; L315-P416 HydrophobicContact CG-CG 4.47Å; L315-N556 HydrophobicContact CD1-CB 4.27Å; L315-N556 WeakPolarHBondContact CD1-OD1 3.08Å
316	V	84.3	Confident	73.9	Confident	42 Å²	42	66 Å²	66	26%	0.255	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-43.7	175.5	173.5	0	0	0	0	110.5	A312 G318 L319 F320 I414 P416	A312-V316 WeakPolarHBondContact O-CB 3.32Å; A312-V316 VanDerWaalsContact O-CG2 3.22Å; A312-V316 WeakPolarHBondContact O-CG2 3.38Å; A312-V316 PolarHBondContact O-N 3.3Å; V316-G318 VanDerWaalsContact C-N 3.31Å; V316-G318 PolarHBondContact O-N 2.85Å; V316-L319 PolarHBondContact O-N 3.42Å; V316-F320 WeakPolarHBondContact O-CB 3.49Å; V316-F320 PolarHBondContact O-N 3.05Å; V316-I414 HydrophobicContact CG1-CB 4.37Å; V316-I414 HydrophobicContact CG2-CB 4.14Å; V316-I414 HydrophobicContact CG2-CG2 4.3Å; V316-I414 WeakPolarHBondContact CG2-O 3.08Å; V316-P416 HydrophobicContact CG2-CG 4.14Å
317	G	82.4	Confident	76.2	Confident	50 Å²	50	62.3 Å²	62.3	52%	0.515	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-35.2	176.9	0	0	0	0	0	114.1	Q313 G314 L315 P321	Q313-G317 PolarHBondContact O-N 2.88Å; G314-G317 PolarHBondContact O-N 3.29Å; L315-G317 VanDerWaalsContact C-N 3.33Å; L315-G317 PolarHBondContact O-N 3.15Å; G317-P321 WeakPolarHBondContact O-CD 3.41Å
318	G	85.1	Confident	78.2	Confident	44 Å²	44	63.2 Å²	63.2	45%	0.454	37%	0.37	S	S	.	.	H	α-helix	trans	-77.9	-40.2	176.4	0	0	0	0	0	113.8	G314 L315 V316	G314-G318 PolarHBondContact O-N 3.36Å; L315-G318 PolarHBondContact O-N 3.38Å; V316-G318 VanDerWaalsContact C-N 3.31Å; V316-G318 PolarHBondContact O-N 2.85Å
319	L	86.5	Confident	79.9	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-75.5	-41.2	-179.4	-80.4	174.7	0	0	0	112.7	L315 V316 Q322 T323 L406 I414 A552 N556	L315-L319 HydrophobicContact CD1-CD1 3.64Å; L315-L319 HydrophobicContact CD1-CG 4.05Å; L315-L319 HydrophobicContact CG-CD1 4.05Å; L315-L319 WeakPolarHBondContact O-CB 3.47Å; L315-L319 PolarHBondContact O-N 2.95Å; V316-L319 PolarHBondContact O-N 3.42Å; L319-Q322 PolarHBondContact O-N 2.83Å; L319-Q322 VanDerWaalsContact O-N 3.12Å; L319-T323 HydrophobicContact CB-CG2 4.41Å; L319-T323 WeakPolarHBondContact O-CB 3.3Å; L319-T323 VanDerWaalsContact O-CG2 3.24Å; L319-T323 WeakPolarHBondContact O-CG2 3.35Å; L319-T323 PolarHBondContact O-N 3.28Å; L319-T323 PolarHBondContact O-OG1 2.87Å; L319-L406 HydrophobicContact CD1-CD1 3.74Å; L319-L406 HydrophobicContact CD1-CD2 4.12Å; L319-I414 HydrophobicContact CB-CD1 3.84Å; L319-I414 HydrophobicContact CD1-CG2 4.3Å; L319-A552 HydrophobicContact CD2-CB 4.12Å; L319-A552 WeakPolarHBondContact CD2-O 3.46Å; L319-N556 HydrophobicContact CD1-CB 4.49Å; L319-N556 WeakPolarHBondContact CD2-ND2 3.36Å
320	F	85.4	Confident	81.4	Confident	98 Å²	98	61.8 Å²	61.8	43%	0.43	34%	0.344	S	S	.	.	H	α-helix	trans	-49.2	-53.6	-175.2	-173.8	-100.1	0	0	0	113.5	V316 Q322 T323 Q324 I414	V316-F320 WeakPolarHBondContact O-CB 3.49Å; V316-F320 PolarHBondContact O-N 3.05Å; F320-Q322 PolarHBondContact O-N 3.07Å; F320-T323 PolarHBondContact O-N 2.94Å; F320-T323 PolarHBondContact O-OG1 3.44Å; F320-Q324 HydrophobicContact CD1-CG 4.4Å; F320-Q324 HydrophobicContact CE1-CG 4.17Å; F320-Q324 HydrophobicContact CE2-CG 4.49Å; F320-Q324 HydrophobicContact CZ-CG 4.22Å; F320-Q324 VanDerWaalsContact O-CG 3.24Å; F320-Q324 WeakPolarHBondContact O-CG 3.41Å; F320-Q324 PolarHBondContact O-N 2.84Å; F320-I414 HydrophobicContact CB-CD1 4.39Å
321	P	85.8	Confident	83.1	Confident	66 Å²	66	56.1 Å²	56.1	43%	0.429	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-40.3	178.8	25.7	-34.6	0	0	0	113.4	G317 T323 Q324 E325	G317-P321 WeakPolarHBondContact O-CD 3.41Å; P321-T323 VanDerWaalsContact C-N 3.35Å; P321-T323 PolarHBondContact O-N 3.44Å; P321-Q324 PolarHBondContact O-N 3.46Å; P321-E325 WeakPolarHBondContact O-CG 3.4Å; P321-E325 PolarHBondContact O-N 3.18Å; P321-E325 VanDerWaalsContact O-N 3.1Å
322	Q	84.3	Confident	84.4	Confident	116 Å²	116	54.1 Å²	54.1	54%	0.542	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-41.2	179.3	-66.5	-63.6	-26.6	0	0	111.6	L319 F320 E325 S326 A552	L319-Q322 PolarHBondContact O-N 2.83Å; L319-Q322 VanDerWaalsContact O-N 3.12Å; F320-Q322 PolarHBondContact O-N 3.07Å; Q322-E325 PolarHBondContact O-N 3.4Å; Q322-S326 WeakPolarHBondContact O-CB 3.38Å; Q322-S326 PolarHBondContact O-N 2.85Å; Q322-A552 HydrophobicContact CB-CB 3.75Å; Q322-A552 HydrophobicContact CG-CB 4.28Å
323	T	85.8	Confident	85.4	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.043	31%	0.305	C	S	.	.	H	α-helix	trans	-68.9	-39.8	177.8	60.9	0	0	0	0	111.3	L319 F320 P321 E325 S326 Q327 L373 F408 I414 V553	L319-T323 HydrophobicContact CB-CG2 4.41Å; L319-T323 WeakPolarHBondContact O-CB 3.3Å; L319-T323 VanDerWaalsContact O-CG2 3.24Å; L319-T323 WeakPolarHBondContact O-CG2 3.35Å; L319-T323 PolarHBondContact O-N 3.28Å; L319-T323 PolarHBondContact O-OG1 2.87Å; F320-T323 PolarHBondContact O-N 2.94Å; F320-T323 PolarHBondContact O-OG1 3.44Å; P321-T323 VanDerWaalsContact C-N 3.35Å; P321-T323 PolarHBondContact O-N 3.44Å; T323-E325 PolarHBondContact O-N 2.93Å; T323-S326 PolarHBondContact O-N 3.4Å; T323-Q327 WeakPolarHBondContact O-CB 3.35Å; T323-Q327 VanDerWaalsContact O-CG 3.22Å; T323-Q327 WeakPolarHBondContact O-CG 3.35Å; T323-Q327 PolarHBondContact O-N 2.99Å; T323-L373 HydrophobicContact CG2-CD1 3.53Å; T323-F408 HydrophobicContact CG2-CE1 3.96Å; T323-F408 HydrophobicContact CG2-CZ 4.31Å; T323-I414 HydrophobicContact CG2-CD1 4.38Å; T323-V553 HydrophobicContact CG2-CG2 4.25Å
324	Q	85.4	Confident	86.2	Confident	75 Å²	75	48.5 Å²	48.5	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-59.2	-46.6	174.2	-69.6	-65.2	-13.4	0	0	112	F320 P321 Q327 R328	F320-Q324 HydrophobicContact CD1-CG 4.4Å; F320-Q324 HydrophobicContact CE1-CG 4.17Å; F320-Q324 HydrophobicContact CE2-CG 4.49Å; F320-Q324 HydrophobicContact CZ-CG 4.22Å; F320-Q324 VanDerWaalsContact O-CG 3.24Å; F320-Q324 WeakPolarHBondContact O-CG 3.41Å; F320-Q324 PolarHBondContact O-N 2.84Å; P321-Q324 PolarHBondContact O-N 3.46Å; Q324-Q327 PolarHBondContact O-N 3.38Å; Q324-R328 PolarHBondContact O-N 3.43Å
325	E	86.9	Confident	86.8	Confident	98 Å²	98	46 Å²	46	46%	0.458	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-43.7	176.3	-72	-66.8	127.5	0	0	112	P321 Q322 T323 R328 K329	P321-E325 WeakPolarHBondContact O-CG 3.4Å; P321-E325 PolarHBondContact O-N 3.18Å; P321-E325 VanDerWaalsContact O-N 3.1Å; Q322-E325 PolarHBondContact O-N 3.4Å; T323-E325 PolarHBondContact O-N 2.93Å; E325-R328 PolarHBondContact O-N 3.42Å; E325-R328 IonicContact OE1-CZ 3.76Å; E325-R328 IonicContact OE1-NH1 3.99Å; E325-R328 PolarHBondContact OE1-NH1 3.19Å; E325-R328 IonicContact OE1-NH2 2.82Å; E325-R328 IonicContact OE2-CZ 2.79Å; E325-R328 IonicContact OE2-NH1 2.67Å; E325-R328 PolarHBondContact OE2-NH1 2.91Å; E325-R328 IonicContact OE2-NH2 3.85Å; E325-R328 PolarHBondContact OE2-NH2 2.97Å; E325-K329 PolarHBondContact O-N 3.1Å
326	S	87	Confident	87.1	Confident	30 Å²	30	48.3 Å²	48.3	21%	0.21	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-44.3	174.8	-176.8	0	0	0	0	112.1	Q322 T323 R328 K329 V330 P550	Q322-S326 WeakPolarHBondContact O-CB 3.38Å; Q322-S326 PolarHBondContact O-N 2.85Å; T323-S326 PolarHBondContact O-N 3.4Å; S326-R328 VanDerWaalsContact C-N 3.32Å; S326-R328 PolarHBondContact O-N 2.87Å; S326-K329 PolarHBondContact O-N 3.35Å; S326-V330 VanDerWaalsContact O-CG2 3.28Å; S326-V330 WeakPolarHBondContact O-CG2 3.28Å; S326-V330 PolarHBondContact O-N 2.91Å; S326-P550 WeakPolarHBondContact OG-CB 3.44Å; S326-P550 WeakPolarHBondContact OG-CG 3.35Å
327	Q	87.6	Confident	87.1	Confident	6 Å²	6	52 Å²	52	3%	0.028	28%	0.282	C	S	.	.	H	α-helix	trans	-68.2	-32.3	-179.1	-69.9	-40.8	-65	0	0	111.9	T323 Q324 V330 C331 R371 L373	T323-Q327 WeakPolarHBondContact O-CB 3.35Å; T323-Q327 VanDerWaalsContact O-CG 3.22Å; T323-Q327 WeakPolarHBondContact O-CG 3.35Å; T323-Q327 PolarHBondContact O-N 2.99Å; Q324-Q327 PolarHBondContact O-N 3.38Å; Q327-V330 PolarHBondContact O-N 3.49Å; Q327-C331 WeakPolarHBondContact O-CB 3.34Å; Q327-C331 PolarHBondContact O-N 3.49Å; Q327-R371 PolarHBondContact NE2-O 2.81Å; Q327-R371 PolarHBondContact OE1-O 3.44Å; Q327-L373 HydrophobicContact CG-CB 4.46Å; Q327-L373 VanDerWaalsContact NE2-CG 3.3Å; Q327-L373 VanDerWaalsContact OE1-N 3.15Å
328	R	88.6	Confident	87.3	Confident	83 Å²	83	52.2 Å²	52.2	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-47.1	170.4	-175.1	-179.8	72.4	-148.1	2.5	111.3	Q324 E325 S326 C331 Q332 T352	Q324-R328 PolarHBondContact O-N 3.43Å; E325-R328 PolarHBondContact O-N 3.42Å; E325-R328 IonicContact OE1-CZ 3.76Å; E325-R328 IonicContact OE1-NH1 3.99Å; E325-R328 PolarHBondContact OE1-NH1 3.19Å; E325-R328 IonicContact OE1-NH2 2.82Å; E325-R328 IonicContact OE2-CZ 2.79Å; E325-R328 IonicContact OE2-NH1 2.67Å; E325-R328 PolarHBondContact OE2-NH1 2.91Å; E325-R328 IonicContact OE2-NH2 3.85Å; E325-R328 PolarHBondContact OE2-NH2 2.97Å; S326-R328 VanDerWaalsContact C-N 3.32Å; S326-R328 PolarHBondContact O-N 2.87Å; R328-C331 PolarHBondContact O-N 3.47Å; R328-Q332 WeakPolarHBondContact O-CG 3.34Å; R328-Q332 PolarHBondContact O-N 3.31Å; R328-Q332 VanDerWaalsContact O-N 3.09Å; R328-T352 HydrophobicContact CG-CG2 3.8Å
329	K	89	Confident	87.4	Confident	127 Å²	127	56.8 Å²	56.8	55%	0.552	29%	0.289	S	S	*	.	H	α-helix	trans	-62.4	-46.5	177.5	-175.9	175.2	179.3	178.9	0	111.6	E325 S326 C331 Q332 D333	E325-K329 PolarHBondContact O-N 3.1Å; S326-K329 PolarHBondContact O-N 3.35Å; K329-C331 VanDerWaalsContact C-N 3.32Å; K329-C331 PolarHBondContact O-N 3.33Å; K329-Q332 PolarHBondContact O-N 2.86Å; K329-Q332 VanDerWaalsContact O-N 3.1Å; K329-D333 VanDerWaalsContact O-CG 3.32Å; K329-D333 PolarHBondContact O-N 2.96Å
330	V	88.9	Confident	87.6	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-42.5	177.4	172.3	0	0	0	0	111.7	S326 Q327 Q332 D333 I334 R371 V372	S326-V330 VanDerWaalsContact O-CG2 3.28Å; S326-V330 WeakPolarHBondContact O-CG2 3.28Å; S326-V330 PolarHBondContact O-N 2.91Å; Q327-V330 PolarHBondContact O-N 3.49Å; V330-Q332 VanDerWaalsContact C-N 3.35Å; V330-Q332 PolarHBondContact O-N 3.38Å; V330-D333 PolarHBondContact O-N 3.5Å; V330-I334 HydrophobicContact CG1-CD1 3.63Å; V330-I334 HydrophobicContact CG1-CG1 4.41Å; V330-I334 WeakPolarHBondContact O-CB 3.34Å; V330-I334 VanDerWaalsContact O-CG1 3.3Å; V330-I334 WeakPolarHBondContact O-CG1 3.38Å; V330-I334 PolarHBondContact O-N 3.34Å; V330-R371 HydrophobicContact CG1-CB 4.21Å; V330-R371 HydrophobicContact CG2-CB 3.69Å; V330-V372 HydrophobicContact CG1-CG2 3.71Å
331	C	91.3	Very high	87.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-43.3	174.4	176.8	0	0	0	0	112.4	Q327 R328 K329 G335 C351 V360 R361	Q327-C331 WeakPolarHBondContact O-CB 3.34Å; Q327-C331 PolarHBondContact O-N 3.49Å; R328-C331 PolarHBondContact O-N 3.47Å; K329-C331 VanDerWaalsContact C-N 3.32Å; K329-C331 PolarHBondContact O-N 3.33Å; C331-G335 PolarHBondContact O-N 3.06Å; C331-C351 HydrophobicContact CB-CB 3.65Å; C331-C351 WeakPolarHBondContact CB-SG 3.37Å; C331-C351 PolarHBondContact O-SG 3.28Å; C331-C351 VanDerWaalsContact SG-CA 3.5Å; C331-C351 WeakPolarHBondContact SG-CB 3.08Å; C331-C351 CovalentContact SG-SG 2.03Å; C331-C351 PolarHBondContact SG-SG 3.36Å; C331-V360 WeakPolarHBondContact O-CG1 3.41Å; C331-R361 HydrophobicContact CB-CG 4.04Å
332	Q	90.4	Very high	87.9	Confident	33 Å²	33	57.5 Å²	57.5	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-42.1	-179.9	-71.6	173.2	-13.6	0	0	111.9	R328 K329 V330 S336 S347 C351	R328-Q332 WeakPolarHBondContact O-CG 3.34Å; R328-Q332 PolarHBondContact O-N 3.31Å; R328-Q332 VanDerWaalsContact O-N 3.09Å; K329-Q332 PolarHBondContact O-N 2.86Å; K329-Q332 VanDerWaalsContact O-N 3.1Å; V330-Q332 VanDerWaalsContact C-N 3.35Å; V330-Q332 PolarHBondContact O-N 3.38Å; Q332-S336 VanDerWaalsContact O-CB 3.26Å; Q332-S336 WeakPolarHBondContact O-CB 3.22Å; Q332-S336 PolarHBondContact O-N 2.88Å; Q332-S347 WeakPolarHBondContact CA-OG 3.32Å; Q332-C351 HydrophobicContact CG-CB 4.04Å; Q332-C351 PolarHBondContact N-SG 2.97Å; Q332-C351 VanDerWaalsContact N-SG 3.44Å
333	D	88.8	Confident	88.1	Confident	50 Å²	50	56.4 Å²	56.4	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-53.8	177.4	-66.2	-14.6	0	0	0	110.3	K329 V330 G335 S336 E337 R371	K329-D333 VanDerWaalsContact O-CG 3.32Å; K329-D333 PolarHBondContact O-N 2.96Å; V330-D333 PolarHBondContact O-N 3.5Å; D333-G335 PolarHBondContact O-N 3.22Å; D333-S336 PolarHBondContact O-N 2.88Å; D333-E337 WeakPolarHBondContact O-CG 3.12Å; D333-E337 PolarHBondContact O-N 3.29Å; D333-R371 IonicContact OD2-CZ 3.18Å; D333-R371 IonicContact OD2-NH1 2.81Å; D333-R371 IonicContact OD2-NH2 3.7Å; D333-R371 PolarHBondContact OD2-NH2 3.12Å
334	I	89.5	Confident	88.1	Confident	5 Å²	5	64 Å²	64	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-47	178.1	-66.3	165	0	0	0	110.5	V330 S336 E337 S338 V360 A364 D368 V372	V330-I334 HydrophobicContact CG1-CD1 3.63Å; V330-I334 HydrophobicContact CG1-CG1 4.41Å; V330-I334 WeakPolarHBondContact O-CB 3.34Å; V330-I334 VanDerWaalsContact O-CG1 3.3Å; V330-I334 WeakPolarHBondContact O-CG1 3.38Å; V330-I334 PolarHBondContact O-N 3.34Å; I334-S336 VanDerWaalsContact C-N 3.27Å; I334-S336 PolarHBondContact O-N 3.42Å; I334-E337 PolarHBondContact O-N 2.85Å; I334-S338 VanDerWaalsContact O-CB 3.32Å; I334-S338 WeakPolarHBondContact O-CB 3.28Å; I334-S338 PolarHBondContact O-N 2.95Å; I334-S338 PolarHBondContact O-OG 3.32Å; I334-V360 HydrophobicContact CB-CG1 4.15Å; I334-V360 HydrophobicContact CG2-CG1 3.95Å; I334-A364 HydrophobicContact CD1-CB 3.68Å; I334-D368 HydrophobicContact CD1-CB 4.17Å; I334-D368 HydrophobicContact CG1-CB 4.17Å; I334-V372 HydrophobicContact CD1-CG2 3.97Å
335	G	89.6	Confident	88.2	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-34.4	-178.5	0	0	0	0	0	113.1	C331 D333 N339 I340	C331-G335 PolarHBondContact O-N 3.06Å; D333-G335 PolarHBondContact O-N 3.22Å; G335-N339 PolarHBondContact O-N 3.03Å; G335-I340 PolarHBondContact O-N 2.86Å
336	S	85.7	Confident	88.3	Confident	82 Å²	82	59.9 Å²	59.9	57%	0.573	33%	0.328	S	S	*	.	H	α-helix	trans	-73.1	-44.3	174.2	-169.5	0	0	0	0	112	Q332 D333 I334 N339	Q332-S336 VanDerWaalsContact O-CB 3.26Å; Q332-S336 WeakPolarHBondContact O-CB 3.22Å; Q332-S336 PolarHBondContact O-N 2.88Å; D333-S336 PolarHBondContact O-N 2.88Å; I334-S336 VanDerWaalsContact C-N 3.27Å; I334-S336 PolarHBondContact O-N 3.42Å; S336-N339 PolarHBondContact O-N 3.17Å
337	E	85.2	Confident	88.5	Confident	120 Å²	120	58.7 Å²	58.7	56%	0.561	32%	0.32	S	S	*	.	H	α-helix	trans	-67.6	-35.7	179.9	-72.8	-178.4	-177.9	0	0	112.5	D333 I334	D333-E337 WeakPolarHBondContact O-CG 3.12Å; D333-E337 PolarHBondContact O-N 3.29Å; I334-E337 PolarHBondContact O-N 2.85Å
338	S	86.7	Confident	88.5	Confident	53 Å²	53	64.4 Å²	64.4	37%	0.371	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	5.5	-179.2	59.9	0	0	0	0	114.3	I334 I340	I334-S338 VanDerWaalsContact O-CB 3.32Å; I334-S338 WeakPolarHBondContact O-CB 3.28Å; I334-S338 PolarHBondContact O-N 2.95Å; I334-S338 PolarHBondContact O-OG 3.32Å; S338-I340 PolarHBondContact O-N 2.97Å; S338-I340 VanDerWaalsContact O-N 3.16Å; S338-I340 WeakPolarHBondContact OG-CD1 3.49Å; S338-I340 WeakPolarHBondContact OG-CG1 3.34Å
339	N	87.9	Confident	88.5	Confident	141 Å²	141	66.4 Å²	66.4	75%	0.754	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	33.6	-177	-61.4	-61.3	0	0	0	113.6	G335 S336 F341	G335-N339 PolarHBondContact O-N 3.03Å; S336-N339 PolarHBondContact O-N 3.17Å; N339-F341 VanDerWaalsContact C-N 3.32Å
340	I	89.9	Confident	88.6	Confident	54 Å²	54	60.4 Å²	60.4	28%	0.277	33%	0.328	S	S	.	.			trans	-72.1	-32.7	178	-69	167.2	0	0	0	110.8	G335 S338 V360 K363	G335-I340 PolarHBondContact O-N 2.86Å; S338-I340 PolarHBondContact O-N 2.97Å; S338-I340 VanDerWaalsContact O-N 3.16Å; S338-I340 WeakPolarHBondContact OG-CD1 3.49Å; S338-I340 WeakPolarHBondContact OG-CG1 3.34Å; I340-V360 HydrophobicContact CD1-CB 4.45Å; I340-V360 HydrophobicContact CD1-CG1 4.12Å; I340-V360 HydrophobicContact CD1-CG2 4.18Å; I340-V360 HydrophobicContact CG2-CG2 4.08Å; I340-K363 HydrophobicContact CD1-CD 3.7Å
341	F	91.2	Very high	88.7	Confident	24 Å²	24	60.6 Å²	60.6	11%	0.105	33%	0.329	C	S	.	.	S	Bend	trans	-108.5	143.7	-179.5	-60.2	-67.7	0	0	0	111.1	N339 D343 A346 S347 Q356 V360	N339-F341 VanDerWaalsContact C-N 3.32Å; F341-D343 VanDerWaalsContact C-N 3.33Å; F341-D343 PolarHBondContact O-N 3.27Å; F341-A346 HydrophobicContact CB-CB 4.25Å; F341-A346 HydrophobicContact CD1-CB 4.49Å; F341-S347 VanDerWaalsContact CD2-CA 3.42Å; F341-Q356 HydrophobicContact CZ-CB 4.31Å; F341-V360 HydrophobicContact CE2-CG1 4.39Å; F341-V360 HydrophobicContact CE2-CG2 3.76Å; F341-V360 HydrophobicContact CZ-CG2 3.64Å
342	A	87	Confident	88.5	Confident	103 Å²	103	63.5 Å²	63.5	85%	0.851	35%	0.347	S	S	*	.	S	Bend	trans	-67.5	-33.2	-178.5	0	0	0	0	0	113
343	D	88.5	Confident	88.4	Confident	93 Å²	93	68 Å²	68	50%	0.497	38%	0.377	S	S	.	.	S	Bend	trans	-154.7	179.9	178.2	64.7	30.4	0	0	0	111.1	F341 A345 A346 S347	F341-D343 VanDerWaalsContact C-N 3.33Å; F341-D343 PolarHBondContact O-N 3.27Å; D343-A345 VanDerWaalsContact C-N 3.3Å; D343-A345 PolarHBondContact O-N 2.75Å; D343-A345 WeakPolarHBondContact OD1-CA 3.29Å; D343-A345 WeakPolarHBondContact OD1-CB 3.04Å; D343-A345 PolarHBondContact OD1-N 3.35Å; D343-A346 PolarHBondContact O-N 3.33Å; D343-A346 WeakPolarHBondContact OD1-CB 3.33Å; D343-A346 PolarHBondContact OD1-N 3.31Å; D343-S347 WeakPolarHBondContact O-CB 3.49Å; D343-S347 PolarHBondContact O-N 3.07Å
344	W	85.2	Confident	88.2	Confident	166 Å²	166	67.5 Å²	67.5	63%	0.629	38%	0.383	S	S	*	.	H	α-helix	trans	-62.9	-33	177.4	177.1	88.2	0	0	0	113.4	S347 R348	W344-S347 PolarHBondContact O-N 2.77Å; W344-R348 VanDerWaalsContact CH2-NH1 3.31Å; W344-R348 WeakPolarHBondContact O-CB 3.39Å; W344-R348 PolarHBondContact O-N 3.44Å
345	A	87.6	Confident	88.1	Confident	55 Å²	55	70.4 Å²	70.4	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-70.5	-44.1	-179.5	0	0	0	0	0	111.1	D343 S347 R348 Q349	D343-A345 VanDerWaalsContact C-N 3.3Å; D343-A345 PolarHBondContact O-N 2.75Å; D343-A345 WeakPolarHBondContact OD1-CA 3.29Å; D343-A345 WeakPolarHBondContact OD1-CB 3.04Å; D343-A345 PolarHBondContact OD1-N 3.35Å; A345-S347 VanDerWaalsContact C-N 3.33Å; A345-R348 PolarHBondContact O-N 2.9Å; A345-Q349 WeakPolarHBondContact O-CB 3.1Å; A345-Q349 PolarHBondContact O-N 3.37Å
346	A	89.7	Confident	88.2	Confident	31 Å²	31	74.6 Å²	74.6	26%	0.256	43%	0.434	S	S	.	.	H	α-helix	trans	-61.6	-41	171.7	0	0	0	0	0	111.4	F341 D343 Q349 G350	F341-A346 HydrophobicContact CB-CB 4.25Å; F341-A346 HydrophobicContact CD1-CB 4.49Å; D343-A346 PolarHBondContact O-N 3.33Å; D343-A346 WeakPolarHBondContact OD1-CB 3.33Å; D343-A346 PolarHBondContact OD1-N 3.31Å; A346-Q349 PolarHBondContact O-N 3.26Å; A346-G350 PolarHBondContact O-N 3.43Å
347	S	90.3	Very high	88.3	Confident	5 Å²	5	72 Å²	72	4%	0.035	42%	0.416	C	S	.	.	H	α-helix	trans	-61.5	-46.1	174.2	179.3	0	0	0	0	112.1	Q332 F341 D343 W344 A345 Q349 G350 C351	Q332-S347 WeakPolarHBondContact CA-OG 3.32Å; F341-S347 VanDerWaalsContact CD2-CA 3.42Å; D343-S347 WeakPolarHBondContact O-CB 3.49Å; D343-S347 PolarHBondContact O-N 3.07Å; W344-S347 PolarHBondContact O-N 2.77Å; A345-S347 VanDerWaalsContact C-N 3.33Å; S347-Q349 PolarHBondContact O-N 2.93Å; S347-G350 PolarHBondContact O-N 2.79Å; S347-C351 WeakPolarHBondContact O-CB 3.4Å; S347-C351 PolarHBondContact O-N 3.15Å; S347-C351 PolarHBondContact O-SG 3.25Å; S347-C351 VanDerWaalsContact O-SG 3.35Å
348	R	88.3	Confident	88.4	Confident	127 Å²	127	68.5 Å²	68.5	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-60.7	-44.7	174.9	-176.1	172.4	-177.9	160.4	-0	111.7	W344 A345 T352	W344-R348 VanDerWaalsContact CH2-NH1 3.31Å; W344-R348 WeakPolarHBondContact O-CB 3.39Å; W344-R348 PolarHBondContact O-N 3.44Å; A345-R348 PolarHBondContact O-N 2.9Å; R348-T352 WeakPolarHBondContact O-CB 3.49Å; R348-T352 WeakPolarHBondContact O-CG2 3.44Å; R348-T352 PolarHBondContact O-N 3.11Å; R348-T352 PolarHBondContact O-OG1 3.07Å
349	Q	88.9	Confident	88.5	Confident	125 Å²	125	69 Å²	69	58%	0.584	41%	0.408	S	S	*	.	H	α-helix	trans	-64.5	-50.9	179.2	-172.5	173.9	7.7	0	0	111.4	A345 A346 S347 C351 T352 V353 G354	A345-Q349 WeakPolarHBondContact O-CB 3.1Å; A345-Q349 PolarHBondContact O-N 3.37Å; A346-Q349 PolarHBondContact O-N 3.26Å; S347-Q349 PolarHBondContact O-N 2.93Å; Q349-C351 PolarHBondContact O-N 3.23Å; Q349-T352 PolarHBondContact O-N 3.08Å; Q349-T352 PolarHBondContact O-OG1 3.18Å; Q349-V353 HydrophobicContact CG-CG2 4.03Å; Q349-V353 PolarHBondContact O-N 3.04Å; Q349-G354 WeakPolarHBondContact O-CA 3.4Å; Q349-G354 PolarHBondContact O-N 2.91Å
350	G	91	Very high	88.6	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-62.5	-41.2	-178.9	0	0	0	0	0	113.6	A346 S347 T352 Q356 S357	A346-G350 PolarHBondContact O-N 3.43Å; S347-G350 PolarHBondContact O-N 2.79Å; G350-T352 VanDerWaalsContact C-N 3.28Å; G350-T352 PolarHBondContact O-N 3.48Å; G350-Q356 VanDerWaalsContact CA-OE1 3.25Å; G350-Q356 WeakPolarHBondContact O-CA 3.37Å; G350-Q356 WeakPolarHBondContact O-CB 3.43Å; G350-Q356 PolarHBondContact O-N 3.04Å; G350-S357 PolarHBondContact O-N 3.27Å
351	C	91.2	Very high	88.6	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.034	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6	178.4	-67.4	0	0	0	0	114.7	C331 Q332 S347 Q349	C331-C351 HydrophobicContact CB-CB 3.65Å; C331-C351 WeakPolarHBondContact CB-SG 3.37Å; C331-C351 PolarHBondContact O-SG 3.28Å; C331-C351 VanDerWaalsContact SG-CA 3.5Å; C331-C351 WeakPolarHBondContact SG-CB 3.08Å; C331-C351 CovalentContact SG-SG 2.03Å; C331-C351 PolarHBondContact SG-SG 3.36Å; Q332-C351 HydrophobicContact CG-CB 4.04Å; Q332-C351 PolarHBondContact N-SG 2.97Å; Q332-C351 VanDerWaalsContact N-SG 3.44Å; S347-C351 WeakPolarHBondContact O-CB 3.4Å; S347-C351 PolarHBondContact O-N 3.15Å; S347-C351 PolarHBondContact O-SG 3.25Å; S347-C351 VanDerWaalsContact O-SG 3.35Å; Q349-C351 PolarHBondContact O-N 3.23Å
352	T	86.7	Confident	88.4	Confident	60 Å²	60	63.8 Å²	63.8	37%	0.368	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-93.7	177.7	56.9	0	0	0	0	111.4	R328 R348 Q349 G350	R328-T352 HydrophobicContact CG-CG2 3.8Å; R348-T352 WeakPolarHBondContact O-CB 3.49Å; R348-T352 WeakPolarHBondContact O-CG2 3.44Å; R348-T352 PolarHBondContact O-N 3.11Å; R348-T352 PolarHBondContact O-OG1 3.07Å; Q349-T352 PolarHBondContact O-N 3.08Å; Q349-T352 PolarHBondContact O-OG1 3.18Å; G350-T352 VanDerWaalsContact C-N 3.28Å; G350-T352 PolarHBondContact O-N 3.48Å
353	V	87.5	Confident	88.5	Confident	128 Å²	128	65.6 Å²	65.6	78%	0.776	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-16.9	-173.7	-62.8	0	0	0	0	113.1	Q349 G355	Q349-V353 HydrophobicContact CG-CG2 4.03Å; Q349-V353 PolarHBondContact O-N 3.04Å; V353-G355 VanDerWaalsContact C-N 3.31Å; V353-G355 PolarHBondContact O-N 3.43Å
354	G	85.7	Confident	88.4	Confident	40 Å²	40	62 Å²	62	41%	0.412	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.9	-176.1	0	0	0	0	0	115	Q349 Q356	Q349-G354 WeakPolarHBondContact O-CA 3.4Å; Q349-G354 PolarHBondContact O-N 2.91Å; G354-Q356 PolarHBondContact O-N 3.44Å; G354-Q356 VanDerWaalsContact O-N 3.15Å
355	G	87.2	Confident	88.4	Confident	66 Å²	66	56.7 Å²	56.7	68%	0.68	34%	0.341	S	S	*	.	S	Bend	trans	69.7	7.2	175.5	0	0	0	0	0	115.5	V353 S357	V353-G355 VanDerWaalsContact C-N 3.31Å; V353-G355 PolarHBondContact O-N 3.43Å; G355-S357 VanDerWaalsContact C-N 3.35Å
356	Q	90.2	Very high	88	Confident	87 Å²	87	60 Å²	60	41%	0.407	35%	0.351	S	S	.	.			trans	-88.9	-1.1	-179	-61.7	171.4	-71	0	0	112.8	F341 G350 G354 S358 S359 V360	F341-Q356 HydrophobicContact CZ-CB 4.31Å; G350-Q356 VanDerWaalsContact CA-OE1 3.25Å; G350-Q356 WeakPolarHBondContact O-CA 3.37Å; G350-Q356 WeakPolarHBondContact O-CB 3.43Å; G350-Q356 PolarHBondContact O-N 3.04Å; G354-Q356 PolarHBondContact O-N 3.44Å; G354-Q356 VanDerWaalsContact O-N 3.15Å; Q356-S358 PolarHBondContact O-N 3.07Å; Q356-S359 PolarHBondContact O-N 3.39Å; Q356-S359 PolarHBondContact O-OG 2.89Å; Q356-S359 VanDerWaalsContact O-OG 3.09Å; Q356-V360 HydrophobicContact CB-CG2 4.37Å; Q356-V360 WeakPolarHBondContact O-CB 3.32Å; Q356-V360 VanDerWaalsContact O-CG2 3.25Å; Q356-V360 WeakPolarHBondContact O-CG2 3.44Å; Q356-V360 PolarHBondContact O-N 2.9Å
357	S	88.2	Confident	87.5	Confident	27 Å²	27	65.8 Å²	65.8	19%	0.189	37%	0.371	C	S	.	.	H	α-helix	trans	-55.1	-49.4	-175.4	-177.4	0	0	0	0	113.5	G350 G355 R361	G350-S357 PolarHBondContact O-N 3.27Å; G355-S357 VanDerWaalsContact C-N 3.35Å; S357-R361 WeakPolarHBondContact O-CB 3.34Å; S357-R361 WeakPolarHBondContact O-CD 3.27Å; S357-R361 VanDerWaalsContact O-CG 3.24Å; S357-R361 WeakPolarHBondContact O-CG 3.27Å; S357-R361 PolarHBondContact O-N 3.48Å; S357-R361 VanDerWaalsContact O-N 3.12Å
358	S	86.9	Confident	87.2	Confident	48 Å²	48	65.8 Å²	65.8	34%	0.336	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-50.3	178.5	-179.3	0	0	0	0	111.9	Q356 V360 R361 D362 K374	Q356-S358 PolarHBondContact O-N 3.07Å; S358-V360 VanDerWaalsContact C-N 3.26Å; S358-V360 PolarHBondContact O-N 3.42Å; S358-R361 PolarHBondContact O-N 3.4Å; S358-R361 VanDerWaalsContact O-N 3.13Å; S358-D362 PolarHBondContact O-N 2.98Å; S358-D362 PolarHBondContact OG-OD2 2.73Å; S358-K374 PolarHBondContact OG-NZ 2.93Å
359	S	90	Very high	87.1	Confident	63 Å²	63	65.1 Å²	65.1	44%	0.441	37%	0.371	S	S	.	.	H	α-helix	trans	-67.5	-26.8	-173.4	59.8	0	0	0	0	113.3	Q356	Q356-S359 PolarHBondContact O-N 3.39Å; Q356-S359 PolarHBondContact O-OG 2.89Å; Q356-S359 VanDerWaalsContact O-OG 3.09Å
360	V	90.5	Very high	87	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-72.3	-48.6	170.3	172.9	0	0	0	0	110.7	C331 I334 I340 F341 Q356 S358 D362 K363	C331-V360 WeakPolarHBondContact O-CG1 3.41Å; I334-V360 HydrophobicContact CB-CG1 4.15Å; I334-V360 HydrophobicContact CG2-CG1 3.95Å; I340-V360 HydrophobicContact CD1-CB 4.45Å; I340-V360 HydrophobicContact CD1-CG1 4.12Å; I340-V360 HydrophobicContact CD1-CG2 4.18Å; I340-V360 HydrophobicContact CG2-CG2 4.08Å; F341-V360 HydrophobicContact CE2-CG1 4.39Å; F341-V360 HydrophobicContact CE2-CG2 3.76Å; F341-V360 HydrophobicContact CZ-CG2 3.64Å; Q356-V360 HydrophobicContact CB-CG2 4.37Å; Q356-V360 WeakPolarHBondContact O-CB 3.32Å; Q356-V360 VanDerWaalsContact O-CG2 3.25Å; Q356-V360 WeakPolarHBondContact O-CG2 3.44Å; Q356-V360 PolarHBondContact O-N 2.9Å; S358-V360 VanDerWaalsContact C-N 3.26Å; S358-V360 PolarHBondContact O-N 3.42Å; V360-D362 VanDerWaalsContact C-N 3.26Å; V360-D362 PolarHBondContact O-N 3.25Å; V360-K363 WeakPolarHBondContact O-CB 3.24Å; V360-K363 PolarHBondContact O-N 2.89Å
361	R	88.3	Confident	86.8	Confident	12 Å²	12	63 Å²	63	5%	0.045	36%	0.359	C	S	.	.	H	α-helix	trans	-63.7	-30.6	179.2	-72.4	166.3	56.9	-151.5	-4.5	112.9	C331 S357 S358 K363 A364 V372 L373	C331-R361 HydrophobicContact CB-CG 4.04Å; S357-R361 WeakPolarHBondContact O-CB 3.34Å; S357-R361 WeakPolarHBondContact O-CD 3.27Å; S357-R361 VanDerWaalsContact O-CG 3.24Å; S357-R361 WeakPolarHBondContact O-CG 3.27Å; S357-R361 PolarHBondContact O-N 3.48Å; S357-R361 VanDerWaalsContact O-N 3.12Å; S358-R361 PolarHBondContact O-N 3.4Å; S358-R361 VanDerWaalsContact O-N 3.13Å; R361-K363 PolarHBondContact O-N 3.17Å; R361-A364 VanDerWaalsContact O-CB 3.23Å; R361-A364 WeakPolarHBondContact O-CB 3.47Å; R361-A364 PolarHBondContact O-N 2.65Å; R361-A364 VanDerWaalsContact O-N 3.07Å; R361-V372 HydrophobicContact CB-CG1 3.99Å; R361-V372 HydrophobicContact CB-CG2 4.12Å; R361-V372 HydrophobicContact CG-CG2 4.38Å; R361-L373 PolarHBondContact NH2-O 3.45Å
362	D	87.6	Confident	86.7	Confident	96 Å²	96	63.3 Å²	63.3	51%	0.513	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.2	174.8	-66	-34.4	0	0	0	112.5	S358 V360 K374	S358-D362 PolarHBondContact O-N 2.98Å; S358-D362 PolarHBondContact OG-OD2 2.73Å; V360-D362 VanDerWaalsContact C-N 3.26Å; V360-D362 PolarHBondContact O-N 3.25Å; D362-K374 IonicContact OD1-NZ 3.28Å; D362-K374 PolarHBondContact OD1-NZ 3.26Å; D362-K374 IonicContact OD2-NZ 2.61Å; D362-K374 PolarHBondContact OD2-NZ 3.4Å
363	K	88.4	Confident	86.8	Confident	141 Å²	141	60.6 Å²	60.6	61%	0.613	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	11.9	173.8	-62.1	176.8	179.5	-178.1	0	113.5	I340 V360 R361 S365	I340-K363 HydrophobicContact CD1-CD 3.7Å; V360-K363 WeakPolarHBondContact O-CB 3.24Å; V360-K363 PolarHBondContact O-N 2.89Å; R361-K363 PolarHBondContact O-N 3.17Å; K363-S365 PolarHBondContact O-N 2.81Å
364	A	87.3	Confident	86.8	Confident	16 Å²	16	56.4 Å²	56.4	13%	0.132	32%	0.315	C	S	.	.			trans	-53.8	135.7	179.6	0	0	0	0	0	112.3	I334 R361 D368 V372	I334-A364 HydrophobicContact CD1-CB 3.68Å; R361-A364 VanDerWaalsContact O-CB 3.23Å; R361-A364 WeakPolarHBondContact O-CB 3.47Å; R361-A364 PolarHBondContact O-N 2.65Å; R361-A364 VanDerWaalsContact O-N 3.07Å; A364-D368 HydrophobicContact CB-CB 4.13Å; A364-V372 HydrophobicContact CB-CG2 3.78Å
365	S	84.6	Confident	86.9	Confident	56 Å²	56	55.9 Å²	55.9	39%	0.392	30%	0.303	S	S	.	.			trans	-66.9	164.3	169.3	79.5	0	0	0	0	110.7	K363 K367 D368 K369	K363-S365 PolarHBondContact O-N 2.81Å; S365-K367 PolarHBondContact O-N 3.39Å; S365-K367 PolarHBondContact OG-N 3.28Å; S365-D368 PolarHBondContact O-N 3.13Å; S365-D368 PolarHBondContact OG-OD2 3.34Å; S365-D368 VanDerWaalsContact OG-OD2 3.08Å; S365-K369 WeakPolarHBondContact O-CG 3.41Å; S365-K369 PolarHBondContact O-N 2.99Å
366	D	78.8	Confident	87	Confident	123 Å²	123	53.3 Å²	53.3	66%	0.658	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-30.9	176.4	-69.7	-34.3	0	0	0	113.3	D368 K369	D366-D368 VanDerWaalsContact C-N 3.34Å; D366-D368 PolarHBondContact O-N 2.84Å; D366-K369 WeakPolarHBondContact OD1-CE 3.45Å; D366-K369 IonicContact OD1-NZ 3.16Å; D366-K369 PolarHBondContact OD1-NZ 3.48Å
367	K	80.1	Confident	87.2	Confident	154 Å²	154	49.1 Å²	49.1	67%	0.67	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-28.5	178.4	-170.6	-174.7	175.4	-167.7	0	113.4	S365 N548	S365-K367 PolarHBondContact O-N 3.39Å; S365-K367 PolarHBondContact OG-N 3.28Å; K367-N548 PolarHBondContact O-ND2 3.1Å
368	D	84.7	Confident	87.4	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-10.5	-175.8	-62.1	-64.3	0	0	0	113.6	I334 A364 S365 D366 E370 R371 V372	I334-D368 HydrophobicContact CD1-CB 4.17Å; I334-D368 HydrophobicContact CG1-CB 4.17Å; A364-D368 HydrophobicContact CB-CB 4.13Å; S365-D368 PolarHBondContact O-N 3.13Å; S365-D368 PolarHBondContact OG-OD2 3.34Å; S365-D368 VanDerWaalsContact OG-OD2 3.08Å; D366-D368 VanDerWaalsContact C-N 3.34Å; D366-D368 PolarHBondContact O-N 2.84Å; D368-E370 PolarHBondContact O-N 3.44Å; D368-R371 WeakPolarHBondContact O-CA 2.93Å; D368-R371 WeakPolarHBondContact O-CB 3.44Å; D368-R371 PolarHBondContact O-N 3.26Å; D368-R371 WeakPolarHBondContact OD1-CD 3.46Å; D368-R371 IonicContact OD1-CZ 2.81Å; D368-R371 IonicContact OD1-NE 2.79Å; D368-R371 IonicContact OD1-NH1 3.6Å; D368-R371 PolarHBondContact OD1-NH1 2.94Å; D368-V372 PolarHBondContact O-N 3.35Å; D368-V372 VanDerWaalsContact O-N 3.13Å
369	K	86.3	Confident	87.7	Confident	113 Å²	113	45.8 Å²	45.8	49%	0.491	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-35.5	-179.7	-82.1	-179.8	-175.9	173.1	0	113.4	S365 D366 V372	S365-K369 WeakPolarHBondContact O-CG 3.41Å; S365-K369 PolarHBondContact O-N 2.99Å; D366-K369 WeakPolarHBondContact OD1-CE 3.45Å; D366-K369 IonicContact OD1-NZ 3.16Å; D366-K369 PolarHBondContact OD1-NZ 3.48Å; K369-V372 PolarHBondContact O-N 2.96Å
370	E	86.1	Confident	87.9	Confident	35 Å²	35	42.9 Å²	42.9	16%	0.164	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-21.3	-179.1	-67.2	162.5	-155	0	0	113.9	D368 V372 K385 G547 N548 Y549	D368-E370 PolarHBondContact O-N 3.44Å; E370-V372 VanDerWaalsContact C-N 3.32Å; E370-K385 WeakPolarHBondContact OE1-CE 3.49Å; E370-K385 IonicContact OE1-NZ 3.27Å; E370-K385 PolarHBondContact OE1-NZ 2.98Å; E370-K385 IonicContact OE2-NZ 2.65Å; E370-K385 PolarHBondContact OE2-NZ 2.82Å; E370-G547 WeakPolarHBondContact OE2-CA 3.46Å; E370-N548 CarbonylContact C-O 3.59Å; E370-N548 VanDerWaalsContact C-O 3.32Å; E370-N548 HydrophobicContact CB-CB 4.4Å; E370-N548 WeakPolarHBondContact CB-O 3.24Å; E370-N548 PolarHBondContact OE2-N 3.23Å; E370-Y549 HydrophobicContact CB-CD1 4.36Å; E370-Y549 HydrophobicContact CB-CE1 4.23Å; E370-Y549 HydrophobicContact CG-CE1 4.44Å
371	R	86.9	Confident	87.9	Confident	47 Å²	47	45.3 Å²	45.3	18%	0.177	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-24.9	172.7	-58.1	171	64.6	-163.6	0.8	111	Q327 V330 D333 D368 L373 N548	Q327-R371 PolarHBondContact NE2-O 2.81Å; Q327-R371 PolarHBondContact OE1-O 3.44Å; V330-R371 HydrophobicContact CG1-CB 4.21Å; V330-R371 HydrophobicContact CG2-CB 3.69Å; D333-R371 IonicContact OD2-CZ 3.18Å; D333-R371 IonicContact OD2-NH1 2.81Å; D333-R371 IonicContact OD2-NH2 3.7Å; D333-R371 PolarHBondContact OD2-NH2 3.12Å; D368-R371 WeakPolarHBondContact O-CA 2.93Å; D368-R371 WeakPolarHBondContact O-CB 3.44Å; D368-R371 PolarHBondContact O-N 3.26Å; D368-R371 WeakPolarHBondContact OD1-CD 3.46Å; D368-R371 IonicContact OD1-CZ 2.81Å; D368-R371 IonicContact OD1-NE 2.79Å; D368-R371 IonicContact OD1-NH1 3.6Å; D368-R371 PolarHBondContact OD1-NH1 2.94Å; R371-L373 PolarHBondContact O-N 2.88Å; R371-N548 WeakPolarHBondContact CD-ND2 3.46Å; R371-N548 WeakPolarHBondContact CG-O 3.24Å; R371-N548 PolarHBondContact N-O 3.31Å
372	V	88.5	Confident	88	Confident	12 Å²	12	44.8 Å²	44.8	7%	0.073	22%	0.218	C	C	.	.	S	Bend	trans	-77.4	96.7	174.8	177.9	0	0	0	0	109.6	V330 I334 R361 A364 D368 K369 E370 K374	V330-V372 HydrophobicContact CG1-CG2 3.71Å; I334-V372 HydrophobicContact CD1-CG2 3.97Å; R361-V372 HydrophobicContact CB-CG1 3.99Å; R361-V372 HydrophobicContact CB-CG2 4.12Å; R361-V372 HydrophobicContact CG-CG2 4.38Å; A364-V372 HydrophobicContact CB-CG2 3.78Å; D368-V372 PolarHBondContact O-N 3.35Å; D368-V372 VanDerWaalsContact O-N 3.13Å; K369-V372 PolarHBondContact O-N 2.96Å; E370-V372 VanDerWaalsContact C-N 3.32Å; V372-K374 HydrophobicContact CG1-CB 4.05Å; V372-K374 PolarHBondContact O-N 2.89Å
373	L	88.5	Confident	88	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	19%	0.194	C	C	.	.			trans	-78.5	72.3	176.4	-60.4	176.6	0	0	0	110.3	T323 Q327 R361 R371 I378 F408 P550 V553	T323-L373 HydrophobicContact CG2-CD1 3.53Å; Q327-L373 HydrophobicContact CG-CB 4.46Å; Q327-L373 VanDerWaalsContact NE2-CG 3.3Å; Q327-L373 VanDerWaalsContact OE1-N 3.15Å; R361-L373 PolarHBondContact NH2-O 3.45Å; R371-L373 PolarHBondContact O-N 2.88Å; L373-I378 HydrophobicContact CD2-CD1 4.13Å; L373-F408 HydrophobicContact CB-CB 4.49Å; L373-F408 HydrophobicContact CB-CD1 3.85Å; L373-F408 HydrophobicContact CB-CD2 4.39Å; L373-F408 HydrophobicContact CB-CE1 4.16Å; L373-F408 HydrophobicContact CB-CG 3.98Å; L373-F408 HydrophobicContact CD1-CD1 4.49Å; L373-F408 HydrophobicContact CD1-CE1 3.97Å; L373-F408 HydrophobicContact CD1-CZ 3.99Å; L373-F408 HydrophobicContact CD2-CD2 4.07Å; L373-F408 HydrophobicContact CD2-CE2 3.92Å; L373-F408 HydrophobicContact CD2-CZ 4.24Å; L373-F408 HydrophobicContact CG-CE1 4.5Å; L373-F408 HydrophobicContact CG-CZ 4.5Å; L373-P550 HydrophobicContact CD1-CB 4.45Å; L373-P550 HydrophobicContact CD1-CG 3.84Å; L373-P550 HydrophobicContact CD2-CG 4.25Å; L373-P550 HydrophobicContact CG-CG 3.98Å; L373-V553 HydrophobicContact CD1-CG2 3.46Å; L373-V553 VanDerWaalsContact CD1-CG2 3.46Å; L373-V553 HydrophobicContact CD2-CG2 3.94Å; L373-V553 HydrophobicContact CG-CG2 4.34Å
374	K	87	Confident	88	Confident	39 Å²	39	36.2 Å²	36.2	17%	0.17	18%	0.176	C	C	.	.	S	Bend	trans	-149	134.6	175.6	-179	-177.4	176.2	-167.6	0	108.5	S358 D362 V372 Q376	S358-K374 PolarHBondContact OG-NZ 2.93Å; D362-K374 IonicContact OD1-NZ 3.28Å; D362-K374 PolarHBondContact OD1-NZ 3.26Å; D362-K374 IonicContact OD2-NZ 2.61Å; D362-K374 PolarHBondContact OD2-NZ 3.4Å; V372-K374 HydrophobicContact CG1-CB 4.05Å; V372-K374 PolarHBondContact O-N 2.89Å; K374-Q376 VanDerWaalsContact C-N 3.29Å; K374-Q376 PolarHBondContact O-N 3.38Å
375	N	88.3	Confident	87.7	Confident	29 Å²	29	38.9 Å²	38.9	16%	0.155	19%	0.185	C	C	.	.	S	Bend	trans	53.5	45	179.7	-72.4	-28.6	0	0	0	113.5	F408 G409 E410 K446 L448	N375-F408 CarbonylContact C-O 3.58Å; N375-F408 VanDerWaalsContact CA-O 3.25Å; N375-F408 WeakPolarHBondContact CA-O 3.44Å; N375-F408 PolarHBondContact N-O 3.5Å; N375-G409 PolarHBondContact N-O 3.49Å; N375-E410 WeakPolarHBondContact ND2-CG 3.41Å; N375-E410 WeakPolarHBondContact OD1-CG 3.45Å; N375-K446 HydrophobicContact CB-CD 4.3Å; N375-L448 HydrophobicContact CB-CD1 4Å
376	Q	89.7	Confident	87	Confident	12 Å²	12	38.1 Å²	38.1	6%	0.056	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	135	-177.1	-169.2	176.7	62.6	0	0	111.6	K374 I378 E381 F408	K374-Q376 VanDerWaalsContact C-N 3.29Å; K374-Q376 PolarHBondContact O-N 3.38Å; Q376-I378 HydrophobicContact CG-CD1 4.19Å; Q376-E381 HydrophobicContact CG-CB 4Å; Q376-E381 HydrophobicContact CG-CG 4.27Å; Q376-F408 PolarHBondContact N-O 2.84Å; Q376-F408 PolarHBondContact O-N 3.03Å
377	N	93.9	Very high	86.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113.6	164.5	173.7	-23.9	0	0	0	107.3	I379 W380 E381 M400 T405 I407 C447	N377-I379 PolarHBondContact O-N 3.37Å; N377-W380 HydrophobicContact CB-CB 3.73Å; N377-W380 PolarHBondContact O-N 3.36Å; N377-W380 WeakPolarHBondContact OD1-CB 3.07Å; N377-W380 PolarHBondContact OD1-N 2.86Å; N377-E381 WeakPolarHBondContact O-CB 3.24Å; N377-E381 PolarHBondContact O-N 2.86Å; N377-M400 PolarHBondContact ND2-SD 3.44Å; N377-T405 WeakPolarHBondContact OD1-CB 3.32Å; N377-T405 WeakPolarHBondContact OD1-CG2 3.4Å; N377-T405 PolarHBondContact OD1-OG1 3.17Å; N377-I407 HydrophobicContact CB-CG1 4.2Å; N377-C447 WeakPolarHBondContact CB-O 3.4Å; N377-C447 PolarHBondContact ND2-O 2.87Å; N377-C447 PolarHBondContact ND2-SG 3.16Å; N377-C447 VanDerWaalsContact ND2-SG 3.42Å
378	I	93.5	Very high	85.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-52.2	-163.6	-58.6	-58.9	0	0	0	112.3	L373 Q376 E381 A382 L406 F408 I544 Y549 V553 V557	L373-I378 HydrophobicContact CD2-CD1 4.13Å; Q376-I378 HydrophobicContact CG-CD1 4.19Å; I378-E381 PolarHBondContact O-N 3.09Å; I378-A382 WeakPolarHBondContact O-CB 3.26Å; I378-A382 PolarHBondContact O-N 2.61Å; I378-L406 HydrophobicContact CG1-CB 4Å; I378-L406 WeakPolarHBondContact CG1-O 3.41Å; I378-L406 PolarHBondContact N-O 2.9Å; I378-F408 HydrophobicContact CD1-CD2 3.88Å; I378-F408 HydrophobicContact CD1-CE2 3.83Å; I378-F408 HydrophobicContact CG1-CD2 4.07Å; I378-F408 HydrophobicContact CG1-CE2 3.81Å; I378-I544 HydrophobicContact CG2-CD1 4.14Å; I378-Y549 HydrophobicContact CD1-CD1 3.9Å; I378-Y549 HydrophobicContact CD1-CE1 3.94Å; I378-Y549 HydrophobicContact CG2-CD1 4.25Å; I378-Y549 HydrophobicContact CG2-CE1 4.03Å; I378-Y549 HydrophobicContact CG2-CE2 4.3Å; I378-Y549 HydrophobicContact CG2-CG 4.49Å; I378-V553 HydrophobicContact CD1-CG1 3.86Å; I378-V553 HydrophobicContact CG1-CG1 3.77Å; I378-V553 HydrophobicContact CG2-CG1 4.38Å; I378-V557 HydrophobicContact CB-CG2 4.42Å; I378-V557 HydrophobicContact CG2-CG2 4.02Å
379	I	93.1	Very high	85.2	Confident	3 Å²	3	35 Å²	35	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-67	-41	179.6	-68.3	-96.7	0	0	0	110.3	N377 E381 A382 L383 M400 T403 G404 T405 I544 V557	N377-I379 PolarHBondContact O-N 3.37Å; I379-E381 PolarHBondContact O-N 2.61Å; I379-A382 PolarHBondContact O-N 3.12Å; I379-L383 HydrophobicContact CG2-CD1 3.68Å; I379-L383 HydrophobicContact CG2-CG 4.16Å; I379-L383 WeakPolarHBondContact O-CB 3.12Å; I379-L383 WeakPolarHBondContact O-CG 3.39Å; I379-L383 PolarHBondContact O-N 2.75Å; I379-M400 HydrophobicContact CG2-CB 4.19Å; I379-M400 HydrophobicContact CG2-CG 4.38Å; I379-T403 HydrophobicContact CD1-CG2 4.45Å; I379-G404 WeakPolarHBondContact CG1-O 3.1Å; I379-T405 WeakPolarHBondContact CB-OG1 3.4Å; I379-T405 PolarHBondContact N-OG1 2.89Å; I379-T405 VanDerWaalsContact N-OG1 3.14Å; I379-I544 HydrophobicContact CD1-CD1 3.21Å; I379-I544 HydrophobicContact CD1-CG1 4.05Å; I379-I544 HydrophobicContact CG1-CD1 3.71Å; I379-V557 HydrophobicContact CD1-CG1 4.02Å; I379-V557 HydrophobicContact CG1-CG1 4.29Å
380	W	93.8	Very high	84.6	Confident	3 Å²	3	33.7 Å²	33.7	1%	0.011	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-46.9	177.9	-173.1	-103.4	0	0	0	112.4	N377 L383 K384 K393 K396 E397 M400 C441 D445 C447	N377-W380 HydrophobicContact CB-CB 3.73Å; N377-W380 PolarHBondContact O-N 3.36Å; N377-W380 WeakPolarHBondContact OD1-CB 3.07Å; N377-W380 PolarHBondContact OD1-N 2.86Å; W380-L383 PolarHBondContact O-N 2.95Å; W380-K384 WeakPolarHBondContact O-CG 3.4Å; W380-K384 PolarHBondContact O-N 3.02Å; W380-K393 HydrophobicContact CH2-CG 3.68Å; W380-K393 HydrophobicContact CZ2-CG 4.29Å; W380-K396 HydrophobicContact CE3-CB 3.94Å; W380-K396 HydrophobicContact CH2-CB 3.93Å; W380-K396 HydrophobicContact CZ3-CB 3.38Å; W380-E397 HydrophobicContact CH2-CG 4.12Å; W380-E397 HydrophobicContact CZ3-CG 3.78Å; W380-M400 HydrophobicContact CE3-SD 4.4Å; W380-C441 VanDerWaalsContact CH2-SG 3.59Å; W380-C441 WeakPolarHBondContact CZ3-SG 3.16Å; W380-D445 PolarHBondContact NE1-O 3Å; W380-C447 HydrophobicContact CB-CB 4.11Å; W380-C447 HydrophobicContact CD2-CB 3.46Å; W380-C447 VanDerWaalsContact CD2-CB 3.46Å; W380-C447 HydrophobicContact CE3-CB 4.09Å; W380-C447 HydrophobicContact CG-CB 3.44Å; W380-C447 VanDerWaalsContact CG-CB 3.44Å; W380-C447 HydrophobicContact CZ2-CB 4.26Å
381	E	90.8	Very high	84	Confident	53 Å²	53	35 Å²	35	25%	0.248	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-40.6	179.9	-168.1	62.8	-161.7	0	0	111.5	Q376 N377 I378 I379 L383 K384	Q376-E381 HydrophobicContact CG-CB 4Å; Q376-E381 HydrophobicContact CG-CG 4.27Å; N377-E381 WeakPolarHBondContact O-CB 3.24Å; N377-E381 PolarHBondContact O-N 2.86Å; I378-E381 PolarHBondContact O-N 3.09Å; I379-E381 PolarHBondContact O-N 2.61Å; E381-L383 PolarHBondContact O-N 3.33Å; E381-K384 PolarHBondContact O-N 3.46Å; E381-K384 IonicContact OE2-NZ 2.63Å
382	A	89.6	Confident	83.8	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-44.8	174.2	0	0	0	0	0	111.7	I378 I379 K384 K385 M543 I544	I378-A382 WeakPolarHBondContact O-CB 3.26Å; I378-A382 PolarHBondContact O-N 2.61Å; I379-A382 PolarHBondContact O-N 3.12Å; A382-K384 VanDerWaalsContact C-N 3.34Å; A382-K384 PolarHBondContact O-N 3.22Å; A382-K385 PolarHBondContact O-N 2.88Å; A382-M543 HydrophobicContact CB-CB 4.2Å; A382-M543 WeakPolarHBondContact O-CE 3.4Å; A382-I544 HydrophobicContact CB-CD1 4.23Å; A382-I544 HydrophobicContact CB-CG1 3.73Å
383	L	89.1	Confident	83.9	Confident	1 Å²	1	36 Å²	36	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-33.3	178.7	-66.3	172.6	0	0	0	112.3	I379 W380 E381 K385 N386 F389 K396 I399 A540	I379-L383 HydrophobicContact CG2-CD1 3.68Å; I379-L383 HydrophobicContact CG2-CG 4.16Å; I379-L383 WeakPolarHBondContact O-CB 3.12Å; I379-L383 WeakPolarHBondContact O-CG 3.39Å; I379-L383 PolarHBondContact O-N 2.75Å; W380-L383 PolarHBondContact O-N 2.95Å; E381-L383 PolarHBondContact O-N 3.33Å; L383-K385 PolarHBondContact O-N 2.83Å; L383-N386 PolarHBondContact O-N 2.83Å; L383-N386 VanDerWaalsContact O-N 3.1Å; L383-F389 HydrophobicContact CB-CD2 4.03Å; L383-F389 HydrophobicContact CD2-CD2 3.72Å; L383-F389 HydrophobicContact CD2-CE2 3.36Å; L383-F389 HydrophobicContact CD2-CZ 4.03Å; L383-F389 HydrophobicContact CG-CD2 4.46Å; L383-F389 WeakPolarHBondContact O-CD2 3.49Å; L383-K396 HydrophobicContact CB-CD 4.04Å; L383-K396 HydrophobicContact CB-CG 4.14Å; L383-K396 HydrophobicContact CD1-CB 4.26Å; L383-K396 HydrophobicContact CD1-CG 4.41Å; L383-I399 HydrophobicContact CD1-CB 3.9Å; L383-I399 HydrophobicContact CD1-CG2 3.76Å; L383-I399 HydrophobicContact CD2-CD1 4.2Å; L383-I399 HydrophobicContact CD2-CG2 3.99Å; L383-A540 HydrophobicContact CD2-CB 4.37Å
384	K	87	Confident	83.9	Confident	55 Å²	55	38.5 Å²	38.5	24%	0.239	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-25.6	176.3	-80.9	176.5	70.1	179.4	0	113.9	W380 E381 A382 N386 D445	W380-K384 WeakPolarHBondContact O-CG 3.4Å; W380-K384 PolarHBondContact O-N 3.02Å; E381-K384 PolarHBondContact O-N 3.46Å; E381-K384 IonicContact OE2-NZ 2.63Å; A382-K384 VanDerWaalsContact C-N 3.34Å; A382-K384 PolarHBondContact O-N 3.22Å; K384-N386 VanDerWaalsContact C-N 3.26Å; K384-N386 PolarHBondContact O-N 3.36Å; K384-D445 PolarHBondContact NZ-O 2.91Å; K384-D445 IonicContact NZ-OD1 3.19Å; K384-D445 PolarHBondContact NZ-OD1 3.12Å
385	K	80.8	Confident	84.1	Confident	73 Å²	73	36.8 Å²	36.8	32%	0.317	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.9	177.3	-64.5	172.7	177.3	179.8	0	113	E370 A382 L383 M543	E370-K385 WeakPolarHBondContact OE1-CE 3.49Å; E370-K385 IonicContact OE1-NZ 3.27Å; E370-K385 PolarHBondContact OE1-NZ 2.98Å; E370-K385 IonicContact OE2-NZ 2.65Å; E370-K385 PolarHBondContact OE2-NZ 2.82Å; A382-K385 PolarHBondContact O-N 2.88Å; L383-K385 PolarHBondContact O-N 2.83Å; K385-M543 HydrophobicContact CB-CE 3.66Å
386	N	71.3	Confident	84.2	Confident	40 Å²	40	36.5 Å²	36.5	21%	0.214	18%	0.182	C	C	.	.			trans	-89.7	114	179.7	-161.3	-24.5	0	0	0	110.1	L383 K384 M388 F389 M543	L383-N386 PolarHBondContact O-N 2.83Å; L383-N386 VanDerWaalsContact O-N 3.1Å; K384-N386 VanDerWaalsContact C-N 3.26Å; K384-N386 PolarHBondContact O-N 3.36Å; N386-M388 PolarHBondContact O-N 3.28Å; N386-M388 WeakPolarHBondContact OD1-CB 3.46Å; N386-M388 PolarHBondContact OD1-N 3.08Å; N386-F389 HydrophobicContact CB-CD2 3.59Å; N386-F389 HydrophobicContact CB-CE2 3.86Å; N386-F389 PolarHBondContact O-N 3.25Å; N386-M543 HydrophobicContact CB-CE 3.62Å; N386-M543 HydrophobicContact CB-CG 3.97Å; N386-M543 HydrophobicContact CB-SD 3.54Å; N386-M543 VanDerWaalsContact CB-SD 3.54Å; N386-M543 PolarHBondContact ND2-SD 2.61Å; N386-M543 VanDerWaalsContact ND2-SD 3.37Å
387	R	69.7	Low	84.4	Confident	158 Å²	158	36.2 Å²	36.2	60%	0.596	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-57.1	-22.1	173.4	-66.8	-169.9	176.6	-177.9	9.1	113.3	E149 F389 D390	E149-R387 IonicContact OE1-CZ 3.83Å; E149-R387 IonicContact OE1-NE 2.95Å; E149-R387 IonicContact OE1-NH1 2.81Å; E149-R387 PolarHBondContact OE1-NH1 3.14Å; E149-R387 IonicContact OE1-NH2 3.56Å; E149-R387 IonicContact OE2-CZ 2.91Å; E149-R387 IonicContact OE2-NH1 3.24Å; E149-R387 PolarHBondContact OE2-NH1 2.76Å; E149-R387 IonicContact OE2-NH2 2.7Å; R387-F389 PolarHBondContact O-N 2.88Å; R387-D390 WeakPolarHBondContact CA-OD2 3.4Å; R387-D390 WeakPolarHBondContact O-CB 3.49Å; R387-D390 PolarHBondContact O-N 2.58Å; R387-D390 VanDerWaalsContact O-N 3.14Å
388	M	62	Low	84.4	Confident	57 Å²	57	36.4 Å²	36.4	28%	0.281	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-56.1	-31.2	172.5	-177	169.8	175	0	0	112.9	M173 N386 Q539	M173-M388 HydrophobicContact SD-CE 4.25Å; M173-M388 HydrophobicContact SD-CG 4.19Å; M173-M388 HydrophobicContact SD-SD 3.67Å; M173-M388 VanDerWaalsContact SD-SD 3.67Å; N386-M388 PolarHBondContact O-N 3.28Å; N386-M388 WeakPolarHBondContact OD1-CB 3.46Å; N386-M388 PolarHBondContact OD1-N 3.08Å; M388-Q539 PolarHBondContact SD-OE1 3.01Å
389	F	72.7	Confident	84.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-100.2	4.5	-179	-53.8	-53.9	0	0	0	113.3	L383 N386 R387 G391 N392 L395 K396 I399 Q539 M543	L383-F389 HydrophobicContact CB-CD2 4.03Å; L383-F389 HydrophobicContact CD2-CD2 3.72Å; L383-F389 HydrophobicContact CD2-CE2 3.36Å; L383-F389 HydrophobicContact CD2-CZ 4.03Å; L383-F389 HydrophobicContact CG-CD2 4.46Å; L383-F389 WeakPolarHBondContact O-CD2 3.49Å; N386-F389 HydrophobicContact CB-CD2 3.59Å; N386-F389 HydrophobicContact CB-CE2 3.86Å; N386-F389 PolarHBondContact O-N 3.25Å; R387-F389 PolarHBondContact O-N 2.88Å; F389-G391 PolarHBondContact O-N 3.38Å; F389-N392 PolarHBondContact O-N 2.91Å; F389-L395 HydrophobicContact CD1-CD2 3.87Å; F389-L395 HydrophobicContact CD1-CG 4.28Å; F389-L395 HydrophobicContact CE1-CD2 4.15Å; F389-K396 HydrophobicContact CB-CD 3.8Å; F389-K396 HydrophobicContact CB-CG 3.61Å; F389-K396 HydrophobicContact CG-CG 4.19Å; F389-I399 HydrophobicContact CD1-CD1 3.89Å; F389-I399 HydrophobicContact CE1-CD1 3.29Å; F389-I399 HydrophobicContact CE2-CD1 4.3Å; F389-I399 HydrophobicContact CZ-CD1 3.54Å; F389-Q539 HydrophobicContact CZ-CB 4.06Å; F389-Q539 VanDerWaalsContact CZ-OE1 3.27Å; F389-M543 HydrophobicContact CE2-CG 4.39Å
390	D	73.9	Confident	84.3	Confident	86 Å²	86	36.2 Å²	36.2	46%	0.46	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	128.2	179	-77.6	-13.1	0	0	0	110.7	R387 N392	R387-D390 WeakPolarHBondContact CA-OD2 3.4Å; R387-D390 WeakPolarHBondContact O-CB 3.49Å; R387-D390 PolarHBondContact O-N 2.58Å; R387-D390 VanDerWaalsContact O-N 3.14Å; D390-N392 PolarHBondContact O-N 2.98Å
391	G	74.6	Confident	84.3	Confident	63 Å²	63	36 Å²	36	65%	0.649	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.8	-7.6	-179.1	0	0	0	0	0	115.2	F389	F389-G391 PolarHBondContact O-N 3.38Å
392	N	82.8	Confident	84.4	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.043	17%	0.169	C	C	.	.			trans	-106.6	76.9	176.4	-163.6	-23.5	0	0	0	111	A181 F389 D390 E394 L395 K396	A181-N392 HydrophobicContact CB-CB 4.08Å; A181-N392 WeakPolarHBondContact CB-ND2 3.25Å; A181-N392 PolarHBondContact O-ND2 2.77Å; A181-N392 PolarHBondContact O-OD1 2.88Å; F389-N392 PolarHBondContact O-N 2.91Å; D390-N392 PolarHBondContact O-N 2.98Å; N392-E394 VanDerWaalsContact C-N 3.33Å; N392-L395 HydrophobicContact CB-CB 4Å; N392-L395 VanDerWaalsContact ND2-CB 3.29Å; N392-L395 WeakPolarHBondContact ND2-CB 3.46Å; N392-L395 WeakPolarHBondContact OD1-CB 3.46Å; N392-L395 PolarHBondContact OD1-N 3.33Å; N392-K396 PolarHBondContact O-N 3.13Å
393	K	89.2	Confident	84.4	Confident	70 Å²	70	33.5 Å²	33.5	30%	0.304	17%	0.169	S	C	.	.	H	α-helix	trans	-61.1	-43.7	178.9	-166.8	-165.4	-178.4	-142.7	0	111.3	W380 L395 K396 E397 H440 C441	W380-K393 HydrophobicContact CH2-CG 3.68Å; W380-K393 HydrophobicContact CZ2-CG 4.29Å; K393-L395 PolarHBondContact O-N 2.73Å; K393-K396 PolarHBondContact O-N 3.14Å; K393-E397 WeakPolarHBondContact CE-OE1 3.18Å; K393-E397 IonicContact NZ-OE1 3.54Å; K393-E397 PolarHBondContact NZ-OE1 3.33Å; K393-E397 WeakPolarHBondContact O-CB 3.25Å; K393-E397 WeakPolarHBondContact O-CG 3.45Å; K393-E397 PolarHBondContact O-N 2.87Å; K393-H440 PolarHBondContact NZ-CE1 3.39Å; K393-C441 PolarHBondContact NZ-O 3.5Å
394	E	90.1	Very high	84.6	Confident	57 Å²	57	33.5 Å²	33.5	27%	0.266	17%	0.169	S	C	.	.	H	α-helix	trans	-64.7	-38.4	-177.1	-161.2	-173.5	87.9	0	0	111.8	D182 V183 N392 E397 F398 I438 V456	D182-E394 WeakPolarHBondContact CB-OE1 3.49Å; V183-E394 WeakPolarHBondContact CB-OE1 3.41Å; V183-E394 HydrophobicContact CG2-CB 4.48Å; V183-E394 HydrophobicContact CG2-CG 3.92Å; V183-E394 WeakPolarHBondContact CG2-OE1 3.41Å; V183-E394 PolarHBondContact N-OE1 2.86Å; N392-E394 VanDerWaalsContact C-N 3.33Å; E394-E397 WeakPolarHBondContact O-CB 3.4Å; E394-E397 PolarHBondContact O-N 2.92Å; E394-F398 VanDerWaalsContact O-CB 3.27Å; E394-F398 WeakPolarHBondContact O-CB 3.48Å; E394-F398 PolarHBondContact O-N 3.49Å; E394-I438 HydrophobicContact CG-CD1 4.34Å; E394-V456 HydrophobicContact CG-CG2 4.21Å; E394-V456 VanDerWaalsContact OE1-CG2 3.29Å; E394-V456 WeakPolarHBondContact OE1-CG2 3.45Å
395	L	89.6	Confident	84.9	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-39.7	174.2	180	60.9	0	0	0	111.9	D186 F389 N392 K393 E397 F398 I399 L536	D186-L395 HydrophobicContact CB-CD1 4.27Å; D186-L395 HydrophobicContact CB-CD2 4.16Å; D186-L395 WeakPolarHBondContact OD2-CD1 3.29Å; F389-L395 HydrophobicContact CD1-CD2 3.87Å; F389-L395 HydrophobicContact CD1-CG 4.28Å; F389-L395 HydrophobicContact CE1-CD2 4.15Å; N392-L395 HydrophobicContact CB-CB 4Å; N392-L395 VanDerWaalsContact ND2-CB 3.29Å; N392-L395 WeakPolarHBondContact ND2-CB 3.46Å; N392-L395 WeakPolarHBondContact OD1-CB 3.46Å; N392-L395 PolarHBondContact OD1-N 3.33Å; K393-L395 PolarHBondContact O-N 2.73Å; L395-E397 VanDerWaalsContact C-N 3.34Å; L395-F398 HydrophobicContact CD1-CD1 4.32Å; L395-F398 WeakPolarHBondContact O-CB 3.26Å; L395-F398 PolarHBondContact O-N 2.86Å; L395-I399 HydrophobicContact CD1-CD1 4.3Å; L395-I399 HydrophobicContact CD1-CG1 4.3Å; L395-I399 HydrophobicContact CG-CD1 4.06Å; L395-I399 HydrophobicContact CG-CG1 4.48Å; L395-I399 VanDerWaalsContact O-CG1 3.26Å; L395-I399 WeakPolarHBondContact O-CG1 3.38Å; L395-I399 PolarHBondContact O-N 3.24Å; L395-L536 HydrophobicContact CD1-CD1 4.37Å; L395-L536 HydrophobicContact CD1-CD2 4Å
396	K	91.5	Very high	85.5	Confident	22 Å²	22	27.4 Å²	27.4	10%	0.096	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-41.9	173.9	-69.8	-171.2	-68.7	178.4	0	111.7	W380 L383 F389 N392 K393 F398 I399 M400	W380-K396 HydrophobicContact CE3-CB 3.94Å; W380-K396 HydrophobicContact CH2-CB 3.93Å; W380-K396 HydrophobicContact CZ3-CB 3.38Å; L383-K396 HydrophobicContact CB-CD 4.04Å; L383-K396 HydrophobicContact CB-CG 4.14Å; L383-K396 HydrophobicContact CD1-CB 4.26Å; L383-K396 HydrophobicContact CD1-CG 4.41Å; F389-K396 HydrophobicContact CB-CD 3.8Å; F389-K396 HydrophobicContact CB-CG 3.61Å; F389-K396 HydrophobicContact CG-CG 4.19Å; N392-K396 PolarHBondContact O-N 3.13Å; K393-K396 PolarHBondContact O-N 3.14Å; K396-F398 VanDerWaalsContact C-N 3.29Å; K396-F398 PolarHBondContact O-N 2.98Å; K396-I399 PolarHBondContact O-N 3.08Å; K396-M400 VanDerWaalsContact O-CB 3.26Å; K396-M400 WeakPolarHBondContact O-CB 3.39Å; K396-M400 PolarHBondContact O-N 2.76Å
397	E	93.9	Very high	86.6	Confident	6 Å²	6	25.9 Å²	25.9	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-39.6	173.9	-79.5	175.6	173.8	0	0	111.2	W380 K393 E394 L395 T401 I438 Y439 H440 C441	W380-E397 HydrophobicContact CH2-CG 4.12Å; W380-E397 HydrophobicContact CZ3-CG 3.78Å; K393-E397 WeakPolarHBondContact CE-OE1 3.18Å; K393-E397 IonicContact NZ-OE1 3.54Å; K393-E397 PolarHBondContact NZ-OE1 3.33Å; K393-E397 WeakPolarHBondContact O-CB 3.25Å; K393-E397 WeakPolarHBondContact O-CG 3.45Å; K393-E397 PolarHBondContact O-N 2.87Å; E394-E397 WeakPolarHBondContact O-CB 3.4Å; E394-E397 PolarHBondContact O-N 2.92Å; L395-E397 VanDerWaalsContact C-N 3.34Å; E397-T401 WeakPolarHBondContact O-CB 3.05Å; E397-T401 PolarHBondContact O-N 3.19Å; E397-T401 PolarHBondContact O-OG1 2.87Å; E397-I438 HydrophobicContact CB-CD1 4.19Å; E397-Y439 VanDerWaalsContact CB-O 3.28Å; E397-Y439 WeakPolarHBondContact CB-O 3.4Å; E397-H440 IonicContact OE1-CE1 2.76Å; E397-H440 PolarHBondContact OE1-CE1 3.15Å; E397-H440 IonicContact OE1-CG 3.55Å; E397-H440 IonicContact OE1-ND1 3.41Å; E397-H440 PolarHBondContact OE1-ND1 2.86Å; E397-H440 IonicContact OE2-CE1 3.48Å; E397-H440 IonicContact OE2-CG 3.49Å; E397-H440 IonicContact OE2-ND1 3.65Å; E397-H440 PolarHBondContact OE2-ND1 2.77Å; E397-C441 PolarHBondContact OE1-N 3.38Å
398	F	93.2	Very high	87.6	Confident	4 Å²	4	18.5 Å²	18.5	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-67.5	-47.7	175.6	-175.9	-120.3	0	0	0	112.6	V183 E394 L395 K396 M400 T401 L402 I426 I430 I438 Y532 L536	V183-F398 HydrophobicContact CG1-CD1 4.11Å; V183-F398 HydrophobicContact CG1-CE1 4.26Å; V183-F398 HydrophobicContact CG1-CG 4.28Å; V183-F398 HydrophobicContact CG2-CB 3.55Å; V183-F398 HydrophobicContact CG2-CD1 4.12Å; V183-F398 HydrophobicContact CG2-CD2 4.39Å; V183-F398 HydrophobicContact CG2-CG 3.77Å; E394-F398 VanDerWaalsContact O-CB 3.27Å; E394-F398 WeakPolarHBondContact O-CB 3.48Å; E394-F398 PolarHBondContact O-N 3.49Å; L395-F398 HydrophobicContact CD1-CD1 4.32Å; L395-F398 WeakPolarHBondContact O-CB 3.26Å; L395-F398 PolarHBondContact O-N 2.86Å; K396-F398 VanDerWaalsContact C-N 3.29Å; K396-F398 PolarHBondContact O-N 2.98Å; F398-M400 VanDerWaalsContact C-N 3.34Å; F398-M400 PolarHBondContact O-N 3.41Å; F398-T401 WeakPolarHBondContact O-CA 3.15Å; F398-T401 VanDerWaalsContact O-CB 3.27Å; F398-T401 WeakPolarHBondContact O-CB 3.49Å; F398-T401 PolarHBondContact O-N 3.14Å; F398-L402 HydrophobicContact CD1-CD1 4.06Å; F398-L402 HydrophobicContact CE1-CD1 3.6Å; F398-L402 HydrophobicContact CE1-CG 4.31Å; F398-L402 HydrophobicContact CE2-CD1 4.42Å; F398-L402 HydrophobicContact CE2-CD2 4.25Å; F398-L402 HydrophobicContact CE2-CG 4.27Å; F398-L402 HydrophobicContact CZ-CD1 3.79Å; F398-L402 HydrophobicContact CZ-CD2 4.09Å; F398-L402 HydrophobicContact CZ-CG 4.09Å; F398-L402 WeakPolarHBondContact O-CG 3.39Å; F398-L402 PolarHBondContact O-N 3.3Å; F398-I426 HydrophobicContact CE2-CG2 3.66Å; F398-I426 HydrophobicContact CZ-CG2 4.09Å; F398-I430 HydrophobicContact CZ-CD1 3.87Å; F398-I438 HydrophobicContact CD2-CG2 4.08Å; F398-Y532 AromaticContact CE1-CE1 3.96Å; F398-Y532 HydrophobicContact CE1-CE1 3.96Å; F398-L536 HydrophobicContact CD1-CD1 3.81Å; F398-L536 HydrophobicContact CE1-CD1 3.63Å
399	I	92.4	Very high	88.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-46.7	174.8	-65.2	166.6	0	0	0	110	L383 F389 L395 K396 T401 L402 T403 L536 A540	L383-I399 HydrophobicContact CD1-CB 3.9Å; L383-I399 HydrophobicContact CD1-CG2 3.76Å; L383-I399 HydrophobicContact CD2-CD1 4.2Å; L383-I399 HydrophobicContact CD2-CG2 3.99Å; F389-I399 HydrophobicContact CD1-CD1 3.89Å; F389-I399 HydrophobicContact CE1-CD1 3.29Å; F389-I399 HydrophobicContact CE2-CD1 4.3Å; F389-I399 HydrophobicContact CZ-CD1 3.54Å; L395-I399 HydrophobicContact CD1-CD1 4.3Å; L395-I399 HydrophobicContact CD1-CG1 4.3Å; L395-I399 HydrophobicContact CG-CD1 4.06Å; L395-I399 HydrophobicContact CG-CG1 4.48Å; L395-I399 VanDerWaalsContact O-CG1 3.26Å; L395-I399 WeakPolarHBondContact O-CG1 3.38Å; L395-I399 PolarHBondContact O-N 3.24Å; K396-I399 PolarHBondContact O-N 3.08Å; I399-T401 PolarHBondContact O-N 2.92Å; I399-L402 PolarHBondContact O-N 2.86Å; I399-T403 HydrophobicContact CG2-CG2 4.05Å; I399-T403 WeakPolarHBondContact O-CG2 3.28Å; I399-T403 PolarHBondContact O-N 2.87Å; I399-T403 PolarHBondContact O-OG1 3.47Å; I399-L536 HydrophobicContact CD1-CD2 4.08Å; I399-L536 HydrophobicContact CG1-CB 4.23Å; I399-L536 HydrophobicContact CG1-CD1 4.31Å; I399-L536 HydrophobicContact CG1-CD2 4.09Å; I399-L536 HydrophobicContact CG1-CG 4.44Å; I399-A540 HydrophobicContact CG2-CB 3.71Å
400	M	92.9	Very high	89.2	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.2	-32.8	174.9	-175.4	-180	66.9	0	0	112.4	N377 I379 W380 K396 F398 G404 T405 V450	N377-M400 PolarHBondContact ND2-SD 3.44Å; I379-M400 HydrophobicContact CG2-CB 4.19Å; I379-M400 HydrophobicContact CG2-CG 4.38Å; W380-M400 HydrophobicContact CE3-SD 4.4Å; K396-M400 VanDerWaalsContact O-CB 3.26Å; K396-M400 WeakPolarHBondContact O-CB 3.39Å; K396-M400 PolarHBondContact O-N 2.76Å; F398-M400 VanDerWaalsContact C-N 3.34Å; F398-M400 PolarHBondContact O-N 3.41Å; M400-G404 CarbonylContact O-C 3.54Å; M400-G404 WeakPolarHBondContact O-CA 3.37Å; M400-G404 PolarHBondContact O-N 2.94Å; M400-T405 HydrophobicContact CG-CG2 3.84Å; M400-T405 HydrophobicContact SD-CG2 3.84Å; M400-V450 HydrophobicContact CE-CG1 4.25Å; M400-V450 HydrophobicContact CE-CG2 4.24Å
401	T	93.6	Very high	89.1	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.9	-44.2	172.6	-57.1	0	0	0	0	112.2	E397 F398 I399 T403 R420 I426 I438 Y439	E397-T401 WeakPolarHBondContact O-CB 3.05Å; E397-T401 PolarHBondContact O-N 3.19Å; E397-T401 PolarHBondContact O-OG1 2.87Å; F398-T401 WeakPolarHBondContact O-CA 3.15Å; F398-T401 VanDerWaalsContact O-CB 3.27Å; F398-T401 WeakPolarHBondContact O-CB 3.49Å; F398-T401 PolarHBondContact O-N 3.14Å; I399-T401 PolarHBondContact O-N 2.92Å; T401-T403 VanDerWaalsContact C-N 3.34Å; T401-T403 PolarHBondContact O-N 3.49Å; T401-R420 HydrophobicContact CG2-CB 3.95Å; T401-R420 PolarHBondContact O-N 3.37Å; T401-I426 HydrophobicContact CG2-CD1 3.63Å; T401-I438 HydrophobicContact CG2-CB 4.11Å; T401-I438 HydrophobicContact CG2-CG2 4.18Å; T401-I438 WeakPolarHBondContact OG1-CB 3.43Å; T401-Y439 HydrophobicContact CG2-CD2 4.28Å; T401-Y439 WeakPolarHBondContact OG1-CB 3.31Å; T401-Y439 PolarHBondContact OG1-N 2.94Å
402	L	92.5	Very high	89	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-35.2	178	-65.5	174.7	0	0	0	112.3	F398 I399 T421 I426 I533 L536 L537	F398-L402 HydrophobicContact CD1-CD1 4.06Å; F398-L402 HydrophobicContact CE1-CD1 3.6Å; F398-L402 HydrophobicContact CE1-CG 4.31Å; F398-L402 HydrophobicContact CE2-CD1 4.42Å; F398-L402 HydrophobicContact CE2-CD2 4.25Å; F398-L402 HydrophobicContact CE2-CG 4.27Å; F398-L402 HydrophobicContact CZ-CD1 3.79Å; F398-L402 HydrophobicContact CZ-CD2 4.09Å; F398-L402 HydrophobicContact CZ-CG 4.09Å; F398-L402 WeakPolarHBondContact O-CG 3.39Å; F398-L402 PolarHBondContact O-N 3.3Å; I399-L402 PolarHBondContact O-N 2.86Å; L402-T421 PolarHBondContact O-OG1 2.86Å; L402-I426 HydrophobicContact CD2-CG2 4.48Å; L402-I533 HydrophobicContact CD1-CG2 4.24Å; L402-I533 HydrophobicContact CD2-CG2 4.44Å; L402-L536 HydrophobicContact CD1-CB 4.4Å; L402-L536 HydrophobicContact CD1-CD1 3.77Å; L402-L537 HydrophobicContact CB-CD2 4.1Å
403	T	90.6	Very high	89	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-96.1	-20.5	-175.3	59.8	0	0	0	0	114.1	I379 I399 T401 L537 A540 L561	I379-T403 HydrophobicContact CD1-CG2 4.45Å; I399-T403 HydrophobicContact CG2-CG2 4.05Å; I399-T403 WeakPolarHBondContact O-CG2 3.28Å; I399-T403 PolarHBondContact O-N 2.87Å; I399-T403 PolarHBondContact O-OG1 3.47Å; T401-T403 VanDerWaalsContact C-N 3.34Å; T401-T403 PolarHBondContact O-N 3.49Å; T403-L537 HydrophobicContact CG2-CD2 3.45Å; T403-L537 VanDerWaalsContact CG2-CD2 3.45Å; T403-A540 HydrophobicContact CG2-CB 3.81Å; T403-L561 HydrophobicContact CG2-CD2 3.48Å; T403-L561 VanDerWaalsContact CG2-CD2 3.48Å
404	G	91.7	Very high	89.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.01	14%	0.141	C	C	.	.			trans	68.4	-175.6	-159.8	0	0	0	0	0	111.5	I379 M400 L417	I379-G404 WeakPolarHBondContact CG1-O 3.1Å; M400-G404 CarbonylContact O-C 3.54Å; M400-G404 WeakPolarHBondContact O-CA 3.37Å; M400-G404 PolarHBondContact O-N 2.94Å; G404-L417 CarbonylContact C-O 3.52Å; G404-L417 WeakPolarHBondContact CA-O 3.48Å
405	T	93.6	Very high	89.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	171.3	174.6	-169.2	0	0	0	0	111.8	N377 I379 M400 I407 L417	N377-T405 WeakPolarHBondContact OD1-CB 3.32Å; N377-T405 WeakPolarHBondContact OD1-CG2 3.4Å; N377-T405 PolarHBondContact OD1-OG1 3.17Å; I379-T405 WeakPolarHBondContact CB-OG1 3.4Å; I379-T405 PolarHBondContact N-OG1 2.89Å; I379-T405 VanDerWaalsContact N-OG1 3.14Å; M400-T405 HydrophobicContact CG-CG2 3.84Å; M400-T405 HydrophobicContact SD-CG2 3.84Å; T405-I407 HydrophobicContact CG2-CD1 4.47Å; T405-I407 HydrophobicContact CG2-CG1 4.02Å; T405-L417 HydrophobicContact CG2-CB 4.03Å; T405-L417 HydrophobicContact CG2-CD1 3.81Å; T405-L417 HydrophobicContact CG2-CG 4.07Å; T405-L417 PolarHBondContact N-O 3.01Å; T405-L417 PolarHBondContact O-N 3.38Å
406	L	93.7	Very high	89.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.6	165.3	-65.1	177.3	0	0	0	108.8	L315 L319 I378 F408 P416 V553 N556 V557	L315-L406 HydrophobicContact CD2-CD2 4.09Å; L319-L406 HydrophobicContact CD1-CD1 3.74Å; L319-L406 HydrophobicContact CD1-CD2 4.12Å; I378-L406 HydrophobicContact CG1-CB 4Å; I378-L406 WeakPolarHBondContact CG1-O 3.41Å; I378-L406 PolarHBondContact N-O 2.9Å; L406-F408 HydrophobicContact CB-CE2 3.95Å; L406-P416 HydrophobicContact CD2-CB 3.71Å; L406-V553 HydrophobicContact CD1-CG1 4.12Å; L406-N556 HydrophobicContact CD1-CB 4.04Å; L406-V557 HydrophobicContact CD1-CG2 3.83Å; L406-V557 HydrophobicContact CG-CG2 4.11Å
407	I	93.6	Very high	89.1	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.041	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125	175.9	-53.6	174.1	0	0	0	108.4	N377 T405 I414 T415 L417 L448 V450	N377-I407 HydrophobicContact CB-CG1 4.2Å; T405-I407 HydrophobicContact CG2-CD1 4.47Å; T405-I407 HydrophobicContact CG2-CG1 4.02Å; I407-I414 CarbonylContact O-C 3.56Å; I407-I414 WeakPolarHBondContact O-CA 3.29Å; I407-T415 PolarHBondContact N-O 3.34Å; I407-T415 PolarHBondContact O-N 3.07Å; I407-L417 HydrophobicContact CD1-CD1 3.94Å; I407-L417 HydrophobicContact CD1-CG 4.26Å; I407-L448 HydrophobicContact CG2-CB 4.45Å; I407-L448 HydrophobicContact CG2-CD2 3.98Å; I407-V450 HydrophobicContact CD1-CB 4.15Å; I407-V450 HydrophobicContact CD1-CG2 3.53Å
408	F	92.1	Very high	88.8	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.009	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	110.9	173	-67.4	-85.5	0	0	0	108.9	T323 L373 N375 Q376 I378 L406 E413 I414 V553	T323-F408 HydrophobicContact CG2-CE1 3.96Å; T323-F408 HydrophobicContact CG2-CZ 4.31Å; L373-F408 HydrophobicContact CB-CB 4.49Å; L373-F408 HydrophobicContact CB-CD1 3.85Å; L373-F408 HydrophobicContact CB-CD2 4.39Å; L373-F408 HydrophobicContact CB-CE1 4.16Å; L373-F408 HydrophobicContact CB-CG 3.98Å; L373-F408 HydrophobicContact CD1-CD1 4.49Å; L373-F408 HydrophobicContact CD1-CE1 3.97Å; L373-F408 HydrophobicContact CD1-CZ 3.99Å; L373-F408 HydrophobicContact CD2-CD2 4.07Å; L373-F408 HydrophobicContact CD2-CE2 3.92Å; L373-F408 HydrophobicContact CD2-CZ 4.24Å; L373-F408 HydrophobicContact CG-CE1 4.5Å; L373-F408 HydrophobicContact CG-CZ 4.5Å; N375-F408 CarbonylContact C-O 3.58Å; N375-F408 VanDerWaalsContact CA-O 3.25Å; N375-F408 WeakPolarHBondContact CA-O 3.44Å; N375-F408 PolarHBondContact N-O 3.5Å; Q376-F408 PolarHBondContact N-O 2.84Å; Q376-F408 PolarHBondContact O-N 3.03Å; I378-F408 HydrophobicContact CD1-CD2 3.88Å; I378-F408 HydrophobicContact CD1-CE2 3.83Å; I378-F408 HydrophobicContact CG1-CD2 4.07Å; I378-F408 HydrophobicContact CG1-CE2 3.81Å; L406-F408 HydrophobicContact CB-CE2 3.95Å; F408-E413 WeakPolarHBondContact CA-O 3.25Å; F408-I414 HydrophobicContact CD1-CD1 4.49Å; F408-I414 HydrophobicContact CD1-CG1 3.93Å; F408-I414 HydrophobicContact CE1-CB 4.48Å; F408-I414 HydrophobicContact CE1-CD1 3.82Å; F408-I414 HydrophobicContact CE1-CG1 3.7Å; F408-I414 HydrophobicContact CE1-CG2 4.15Å; F408-I414 HydrophobicContact CZ-CG2 4.41Å; F408-V553 HydrophobicContact CE2-CG1 4.08Å; F408-V553 HydrophobicContact CE2-CG2 4.1Å; F408-V553 HydrophobicContact CZ-CG1 4.42Å; F408-V553 HydrophobicContact CZ-CG2 3.68Å
409	G	88.6	Confident	88.6	Confident	17 Å²	17	31.6 Å²	31.6	18%	0.175	18%	0.175	C	C	.	.			trans	-75.3	-168.7	178.6	0	0	0	0	0	114	N375 E413	N375-G409 PolarHBondContact N-O 3.49Å; G409-E413 PolarHBondContact N-O 3.45Å
410	E	80.1	Confident	88.4	Confident	135 Å²	135	33.8 Å²	33.8	63%	0.631	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-42.6	177.5	-72	-170.3	161.8	0	0	112.2	N375 S412	N375-E410 WeakPolarHBondContact ND2-CG 3.41Å; N375-E410 WeakPolarHBondContact OD1-CG 3.45Å; E410-S412 VanDerWaalsContact C-N 3.28Å; E410-S412 PolarHBondContact O-N 3Å
411	D	71.3	Confident	88.1	Confident	148 Å²	148	33.8 Å²	33.8	79%	0.791	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	24.7	-173.4	-64.2	-36.1	0	0	0	113.5	E413	D411-E413 PolarHBondContact O-N 2.73Å
412	S	71.6	Confident	87.7	Confident	29 Å²	29	36.1 Å²	36.1	20%	0.203	20%	0.198	C	C	.	.	S	Bend	trans	59.6	19.4	-170.7	-45.2	0	0	0	0	113.9	E410 I414	E410-S412 VanDerWaalsContact C-N 3.28Å; E410-S412 PolarHBondContact O-N 3Å; S412-I414 PolarHBondContact O-N 2.91Å
413	E	84.3	Confident	87.5	Confident	133 Å²	133	37.9 Å²	37.9	62%	0.621	21%	0.207	S	C	*	.			trans	-64.4	131.3	168.9	-170.4	177.9	-169.9	0	0	109.2	F408 G409 D411	F408-E413 WeakPolarHBondContact CA-O 3.25Å; G409-E413 PolarHBondContact N-O 3.45Å; D411-E413 PolarHBondContact O-N 2.73Å
414	I	90.8	Very high	87.4	Confident	10 Å²	10	48 Å²	48	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116	-179.5	-51.9	178.8	0	0	0	107.5	V316 L319 F320 T323 I407 F408 S412 P416	V316-I414 HydrophobicContact CG1-CB 4.37Å; V316-I414 HydrophobicContact CG2-CB 4.14Å; V316-I414 HydrophobicContact CG2-CG2 4.3Å; V316-I414 WeakPolarHBondContact CG2-O 3.08Å; L319-I414 HydrophobicContact CB-CD1 3.84Å; L319-I414 HydrophobicContact CD1-CG2 4.3Å; F320-I414 HydrophobicContact CB-CD1 4.39Å; T323-I414 HydrophobicContact CG2-CD1 4.38Å; I407-I414 CarbonylContact O-C 3.56Å; I407-I414 WeakPolarHBondContact O-CA 3.29Å; F408-I414 HydrophobicContact CD1-CD1 4.49Å; F408-I414 HydrophobicContact CD1-CG1 3.93Å; F408-I414 HydrophobicContact CE1-CB 4.48Å; F408-I414 HydrophobicContact CE1-CD1 3.82Å; F408-I414 HydrophobicContact CE1-CG1 3.7Å; F408-I414 HydrophobicContact CE1-CG2 4.15Å; F408-I414 HydrophobicContact CZ-CG2 4.41Å; S412-I414 PolarHBondContact O-N 2.91Å; I414-P416 WeakPolarHBondContact O-CD 3.41Å
415	T	90.9	Very high	87.4	Confident	57 Å²	57	52.1 Å²	52.1	35%	0.35	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	98.7	178.3	-54.8	0	0	0	0	109.4	I407	I407-T415 PolarHBondContact N-O 3.34Å; I407-T415 PolarHBondContact O-N 3.07Å
416	P	90.7	Very high	87.4	Confident	20 Å²	20	52.2 Å²	52.2	13%	0.13	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.2	175.8	31.4	-33.8	0	0	0	111.4	A312 L315 V316 L406 I414	A312-P416 HydrophobicContact CB-CG 3.75Å; L315-P416 HydrophobicContact CD2-CB 3.36Å; L315-P416 HydrophobicContact CD2-CG 3.93Å; L315-P416 HydrophobicContact CG-CB 4.27Å; L315-P416 HydrophobicContact CG-CG 4.47Å; V316-P416 HydrophobicContact CG2-CG 4.14Å; L406-P416 HydrophobicContact CD2-CB 3.71Å; I414-P416 WeakPolarHBondContact O-CD 3.41Å
417	L	89.9	Confident	87.3	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.126	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.6	170.8	-61	-172.9	0	0	0	109.7	G404 T405 I407 Y439 V450	G404-L417 CarbonylContact C-O 3.52Å; G404-L417 WeakPolarHBondContact CA-O 3.48Å; T405-L417 HydrophobicContact CG2-CB 4.03Å; T405-L417 HydrophobicContact CG2-CD1 3.81Å; T405-L417 HydrophobicContact CG2-CG 4.07Å; T405-L417 PolarHBondContact N-O 3.01Å; T405-L417 PolarHBondContact O-N 3.38Å; I407-L417 HydrophobicContact CD1-CD1 3.94Å; I407-L417 HydrophobicContact CD1-CG 4.26Å; L417-Y439 HydrophobicContact CB-CE2 4.04Å; L417-Y439 HydrophobicContact CD1-CD1 4.03Å; L417-Y439 HydrophobicContact CD1-CD2 4.23Å; L417-Y439 HydrophobicContact CD1-CE1 4.22Å; L417-Y439 HydrophobicContact CD1-CE2 4.41Å; L417-Y439 HydrophobicContact CD1-CG 4.12Å; L417-Y439 HydrophobicContact CD2-CE1 4.27Å; L417-V450 HydrophobicContact CD1-CB 3.91Å; L417-V450 HydrophobicContact CD1-CG1 3.59Å; L417-V450 HydrophobicContact CD1-CG2 4.09Å
418	P	86.3	Confident	87.2	Confident	65 Å²	65	59.8 Å²	59.8	42%	0.422	30%	0.297	S	S	.	.			trans	-71.6	153.5	-179.6	29.6	-35.5	0	0	0	112.3	Y439	P418-Y439 WeakPolarHBondContact CD-OH 3.31Å; P418-Y439 WeakPolarHBondContact O-CE2 3.22Å; P418-Y439 PolarHBondContact O-OH 3.25Å
419	A	89.1	Confident	87.3	Confident	14 Å²	14	59.9 Å²	59.9	12%	0.116	30%	0.298	C	S	.	.			trans	-68.3	134.5	171.4	0	0	0	0	0	111.2	A564	A419-A564 HydrophobicContact CB-CB 4.42Å
420	R	89.1	Confident	87.6	Confident	45 Å²	45	59.1 Å²	59.1	17%	0.17	29%	0.289	C	S	.	.			trans	-113.5	34.4	177.1	-66.9	177.1	62.5	-164.3	-5	111.8	T401 T422 D423 I426 K437 A452	T401-R420 HydrophobicContact CG2-CB 3.95Å; T401-R420 PolarHBondContact O-N 3.37Å; R420-T422 VanDerWaalsContact C-N 3.31Å; R420-T422 PolarHBondContact O-N 2.57Å; R420-D423 HydrophobicContact CB-CB 4.15Å; R420-D423 IonicContact CZ-OD2 3Å; R420-D423 IonicContact NE-OD2 2.88Å; R420-D423 PolarHBondContact NE-OD2 2.98Å; R420-D423 IonicContact NH2-OD2 3.47Å; R420-D423 PolarHBondContact NH2-OD2 3.4Å; R420-D423 VanDerWaalsContact O-CB 3.28Å; R420-D423 WeakPolarHBondContact O-CB 3.36Å; R420-D423 PolarHBondContact O-N 2.84Å; R420-D423 VanDerWaalsContact O-N 3.15Å; R420-I426 HydrophobicContact CB-CD1 4.39Å; R420-K437 PolarHBondContact NH1-O 2.86Å; R420-K437 VanDerWaalsContact NH1-O 3.12Å; R420-K437 PolarHBondContact NH2-O 3.27Å; R420-A452 PolarHBondContact NH1-O 3.03Å
421	T	86.9	Confident	88.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-38.5	-172	-34	0	0	0	0	113.5	L402 I533 L537 A564 I568	L402-T421 PolarHBondContact O-OG1 2.86Å; T421-I533 HydrophobicContact CG2-CG2 3.77Å; T421-L537 HydrophobicContact CG2-CD1 4.11Å; T421-A564 HydrophobicContact CG2-CB 4.14Å; T421-A564 WeakPolarHBondContact OG1-CA 3.33Å; T421-A564 WeakPolarHBondContact OG1-CB 3.41Å; T421-I568 HydrophobicContact CG2-CD1 3.75Å; T421-I568 HydrophobicContact CG2-CG1 3.73Å
422	T	84.3	Confident	89.3	Confident	50 Å²	50	49.8 Å²	49.8	31%	0.307	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	24.8	178.5	56.6	0	0	0	0	113.9	R420 R424 Q567 F571	R420-T422 VanDerWaalsContact C-N 3.31Å; R420-T422 PolarHBondContact O-N 2.57Å; T422-R424 PolarHBondContact O-N 3.39Å; T422-Q567 HydrophobicContact CG2-CB 3.63Å; T422-Q567 PolarHBondContact OG1-OE1 3.07Å; T422-F571 HydrophobicContact CG2-CB 4.18Å
423	D	89.2	Confident	90.3	Very high	36 Å²	36	49 Å²	49	19%	0.193	24%	0.238	C	C	.	.			trans	-59.1	123.8	173.5	-178.4	-61.8	0	0	0	110.2	R420 D425 I426 L427	R420-D423 HydrophobicContact CB-CB 4.15Å; R420-D423 IonicContact CZ-OD2 3Å; R420-D423 IonicContact NE-OD2 2.88Å; R420-D423 PolarHBondContact NE-OD2 2.98Å; R420-D423 IonicContact NH2-OD2 3.47Å; R420-D423 PolarHBondContact NH2-OD2 3.4Å; R420-D423 VanDerWaalsContact O-CB 3.28Å; R420-D423 WeakPolarHBondContact O-CB 3.36Å; R420-D423 PolarHBondContact O-N 2.84Å; R420-D423 VanDerWaalsContact O-N 3.15Å; D423-D425 VanDerWaalsContact C-N 3.28Å; D423-D425 PolarHBondContact O-N 2.83Å; D423-D425 WeakPolarHBondContact OD1-CB 3.19Å; D423-D425 PolarHBondContact OD1-N 3.43Å; D423-I426 HydrophobicContact CB-CB 4.08Å; D423-I426 HydrophobicContact CB-CD1 3.84Å; D423-I426 HydrophobicContact CB-CG1 3.95Å; D423-I426 PolarHBondContact O-N 3.37Å; D423-I426 PolarHBondContact OD1-N 2.77Å; D423-I426 VanDerWaalsContact OD1-N 3.14Å; D423-L427 WeakPolarHBondContact O-CG 3.31Å; D423-L427 PolarHBondContact O-N 2.83Å
424	R	88.7	Confident	90.8	Very high	215 Å²	215	44.2 Å²	44.2	81%	0.811	22%	0.224	S	C	*	.	H	α-helix	trans	-63.5	-33.8	-172.2	-68.7	-173.3	-179.8	-175.8	0.8	112.7	T422 R428	T422-R424 PolarHBondContact O-N 3.39Å; R424-R428 WeakPolarHBondContact O-CB 3.43Å; R424-R428 PolarHBondContact O-N 3.44Å
425	D	91.3	Very high	91	Very high	87 Å²	87	47.3 Å²	47.3	47%	0.465	24%	0.243	S	C	.	.	H	α-helix	trans	-74.7	-38	-179.3	-67.1	-31.6	0	0	0	110.5	D423 R428 A429	D423-D425 VanDerWaalsContact C-N 3.28Å; D423-D425 PolarHBondContact O-N 2.83Å; D423-D425 WeakPolarHBondContact OD1-CB 3.19Å; D423-D425 PolarHBondContact OD1-N 3.43Å; D425-R428 PolarHBondContact O-N 3.49Å; D425-A429 VanDerWaalsContact O-CB 3.31Å; D425-A429 WeakPolarHBondContact O-CB 3.45Å; D425-A429 PolarHBondContact O-N 3.47Å
426	I	92.9	Very high	91.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-53.6	172.3	-65.8	-179.8	0	0	0	110.6	F398 T401 L402 R420 D423 R428 A429 I430 A436 I438	F398-I426 HydrophobicContact CE2-CG2 3.66Å; F398-I426 HydrophobicContact CZ-CG2 4.09Å; T401-I426 HydrophobicContact CG2-CD1 3.63Å; L402-I426 HydrophobicContact CD2-CG2 4.48Å; R420-I426 HydrophobicContact CB-CD1 4.39Å; D423-I426 HydrophobicContact CB-CB 4.08Å; D423-I426 HydrophobicContact CB-CD1 3.84Å; D423-I426 HydrophobicContact CB-CG1 3.95Å; D423-I426 PolarHBondContact O-N 3.37Å; D423-I426 PolarHBondContact OD1-N 2.77Å; D423-I426 VanDerWaalsContact OD1-N 3.14Å; I426-R428 VanDerWaalsContact C-N 3.28Å; I426-R428 PolarHBondContact O-N 2.83Å; I426-A429 PolarHBondContact O-N 2.96Å; I426-I430 HydrophobicContact CG2-CD1 3.95Å; I426-I430 WeakPolarHBondContact O-CG1 3.5Å; I426-I430 PolarHBondContact O-N 3.4Å; I426-A436 HydrophobicContact CB-CB 4.48Å; I426-A436 HydrophobicContact CG1-CB 4Å; I426-I438 HydrophobicContact CD1-CG2 4.28Å
427	L	91.9	Very high	91.2	Very high	15 Å²	15	47.8 Å²	47.8	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-40	-179.4	-62.6	-175.5	0	0	0	111.4	D423 I430 M431 M529 I533 F571	D423-L427 WeakPolarHBondContact O-CG 3.31Å; D423-L427 PolarHBondContact O-N 2.83Å; L427-I430 PolarHBondContact O-N 3.14Å; L427-M431 WeakPolarHBondContact O-CB 3.25Å; L427-M431 VanDerWaalsContact O-CG 3.29Å; L427-M431 WeakPolarHBondContact O-CG 3.32Å; L427-M431 PolarHBondContact O-N 2.97Å; L427-M431 VanDerWaalsContact O-N 3.08Å; L427-M529 HydrophobicContact CB-CE 4.28Å; L427-M529 HydrophobicContact CB-SD 4.08Å; L427-M529 HydrophobicContact CD1-CE 4.46Å; L427-M529 HydrophobicContact CD2-CE 3.87Å; L427-M529 HydrophobicContact CD2-SD 3.8Å; L427-M529 HydrophobicContact CG-CE 4.42Å; L427-M529 HydrophobicContact CG-SD 4.49Å; L427-I533 HydrophobicContact CD2-CD1 3.54Å; L427-F571 HydrophobicContact CD1-CD2 4.05Å; L427-F571 HydrophobicContact CD1-CE2 3.67Å; L427-F571 HydrophobicContact CD1-CZ 3.93Å
428	R	92	Very high	91.5	Very high	153 Å²	153	46.8 Å²	46.8	58%	0.577	23%	0.234	S	C	*	.	H	α-helix	trans	-64.1	-44.4	175.4	-177	-178.5	178.4	-161.7	-2.8	112	R424 D425 I426 I430 M431 E432	R424-R428 WeakPolarHBondContact O-CB 3.43Å; R424-R428 PolarHBondContact O-N 3.44Å; D425-R428 PolarHBondContact O-N 3.49Å; I426-R428 VanDerWaalsContact C-N 3.28Å; I426-R428 PolarHBondContact O-N 2.83Å; R428-I430 VanDerWaalsContact C-N 3.31Å; R428-I430 PolarHBondContact O-N 3.46Å; R428-M431 PolarHBondContact O-N 3.48Å; R428-E432 IonicContact NE-OE2 2.72Å; R428-E432 PolarHBondContact O-N 2.88Å
429	A	94.3	Very high	91.9	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-38.1	179.6	0	0	0	0	0	112	D425 I426 G433 A436 I458	D425-A429 VanDerWaalsContact O-CB 3.31Å; D425-A429 WeakPolarHBondContact O-CB 3.45Å; D425-A429 PolarHBondContact O-N 3.47Å; I426-A429 PolarHBondContact O-N 2.96Å; A429-G433 WeakPolarHBondContact O-CA 3.31Å; A429-G433 PolarHBondContact O-N 2.95Å; A429-A436 HydrophobicContact CB-CB 3.79Å; A429-I458 HydrophobicContact CB-CD1 4.16Å
430	I	93.4	Very high	92.1	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-44.4	174.5	-65.1	165.3	0	0	0	111	M187 F398 I426 L427 R428 I458 L464 M529 I533	M187-I430 HydrophobicContact SD-CB 4.34Å; M187-I430 HydrophobicContact SD-CG2 3.78Å; F398-I430 HydrophobicContact CZ-CD1 3.87Å; I426-I430 HydrophobicContact CG2-CD1 3.95Å; I426-I430 WeakPolarHBondContact O-CG1 3.5Å; I426-I430 PolarHBondContact O-N 3.4Å; L427-I430 PolarHBondContact O-N 3.14Å; R428-I430 VanDerWaalsContact C-N 3.31Å; R428-I430 PolarHBondContact O-N 3.46Å; I430-I458 HydrophobicContact CG1-CD1 4.06Å; I430-L464 HydrophobicContact CG2-CD1 3.65Å; I430-L464 HydrophobicContact CG2-CG 4.12Å; I430-L464 PolarHBondContact O-N 3.32Å; I430-M529 HydrophobicContact CB-CG 4.46Å; I430-M529 HydrophobicContact CB-SD 4.21Å; I430-M529 HydrophobicContact CG2-CB 4.34Å; I430-M529 HydrophobicContact CG2-CG 3.74Å; I430-M529 HydrophobicContact CG2-SD 4.05Å; I430-I533 HydrophobicContact CD1-CD1 4.43Å
431	M	92.9	Very high	92.3	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-73.7	-49.2	-176.9	-72.8	-67.2	-72.1	0	0	113.4	L427 R428 A463 L464 K465 Y526 M529	L427-M431 WeakPolarHBondContact O-CB 3.25Å; L427-M431 VanDerWaalsContact O-CG 3.29Å; L427-M431 WeakPolarHBondContact O-CG 3.32Å; L427-M431 PolarHBondContact O-N 2.97Å; L427-M431 VanDerWaalsContact O-N 3.08Å; R428-M431 PolarHBondContact O-N 3.48Å; M431-A463 WeakPolarHBondContact O-CB 3.44Å; M431-L464 PolarHBondContact O-N 3.39Å; M431-L464 HydrophobicContact SD-CB 4.42Å; M431-L464 HydrophobicContact SD-CD1 4.16Å; M431-K465 HydrophobicContact CE-CD 4.47Å; M431-K465 HydrophobicContact CE-CG 4.01Å; M431-K465 VanDerWaalsContact O-CB 3.25Å; M431-K465 WeakPolarHBondContact O-CB 3.44Å; M431-K465 VanDerWaalsContact O-CG 3.26Å; M431-K465 WeakPolarHBondContact O-CG 3.45Å; M431-K465 PolarHBondContact O-N 3.36Å; M431-Y526 HydrophobicContact CE-CD1 4.01Å; M431-Y526 HydrophobicContact CE-CD2 4.36Å; M431-Y526 HydrophobicContact CE-CE1 4.07Å; M431-Y526 HydrophobicContact CE-CE2 4.43Å; M431-Y526 HydrophobicContact CE-CG 4.14Å; M431-Y526 HydrophobicContact CG-CE1 4.46Å; M431-Y526 HydrophobicContact SD-CD1 4.33Å; M431-M529 HydrophobicContact CG-CE 4.33Å; M431-M529 HydrophobicContact CG-SD 3.6Å; M431-M529 HydrophobicContact SD-CB 4.13Å; M431-M529 HydrophobicContact SD-SD 4.05Å
432	E	94.1	Very high	92.4	Very high	83 Å²	83	49.5 Å²	49.5	39%	0.388	24%	0.243	S	C	.	.	H	α-helix	trans	-113.9	-14.2	-167.4	-67.6	179.5	178.3	0	0	113.9	R428 K465	R428-E432 IonicContact NE-OE2 2.72Å; R428-E432 PolarHBondContact O-N 2.88Å; E432-K465 HydrophobicContact CG-CD 3.81Å; E432-K465 IonicContact OE1-NZ 3.77Å; E432-K465 PolarHBondContact OE1-NZ 3.19Å
433	G	94	Very high	92.5	Very high	12 Å²	12	49 Å²	49	12%	0.124	24%	0.239	C	C	.	.			trans	84.7	179.4	-168.5	0	0	0	0	0	111.5	A429 I458	A429-G433 WeakPolarHBondContact O-CA 3.31Å; A429-G433 PolarHBondContact O-N 2.95Å; G433-I458 CarbonylContact C-O 3.46Å; G433-I458 VanDerWaalsContact CA-O 3.32Å; G433-I458 WeakPolarHBondContact CA-O 3.36Å
434	G	94.6	Very high	91.6	Very high	33 Å²	33	52.2 Å²	52.2	34%	0.34	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.2	-164.1	-174.4	0	0	0	0	0	112	T457 I458	G434-T457 WeakPolarHBondContact O-CA 3.38Å; G434-I458 PolarHBondContact N-O 3.32Å; G434-I458 PolarHBondContact O-N 3.13Å
435	T	94.4	Very high	91.4	Very high	74 Å²	74	46.6 Å²	46.6	45%	0.454	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.8	-172.9	-55.1	0	0	0	0	110.3	N455 V456 T457	T435-N455 HydrophobicContact CG2-CB 3.6Å; T435-V456 CarbonylContact C-O 3.54Å; T435-V456 VanDerWaalsContact CA-O 3.27Å; T435-V456 WeakPolarHBondContact CA-O 3.3Å; T435-T457 PolarHBondContact OG1-OG1 3.46Å
436	A	93.4	Very high	91.2	Very high	2 Å²	2	46.7 Å²	46.7	2%	0.017	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.8	170.8	0	0	0	0	0	110.1	I426 A429 N455 V456	I426-A436 HydrophobicContact CB-CB 4.48Å; I426-A436 HydrophobicContact CG1-CB 4Å; A429-A436 HydrophobicContact CB-CB 3.79Å; A436-N455 WeakPolarHBondContact O-CA 3.46Å; A436-V456 HydrophobicContact CB-CG1 4.14Å; A436-V456 PolarHBondContact N-O 3.35Å; A436-V456 PolarHBondContact O-N 3.27Å
437	K	93.2	Very high	91.3	Very high	85 Å²	85	46.6 Å²	46.6	37%	0.37	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.5	177	-71.6	174.7	160.2	-161.3	0	110.5	R420 D453 A454	R420-K437 PolarHBondContact NH1-O 2.86Å; R420-K437 VanDerWaalsContact NH1-O 3.12Å; R420-K437 PolarHBondContact NH2-O 3.27Å; K437-D453 HydrophobicContact CD-CB 4.2Å; K437-D453 VanDerWaalsContact CD-OD1 3.3Å; K437-D453 WeakPolarHBondContact CD-OD1 3.33Å; K437-D453 WeakPolarHBondContact CE-OD1 3.31Å; K437-D453 IonicContact NZ-OD1 2.76Å; K437-D453 PolarHBondContact NZ-OD1 2.95Å; K437-A454 CarbonylContact C-O 3.6Å; K437-A454 VanDerWaalsContact CA-O 3.29Å; K437-A454 WeakPolarHBondContact CA-O 3.42Å
438	I	94.8	Very high	91.3	Very high	4 Å²	4	48 Å²	48	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.1	178.6	66.5	166.6	0	0	0	110.9	E394 E397 F398 T401 I426 A452 A454 V456	E394-I438 HydrophobicContact CG-CD1 4.34Å; E397-I438 HydrophobicContact CB-CD1 4.19Å; F398-I438 HydrophobicContact CD2-CG2 4.08Å; T401-I438 HydrophobicContact CG2-CB 4.11Å; T401-I438 HydrophobicContact CG2-CG2 4.18Å; T401-I438 WeakPolarHBondContact OG1-CB 3.43Å; I426-I438 HydrophobicContact CD1-CG2 4.28Å; I438-A452 CarbonylContact O-C 3.32Å; I438-A454 PolarHBondContact N-O 3.46Å; I438-A454 PolarHBondContact O-N 2.89Å; I438-A454 VanDerWaalsContact O-N 3.11Å; I438-V456 HydrophobicContact CD1-CB 4.08Å; I438-V456 HydrophobicContact CD1-CG1 4.25Å; I438-V456 HydrophobicContact CG1-CB 4.29Å; I438-V456 HydrophobicContact CG1-CG1 4.25Å; I438-V456 HydrophobicContact CG2-CG1 3.7Å
439	Y	95.2	Very high	91.3	Very high	13 Å²	13	48 Å²	48	5%	0.051	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.3	168.4	-67.4	-51.8	0	0	0	110.5	E397 T401 L417 P418 V450 V451 A452	E397-Y439 VanDerWaalsContact CB-O 3.28Å; E397-Y439 WeakPolarHBondContact CB-O 3.4Å; T401-Y439 HydrophobicContact CG2-CD2 4.28Å; T401-Y439 WeakPolarHBondContact OG1-CB 3.31Å; T401-Y439 PolarHBondContact OG1-N 2.94Å; L417-Y439 HydrophobicContact CB-CE2 4.04Å; L417-Y439 HydrophobicContact CD1-CD1 4.03Å; L417-Y439 HydrophobicContact CD1-CD2 4.23Å; L417-Y439 HydrophobicContact CD1-CE1 4.22Å; L417-Y439 HydrophobicContact CD1-CE2 4.41Å; L417-Y439 HydrophobicContact CD1-CG 4.12Å; L417-Y439 HydrophobicContact CD2-CE1 4.27Å; P418-Y439 WeakPolarHBondContact CD-OH 3.31Å; P418-Y439 WeakPolarHBondContact O-CE2 3.22Å; P418-Y439 PolarHBondContact O-OH 3.25Å; Y439-V450 HydrophobicContact CD1-CG1 3.76Å; Y439-V450 HydrophobicContact CG-CG1 3.97Å; Y439-V451 CarbonylContact C-O 3.58Å; Y439-V451 VanDerWaalsContact CA-O 3.3Å; Y439-V451 WeakPolarHBondContact CA-O 3.35Å; Y439-A452 HydrophobicContact CD1-CB 4.04Å; Y439-A452 HydrophobicContact CE1-CB 3.79Å
440	H	94.2	Very high	91.3	Very high	58 Å²	58	49.6 Å²	49.6	27%	0.269	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.2	178.1	-178.6	78	0	0	0	111.9	K393 E397 N442 V450 V451 A454	K393-H440 PolarHBondContact NZ-CE1 3.39Å; E397-H440 IonicContact OE1-CE1 2.76Å; E397-H440 PolarHBondContact OE1-CE1 3.15Å; E397-H440 IonicContact OE1-CG 3.55Å; E397-H440 IonicContact OE1-ND1 3.41Å; E397-H440 PolarHBondContact OE1-ND1 2.86Å; E397-H440 IonicContact OE2-CE1 3.48Å; E397-H440 IonicContact OE2-CG 3.49Å; E397-H440 IonicContact OE2-ND1 3.65Å; E397-H440 PolarHBondContact OE2-ND1 2.77Å; H440-N442 PolarHBondContact CD2-OD1 2.9Å; H440-N442 PolarHBondContact O-N 3.4Å; H440-V450 CarbonylContact O-C 3.58Å; H440-V450 VanDerWaalsContact O-CA 3.32Å; H440-V450 WeakPolarHBondContact O-CA 3.3Å; H440-V451 PolarHBondContact N-O 2.77Å; H440-V451 PolarHBondContact O-N 2.91Å; H440-A454 HydrophobicContact CB-CB 3.25Å
441	C	93.3	Very high	91.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	107.7	179.7	-50.1	0	0	0	0	109.9	W380 K393 E397 D443 C447	W380-C441 VanDerWaalsContact CH2-SG 3.59Å; W380-C441 WeakPolarHBondContact CZ3-SG 3.16Å; K393-C441 PolarHBondContact NZ-O 3.5Å; E397-C441 PolarHBondContact OE1-N 3.38Å; C441-D443 PolarHBondContact O-N 3.39Å; C441-C447 HydrophobicContact CB-CB 3.58Å; C441-C447 WeakPolarHBondContact CB-SG 3.45Å; C441-C447 WeakPolarHBondContact SG-CB 3.48Å; C441-C447 CovalentContact SG-SG 2.01Å; C441-C447 PolarHBondContact SG-SG 3.48Å
442	N	89.4	Confident	91	Very high	110 Å²	110	53.9 Å²	53.9	59%	0.588	30%	0.298	S	S	*	.	S	Bend	trans	-72.1	-18.7	175.7	-82.6	-4.3	0	0	0	112.9	H440 K449 V451	H440-N442 PolarHBondContact CD2-OD1 2.9Å; H440-N442 PolarHBondContact O-N 3.4Å; N442-K449 HydrophobicContact CB-CB 4.28Å; N442-K449 PolarHBondContact N-O 3.27Å; N442-V451 WeakPolarHBondContact ND2-CG2 3.32Å
443	D	86.3	Confident	90.7	Very high	39 Å²	39	54.4 Å²	54.4	21%	0.209	30%	0.303	C	S	.	.	S	Bend	trans	-103.7	132.7	169.9	63.3	-49.5	0	0	0	110.5	C441 C447 L448 K449	C441-D443 PolarHBondContact O-N 3.39Å; D443-C447 VanDerWaalsContact OD1-CA 3.29Å; D443-C447 WeakPolarHBondContact OD1-CA 3.26Å; D443-C447 PolarHBondContact OD2-N 3.21Å; D443-C447 VanDerWaalsContact OD2-N 3.08Å; D443-L448 VanDerWaalsContact CG-N 3.28Å; D443-L448 PolarHBondContact OD1-N 3.41Å; D443-L448 PolarHBondContact OD2-N 3.02Å; D443-K449 PolarHBondContact OD1-N 3.17Å
444	S	70.2	Confident	90.6	Very high	104 Å²	104	55 Å²	55	73%	0.727	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-37.1	-163.7	51.6	0	0	0	0	114.7
445	D	83.1	Confident	90.5	Very high	96 Å²	96	59 Å²	59	51%	0.513	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-48.9	-167.3	-170.2	29.3	0	0	0	113.6	W380 K384	W380-D445 PolarHBondContact NE1-O 3Å; K384-D445 PolarHBondContact NZ-O 2.91Å; K384-D445 IonicContact NZ-OD1 3.19Å; K384-D445 PolarHBondContact NZ-OD1 3.12Å
446	K	88.7	Confident	90.4	Very high	89 Å²	89	55.8 Å²	55.8	39%	0.387	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-16	-172.7	-65.3	-175.1	174.9	-170.3	0	114.7	N375 L448	N375-K446 HydrophobicContact CB-CD 4.3Å; K446-L448 HydrophobicContact CB-CD1 4.18Å; K446-L448 HydrophobicContact CB-CD2 4.22Å; K446-L448 HydrophobicContact CB-CG 3.81Å; K446-L448 HydrophobicContact CD-CD1 4.33Å; K446-L448 PolarHBondContact O-N 2.83Å
447	C	93.5	Very high	90.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.324	C	S	.	.			trans	53	49	-178.9	-170.4	0	0	0	0	113.6	N377 W380 C441 D443	N377-C447 WeakPolarHBondContact CB-O 3.4Å; N377-C447 PolarHBondContact ND2-O 2.87Å; N377-C447 PolarHBondContact ND2-SG 3.16Å; N377-C447 VanDerWaalsContact ND2-SG 3.42Å; W380-C447 HydrophobicContact CB-CB 4.11Å; W380-C447 HydrophobicContact CD2-CB 3.46Å; W380-C447 VanDerWaalsContact CD2-CB 3.46Å; W380-C447 HydrophobicContact CE3-CB 4.09Å; W380-C447 HydrophobicContact CG-CB 3.44Å; W380-C447 VanDerWaalsContact CG-CB 3.44Å; W380-C447 HydrophobicContact CZ2-CB 4.26Å; C441-C447 HydrophobicContact CB-CB 3.58Å; C441-C447 WeakPolarHBondContact CB-SG 3.45Å; C441-C447 WeakPolarHBondContact SG-CB 3.48Å; C441-C447 CovalentContact SG-SG 2.01Å; C441-C447 PolarHBondContact SG-SG 3.48Å; D443-C447 VanDerWaalsContact OD1-CA 3.29Å; D443-C447 WeakPolarHBondContact OD1-CA 3.26Å; D443-C447 PolarHBondContact OD2-N 3.21Å; D443-C447 VanDerWaalsContact OD2-N 3.08Å
448	L	92.8	Very high	90.3	Very high	43 Å²	43	55.9 Å²	55.9	23%	0.225	31%	0.308	C	S	.	.			trans	-86.4	-25.9	176.8	-54.3	-179.7	0	0	0	112.1	N375 I407 D443 K446	N375-L448 HydrophobicContact CB-CD1 4Å; I407-L448 HydrophobicContact CG2-CB 4.45Å; I407-L448 HydrophobicContact CG2-CD2 3.98Å; D443-L448 VanDerWaalsContact CG-N 3.28Å; D443-L448 PolarHBondContact OD1-N 3.41Å; D443-L448 PolarHBondContact OD2-N 3.02Å; K446-L448 HydrophobicContact CB-CD1 4.18Å; K446-L448 HydrophobicContact CB-CD2 4.22Å; K446-L448 HydrophobicContact CB-CG 3.81Å; K446-L448 HydrophobicContact CD-CD1 4.33Å; K446-L448 PolarHBondContact O-N 2.83Å
449	K	92	Very high	90.2	Very high	154 Å²	154	57.4 Å²	57.4	67%	0.67	32%	0.321	S	S	*	.	S	Bend	trans	-104.1	85.5	-179.3	-64.7	-176.5	-178.8	-179.9	0	109.8	N442 D443	N442-K449 HydrophobicContact CB-CB 4.28Å; N442-K449 PolarHBondContact N-O 3.27Å; D443-K449 PolarHBondContact OD1-N 3.17Å
450	V	93.9	Very high	90.1	Very high	36 Å²	36	66.6 Å²	66.6	22%	0.218	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.7	-177.6	-178.3	0	0	0	0	111.9	M400 I407 L417 Y439 H440	M400-V450 HydrophobicContact CE-CG1 4.25Å; M400-V450 HydrophobicContact CE-CG2 4.24Å; I407-V450 HydrophobicContact CD1-CB 4.15Å; I407-V450 HydrophobicContact CD1-CG2 3.53Å; L417-V450 HydrophobicContact CD1-CB 3.91Å; L417-V450 HydrophobicContact CD1-CG1 3.59Å; L417-V450 HydrophobicContact CD1-CG2 4.09Å; Y439-V450 HydrophobicContact CD1-CG1 3.76Å; Y439-V450 HydrophobicContact CG-CG1 3.97Å; H440-V450 CarbonylContact O-C 3.58Å; H440-V450 VanDerWaalsContact O-CA 3.32Å; H440-V450 WeakPolarHBondContact O-CA 3.3Å
451	V	92.4	Very high	90.1	Very high	55 Å²	55	67.2 Å²	67.2	33%	0.333	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.7	169	-180	0	0	0	0	109.1	Y439 H440 N442	Y439-V451 CarbonylContact C-O 3.58Å; Y439-V451 VanDerWaalsContact CA-O 3.3Å; Y439-V451 WeakPolarHBondContact CA-O 3.35Å; H440-V451 PolarHBondContact N-O 2.77Å; H440-V451 PolarHBondContact O-N 2.91Å; N442-V451 WeakPolarHBondContact ND2-CG2 3.32Å
452	A	87.9	Confident	89.9	Confident	42 Å²	42	71.1 Å²	71.1	35%	0.347	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-13.5	-173.5	0	0	0	0	0	116.2	R420 I438 Y439	R420-A452 PolarHBondContact NH1-O 3.03Å; I438-A452 CarbonylContact O-C 3.32Å; Y439-A452 HydrophobicContact CD1-CB 4.04Å; Y439-A452 HydrophobicContact CE1-CB 3.79Å
453	D	87	Confident	90.1	Very high	93 Å²	93	65.9 Å²	65.9	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	29.9	-166.8	-69.4	-72.4	0	0	0	113.5	K437	K437-D453 HydrophobicContact CD-CB 4.2Å; K437-D453 VanDerWaalsContact CD-OD1 3.3Å; K437-D453 WeakPolarHBondContact CD-OD1 3.33Å; K437-D453 WeakPolarHBondContact CE-OD1 3.31Å; K437-D453 IonicContact NZ-OD1 2.76Å; K437-D453 PolarHBondContact NZ-OD1 2.95Å
454	A	91.5	Very high	90.5	Very high	24 Å²	24	64.1 Å²	64.1	20%	0.198	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133.6	179.6	0	0	0	0	0	111.5	K437 I438 H440	K437-A454 CarbonylContact C-O 3.6Å; K437-A454 VanDerWaalsContact CA-O 3.29Å; K437-A454 WeakPolarHBondContact CA-O 3.42Å; I438-A454 PolarHBondContact N-O 3.46Å; I438-A454 PolarHBondContact O-N 2.89Å; I438-A454 VanDerWaalsContact O-N 3.11Å; H440-A454 HydrophobicContact CB-CB 3.25Å
455	N	93.4	Very high	91.5	Very high	118 Å²	118	60.9 Å²	60.9	63%	0.631	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.3	-177.7	-72.5	-25.8	0	0	0	111.1	T435 A436	T435-N455 HydrophobicContact CG2-CB 3.6Å; A436-N455 WeakPolarHBondContact O-CA 3.46Å
456	V	91.6	Very high	92	Very high	6 Å²	6	57.7 Å²	57.7	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.8	163	66.9	0	0	0	0	108.7	V183 E394 T435 A436 I438	V183-V456 HydrophobicContact CB-CG2 4.3Å; V183-V456 HydrophobicContact CG2-CG2 4.4Å; E394-V456 HydrophobicContact CG-CG2 4.21Å; E394-V456 VanDerWaalsContact OE1-CG2 3.29Å; E394-V456 WeakPolarHBondContact OE1-CG2 3.45Å; T435-V456 CarbonylContact C-O 3.54Å; T435-V456 VanDerWaalsContact CA-O 3.27Å; T435-V456 WeakPolarHBondContact CA-O 3.3Å; A436-V456 HydrophobicContact CB-CG1 4.14Å; A436-V456 PolarHBondContact N-O 3.35Å; A436-V456 PolarHBondContact O-N 3.27Å; I438-V456 HydrophobicContact CD1-CB 4.08Å; I438-V456 HydrophobicContact CD1-CG1 4.25Å; I438-V456 HydrophobicContact CG1-CB 4.29Å; I438-V456 HydrophobicContact CG1-CG1 4.25Å; I438-V456 HydrophobicContact CG2-CG1 3.7Å
457	T	92.6	Very high	92.2	Very high	85 Å²	85	54.2 Å²	54.2	52%	0.521	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.5	-177.7	-60.2	0	0	0	0	111	G434 T435	G434-T457 WeakPolarHBondContact O-CA 3.38Å; T435-T457 PolarHBondContact OG1-OG1 3.46Å
458	I	92	Very high	92.1	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.5	173.4	-64	174.3	0	0	0	108	V183 M187 A429 I430 G433 G434 R460 A463	V183-I458 HydrophobicContact CG1-CD1 4.4Å; M187-I458 HydrophobicContact CE-CG2 3.56Å; M187-I458 HydrophobicContact SD-CD1 4.37Å; A429-I458 HydrophobicContact CB-CD1 4.16Å; I430-I458 HydrophobicContact CG1-CD1 4.06Å; G433-I458 CarbonylContact C-O 3.46Å; G433-I458 VanDerWaalsContact CA-O 3.32Å; G433-I458 WeakPolarHBondContact CA-O 3.36Å; G434-I458 PolarHBondContact N-O 3.32Å; G434-I458 PolarHBondContact O-N 3.13Å; I458-R460 PolarHBondContact O-N 2.86Å; I458-A463 HydrophobicContact CG2-CB 4.42Å
459	A	93.4	Very high	92.1	Very high	36 Å²	36	54.1 Å²	54.1	30%	0.298	29%	0.285	S	S	.	.			trans	-63.5	135.6	178.3	0	0	0	0	0	110.7	D461 K462 A463	A459-D461 WeakPolarHBondContact CB-OD1 3.11Å; A459-D461 PolarHBondContact O-N 2.82Å; A459-K462 HydrophobicContact CB-CB 4.32Å; A459-K462 HydrophobicContact CB-CG 3.95Å; A459-K462 CarbonylContact O-C 3.59Å; A459-K462 WeakPolarHBondContact O-CA 3.38Å; A459-K462 WeakPolarHBondContact O-CB 3.37Å; A459-K462 PolarHBondContact O-N 2.8Å; A459-A463 PolarHBondContact O-N 2.8Å
460	R	93.9	Very high	92.1	Very high	205 Å²	205	52.5 Å²	52.5	77%	0.774	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-37.7	-175.8	-173.6	-179.8	-175.4	178	2.4	113	I458 K462 A463 S466	I458-R460 PolarHBondContact O-N 2.86Å; R460-K462 PolarHBondContact O-N 2.89Å; R460-A463 PolarHBondContact O-N 2.82Å; R460-S466 WeakPolarHBondContact O-CB 3.16Å; R460-S466 PolarHBondContact O-OG 3.24Å
461	D	92.6	Very high	91.9	Very high	71 Å²	71	51.3 Å²	51.3	38%	0.38	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.4	-179.5	69.3	-63.6	0	0	0	113.1	A459 S466	A459-D461 WeakPolarHBondContact CB-OD1 3.11Å; A459-D461 PolarHBondContact O-N 2.82Å; D461-S466 VanDerWaalsContact CA-OG 3.29Å; D461-S466 WeakPolarHBondContact CA-OG 3.49Å; D461-S466 PolarHBondContact O-OG 3.01Å
462	K	89.9	Confident	91.8	Very high	83 Å²	83	48.7 Å²	48.7	36%	0.361	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-16.8	178.8	-56.5	-54.4	-171.5	179.7	0	113.5	N184 M187 N188 A459 R460 Q467	N184-K462 WeakPolarHBondContact OD1-CB 3.46Å; N184-K462 VanDerWaalsContact OD1-CG 3.29Å; N184-K462 WeakPolarHBondContact OD1-CG 3.39Å; M187-K462 WeakPolarHBondContact CE-O 3.3Å; N188-K462 WeakPolarHBondContact ND2-CD 3.42Å; A459-K462 HydrophobicContact CB-CB 4.32Å; A459-K462 HydrophobicContact CB-CG 3.95Å; A459-K462 CarbonylContact O-C 3.59Å; A459-K462 WeakPolarHBondContact O-CA 3.38Å; A459-K462 WeakPolarHBondContact O-CB 3.37Å; A459-K462 PolarHBondContact O-N 2.8Å; R460-K462 PolarHBondContact O-N 2.89Å; K462-Q467 PolarHBondContact O-NE2 3.47Å
463	A	94.4	Very high	91.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-59.1	150.4	174.2	0	0	0	0	0	112.3	M431 I458 A459 R460 K465 S466 Q467	M431-A463 WeakPolarHBondContact O-CB 3.44Å; I458-A463 HydrophobicContact CG2-CB 4.42Å; A459-A463 PolarHBondContact O-N 2.8Å; R460-A463 PolarHBondContact O-N 2.82Å; A463-K465 PolarHBondContact O-N 3.45Å; A463-S466 PolarHBondContact O-N 3.41Å; A463-S466 VanDerWaalsContact O-N 3.11Å; A463-Q467 PolarHBondContact O-N 3.31Å; A463-Q467 VanDerWaalsContact O-N 3.07Å
464	L	92.9	Very high	92	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-55.7	-47	-173.8	-68.2	179.2	0	0	0	112.3	M187 F191 I430 M431 S466 Q467 I468 I528 M529	M187-L464 HydrophobicContact CG-CD2 4.39Å; M187-L464 HydrophobicContact SD-CG 4.31Å; F191-L464 HydrophobicContact CD2-CD2 3.69Å; F191-L464 HydrophobicContact CE2-CD2 4.34Å; F191-L464 HydrophobicContact CG-CD2 4.43Å; I430-L464 HydrophobicContact CG2-CD1 3.65Å; I430-L464 HydrophobicContact CG2-CG 4.12Å; I430-L464 PolarHBondContact O-N 3.32Å; M431-L464 PolarHBondContact O-N 3.39Å; M431-L464 HydrophobicContact SD-CB 4.42Å; M431-L464 HydrophobicContact SD-CD1 4.16Å; L464-S466 VanDerWaalsContact C-N 3.29Å; L464-S466 PolarHBondContact O-N 3.36Å; L464-Q467 PolarHBondContact O-N 2.79Å; L464-I468 HydrophobicContact CB-CD1 4.18Å; L464-I468 VanDerWaalsContact O-CB 3.32Å; L464-I468 WeakPolarHBondContact O-CB 3.42Å; L464-I468 WeakPolarHBondContact O-CD1 3.14Å; L464-I468 WeakPolarHBondContact O-CG1 3.38Å; L464-I468 PolarHBondContact O-N 2.8Å; L464-I528 HydrophobicContact CD1-CG2 4.03Å; L464-I528 HydrophobicContact CD2-CG2 3.73Å; L464-M529 HydrophobicContact CD1-CB 3.66Å; L464-M529 HydrophobicContact CD1-CG 4.44Å
465	K	92.6	Very high	91.8	Very high	36 Å²	36	45.6 Å²	45.6	16%	0.157	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-39.9	-179.8	-69.6	-168.5	-168.7	-169.9	0	112.4	M431 E432 A463 T469 T521 D522	M431-K465 HydrophobicContact CE-CD 4.47Å; M431-K465 HydrophobicContact CE-CG 4.01Å; M431-K465 VanDerWaalsContact O-CB 3.25Å; M431-K465 WeakPolarHBondContact O-CB 3.44Å; M431-K465 VanDerWaalsContact O-CG 3.26Å; M431-K465 WeakPolarHBondContact O-CG 3.45Å; M431-K465 PolarHBondContact O-N 3.36Å; E432-K465 HydrophobicContact CG-CD 3.81Å; E432-K465 IonicContact OE1-NZ 3.77Å; E432-K465 PolarHBondContact OE1-NZ 3.19Å; A463-K465 PolarHBondContact O-N 3.45Å; K465-T469 VanDerWaalsContact O-CB 3.22Å; K465-T469 WeakPolarHBondContact O-CB 3.48Å; K465-T469 PolarHBondContact O-N 2.96Å; K465-T469 PolarHBondContact O-OG1 2.9Å; K465-T521 HydrophobicContact CB-CG2 3.91Å; K465-T521 HydrophobicContact CG-CG2 4.09Å; K465-T521 WeakPolarHBondContact O-CG2 3.06Å; K465-D522 WeakPolarHBondContact CD-OD1 3.45Å; K465-D522 WeakPolarHBondContact CE-OD1 3.36Å; K465-D522 IonicContact NZ-OD1 3.1Å; K465-D522 PolarHBondContact NZ-OD1 3.39Å; K465-D522 IonicContact NZ-OD2 3.41Å
466	S	93.3	Very high	91.4	Very high	29 Å²	29	41 Å²	41	20%	0.203	21%	0.209	C	C	.	.	H	α-helix	trans	-65.8	-46.9	177.3	164.4	0	0	0	0	111.2	R460 D461 A463 L464 T469 K470	R460-S466 WeakPolarHBondContact O-CB 3.16Å; R460-S466 PolarHBondContact O-OG 3.24Å; D461-S466 VanDerWaalsContact CA-OG 3.29Å; D461-S466 WeakPolarHBondContact CA-OG 3.49Å; D461-S466 PolarHBondContact O-OG 3.01Å; A463-S466 PolarHBondContact O-N 3.41Å; A463-S466 VanDerWaalsContact O-N 3.11Å; L464-S466 VanDerWaalsContact C-N 3.29Å; L464-S466 PolarHBondContact O-N 3.36Å; S466-T469 PolarHBondContact O-N 2.83Å; S466-K470 WeakPolarHBondContact O-CG 3.21Å; S466-K470 PolarHBondContact O-N 2.87Å
467	Q	92.1	Very high	91.2	Very high	16 Å²	16	45.1 Å²	45.1	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-42	179.9	-63.3	-163.9	77.2	0	0	112.3	N188 F191 K462 A463 L464 K470 L471	N188-Q467 PolarHBondContact OD1-NE2 3.31Å; F191-Q467 HydrophobicContact CD1-CB 3.94Å; F191-Q467 HydrophobicContact CD1-CG 4.41Å; F191-Q467 HydrophobicContact CE1-CB 3.47Å; F191-Q467 VanDerWaalsContact CE1-CB 3.47Å; F191-Q467 HydrophobicContact CE1-CG 4.38Å; F191-Q467 HydrophobicContact CE2-CB 4.26Å; F191-Q467 HydrophobicContact CG-CB 4.5Å; F191-Q467 HydrophobicContact CZ-CB 3.64Å; K462-Q467 PolarHBondContact O-NE2 3.47Å; A463-Q467 PolarHBondContact O-N 3.31Å; A463-Q467 VanDerWaalsContact O-N 3.07Å; L464-Q467 PolarHBondContact O-N 2.79Å; Q467-K470 PolarHBondContact O-N 2.94Å; Q467-L471 PolarHBondContact O-N 3.07Å; Q467-L471 VanDerWaalsContact O-N 3.07Å
468	I	92.7	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-46.3	176.7	-67.2	164.6	0	0	0	110.5	F191 L464 K470 L471 L472 F492 T521 I524 I528	F191-I468 HydrophobicContact CE2-CD1 4.34Å; F191-I468 HydrophobicContact CE2-CG1 3.62Å; F191-I468 HydrophobicContact CZ-CG1 3.87Å; L464-I468 HydrophobicContact CB-CD1 4.18Å; L464-I468 VanDerWaalsContact O-CB 3.32Å; L464-I468 WeakPolarHBondContact O-CB 3.42Å; L464-I468 WeakPolarHBondContact O-CD1 3.14Å; L464-I468 WeakPolarHBondContact O-CG1 3.38Å; L464-I468 PolarHBondContact O-N 2.8Å; I468-K470 VanDerWaalsContact C-N 3.27Å; I468-K470 PolarHBondContact O-N 3.21Å; I468-L471 PolarHBondContact O-N 2.81Å; I468-L471 VanDerWaalsContact O-N 3.12Å; I468-L472 HydrophobicContact CG2-CD1 3.69Å; I468-L472 HydrophobicContact CG2-CG 4.07Å; I468-L472 WeakPolarHBondContact O-CB 3.29Å; I468-L472 WeakPolarHBondContact O-CG 3.45Å; I468-L472 PolarHBondContact O-N 3.44Å; I468-F492 HydrophobicContact CG1-CE2 4.24Å; I468-F492 HydrophobicContact CG2-CE2 4.45Å; I468-F492 HydrophobicContact CG2-CZ 4.04Å; I468-T521 HydrophobicContact CB-CG2 4.18Å; I468-T521 HydrophobicContact CG2-CG2 3.96Å; I468-I524 HydrophobicContact CD1-CB 4.46Å; I468-I524 HydrophobicContact CD1-CG2 4.12Å; I468-I524 HydrophobicContact CG1-CG2 4.47Å; I468-I524 HydrophobicContact CG2-CB 4.35Å; I468-I524 HydrophobicContact CG2-CG2 4.4Å; I468-I528 HydrophobicContact CD1-CD1 4.12Å; I468-I528 HydrophobicContact CG1-CD1 4.36Å
469	T	91.8	Very high	90.5	Very high	41 Å²	41	44.4 Å²	44.4	25%	0.252	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-41.3	177.7	-60.1	0	0	0	0	111.3	K465 S466 T473 T521	K465-T469 VanDerWaalsContact O-CB 3.22Å; K465-T469 WeakPolarHBondContact O-CB 3.48Å; K465-T469 PolarHBondContact O-N 2.96Å; K465-T469 PolarHBondContact O-OG1 2.9Å; S466-T469 PolarHBondContact O-N 2.83Å; T469-T473 VanDerWaalsContact O-CB 3.27Å; T469-T473 WeakPolarHBondContact O-CB 3.27Å; T469-T473 PolarHBondContact O-N 2.87Å; T469-T473 PolarHBondContact O-OG1 3.31Å; T469-T521 WeakPolarHBondContact OG1-CG2 3.35Å; T469-T521 PolarHBondContact OG1-OG1 3.2Å
470	K	91.8	Very high	89.9	Confident	121 Å²	121	47.1 Å²	47.1	53%	0.526	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-44.8	175.5	-73.7	172.4	-175.5	173.6	0	111.9	S466 Q467 I468 S474	S466-K470 WeakPolarHBondContact O-CG 3.21Å; S466-K470 PolarHBondContact O-N 2.87Å; Q467-K470 PolarHBondContact O-N 2.94Å; I468-K470 VanDerWaalsContact C-N 3.27Å; I468-K470 PolarHBondContact O-N 3.21Å; K470-S474 WeakPolarHBondContact O-CB 3.22Å; K470-S474 PolarHBondContact O-N 2.93Å
471	L	89.6	Confident	89.5	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-47.9	176.9	-80.4	174.6	0	0	0	112.2	F191 F196 Q467 I468 T473 S474 I475 R488 E489 F492	F191-L471 HydrophobicContact CE1-CD1 3.65Å; F191-L471 HydrophobicContact CZ-CD1 3.63Å; F196-L471 HydrophobicContact CZ-CD1 4.37Å; Q467-L471 PolarHBondContact O-N 3.07Å; Q467-L471 VanDerWaalsContact O-N 3.07Å; I468-L471 PolarHBondContact O-N 2.81Å; I468-L471 VanDerWaalsContact O-N 3.12Å; L471-T473 VanDerWaalsContact C-N 3.33Å; L471-T473 PolarHBondContact O-N 3.07Å; L471-S474 WeakPolarHBondContact O-CB 3.31Å; L471-S474 PolarHBondContact O-N 3.01Å; L471-S474 VanDerWaalsContact O-N 3.17Å; L471-I475 VanDerWaalsContact O-CG1 3.26Å; L471-I475 WeakPolarHBondContact O-CG1 3.3Å; L471-I475 PolarHBondContact O-N 3.42Å; L471-R488 HydrophobicContact CD2-CG 4.16Å; L471-E489 HydrophobicContact CD2-CG 4.08Å; L471-F492 HydrophobicContact CB-CD1 4.47Å; L471-F492 HydrophobicContact CD1-CB 4.02Å; L471-F492 HydrophobicContact CD1-CD1 4.46Å; L471-F492 HydrophobicContact CD1-CD2 3.77Å; L471-F492 HydrophobicContact CD1-CE2 4.35Å; L471-F492 HydrophobicContact CD1-CG 3.82Å
472	L	90.3	Very high	89	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-41.6	178.5	-69.5	176.4	0	0	0	111.8	I468 I475 Q476 F492 V500 L504 V517 L520 T521 I524	I468-L472 HydrophobicContact CG2-CD1 3.69Å; I468-L472 HydrophobicContact CG2-CG 4.07Å; I468-L472 WeakPolarHBondContact O-CB 3.29Å; I468-L472 WeakPolarHBondContact O-CG 3.45Å; I468-L472 PolarHBondContact O-N 3.44Å; L472-I475 PolarHBondContact O-N 3.44Å; L472-Q476 WeakPolarHBondContact O-CB 3.45Å; L472-Q476 PolarHBondContact O-N 3.4Å; L472-F492 HydrophobicContact CD2-CE1 3.77Å; L472-F492 HydrophobicContact CD2-CZ 4.22Å; L472-F492 HydrophobicContact CG-CE1 4.34Å; L472-F492 HydrophobicContact CG-CZ 4.45Å; L472-V500 HydrophobicContact CD2-CG1 3.54Å; L472-L504 HydrophobicContact CD2-CD1 4.06Å; L472-L504 HydrophobicContact CD2-CD2 4.46Å; L472-V517 HydrophobicContact CB-CG1 4.22Å; L472-V517 HydrophobicContact CD1-CG1 4.24Å; L472-L520 HydrophobicContact CD1-CB 4.46Å; L472-L520 HydrophobicContact CD1-CD2 4.1Å; L472-L520 HydrophobicContact CD1-CG 4.15Å; L472-L520 HydrophobicContact CD2-CD2 3.83Å; L472-L520 HydrophobicContact CD2-CG 4.5Å; L472-T521 WeakPolarHBondContact CD1-OG1 3.08Å; L472-I524 HydrophobicContact CD1-CD1 4.48Å; L472-I524 HydrophobicContact CD2-CD1 4.23Å
473	T	89.4	Confident	88.8	Confident	54 Å²	54	43.9 Å²	43.9	33%	0.331	25%	0.25	S	C	.	.	H	α-helix	trans	-64.8	-40.7	175.4	-54.8	0	0	0	0	111.4	T469 L471 Q476 N477	T469-T473 VanDerWaalsContact O-CB 3.27Å; T469-T473 WeakPolarHBondContact O-CB 3.27Å; T469-T473 PolarHBondContact O-N 2.87Å; T469-T473 PolarHBondContact O-OG1 3.31Å; L471-T473 VanDerWaalsContact C-N 3.33Å; L471-T473 PolarHBondContact O-N 3.07Å; T473-Q476 PolarHBondContact O-N 2.94Å; T473-N477 WeakPolarHBondContact O-CB 3.29Å; T473-N477 VanDerWaalsContact O-CG 3.22Å; T473-N477 PolarHBondContact O-N 3.04Å; T473-N477 PolarHBondContact O-ND2 3.26Å
474	S	90.7	Very high	88.2	Confident	41 Å²	41	49.1 Å²	49.1	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-63.4	-48.4	176.1	-168.2	0	0	0	0	111.7	K470 L471 Q476 N477 K478 E489	K470-S474 WeakPolarHBondContact O-CB 3.22Å; K470-S474 PolarHBondContact O-N 2.93Å; L471-S474 WeakPolarHBondContact O-CB 3.31Å; L471-S474 PolarHBondContact O-N 3.01Å; L471-S474 VanDerWaalsContact O-N 3.17Å; S474-Q476 VanDerWaalsContact C-N 3.31Å; S474-Q476 PolarHBondContact O-N 2.93Å; S474-N477 PolarHBondContact O-N 3.12Å; S474-K478 WeakPolarHBondContact O-CB 3.27Å; S474-K478 WeakPolarHBondContact O-CG 3.28Å; S474-K478 PolarHBondContact O-N 2.95Å; S474-E489 VanDerWaalsContact CB-OE1 3.27Å; S474-E489 WeakPolarHBondContact CB-OE1 3.45Å; S474-E489 PolarHBondContact OG-OE1 3.22Å
475	I	87.8	Confident	87.7	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.6	-45.1	175.8	-68	162.5	0	0	0	110.5	L471 L472 K478 A479 L485 E489 F492 I493 F501 L504	L471-I475 VanDerWaalsContact O-CG1 3.26Å; L471-I475 WeakPolarHBondContact O-CG1 3.3Å; L471-I475 PolarHBondContact O-N 3.42Å; L472-I475 PolarHBondContact O-N 3.44Å; I475-K478 PolarHBondContact O-N 3.37Å; I475-A479 WeakPolarHBondContact O-CB 3.39Å; I475-A479 PolarHBondContact O-N 2.92Å; I475-L485 HydrophobicContact CB-CD2 4.39Å; I475-L485 HydrophobicContact CG1-CD2 4.18Å; I475-L485 HydrophobicContact CG2-CD2 4.26Å; I475-E489 HydrophobicContact CD1-CB 4.14Å; I475-E489 HydrophobicContact CD1-CG 4.38Å; I475-E489 HydrophobicContact CG1-CB 3.73Å; I475-E489 HydrophobicContact CG1-CG 3.75Å; I475-F492 HydrophobicContact CD1-CD1 3.83Å; I475-F492 HydrophobicContact CD1-CE1 4.22Å; I475-I493 HydrophobicContact CD1-CD1 4.03Å; I475-I493 HydrophobicContact CD1-CG1 4.02Å; I475-I493 HydrophobicContact CG2-CD1 4.41Å; I475-F501 HydrophobicContact CG2-CD1 4.39Å; I475-F501 HydrophobicContact CG2-CE1 4.03Å; I475-L504 HydrophobicContact CB-CD1 3.99Å; I475-L504 HydrophobicContact CG2-CD1 3.58Å
476	Q	85	Confident	87.1	Confident	21 Å²	21	51.5 Å²	51.5	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-50.5	178.4	175.3	166.5	75.8	0	0	111.7	L472 T473 S474 K478 A479 V480 N514	L472-Q476 WeakPolarHBondContact O-CB 3.45Å; L472-Q476 PolarHBondContact O-N 3.4Å; T473-Q476 PolarHBondContact O-N 2.94Å; S474-Q476 VanDerWaalsContact C-N 3.31Å; S474-Q476 PolarHBondContact O-N 2.93Å; Q476-K478 VanDerWaalsContact C-N 3.32Å; Q476-K478 PolarHBondContact O-N 3.47Å; Q476-A479 PolarHBondContact O-N 3.23Å; Q476-V480 WeakPolarHBondContact O-CG2 2.89Å; Q476-V480 PolarHBondContact O-N 3.32Å; Q476-N514 VanDerWaalsContact CD-ND2 3.28Å; Q476-N514 PolarHBondContact NE2-ND2 3.14Å; Q476-N514 PolarHBondContact NE2-OD1 3.02Å; Q476-N514 VanDerWaalsContact NE2-OD1 3.12Å; Q476-N514 PolarHBondContact OE1-ND2 2.8Å; Q476-N514 VanDerWaalsContact OE1-ND2 3.08Å
477	N	86.8	Confident	86.3	Confident	93 Å²	93	54.7 Å²	54.7	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-42.7	179.8	-71.8	-20.2	0	0	0	111.2	T473 S474 V480 S481	T473-N477 WeakPolarHBondContact O-CB 3.29Å; T473-N477 VanDerWaalsContact O-CG 3.22Å; T473-N477 PolarHBondContact O-N 3.04Å; T473-N477 PolarHBondContact O-ND2 3.26Å; S474-N477 PolarHBondContact O-N 3.12Å; N477-V480 PolarHBondContact O-N 3.01Å; N477-S481 WeakPolarHBondContact O-CB 3.13Å; N477-S481 PolarHBondContact O-N 2.85Å; N477-S481 PolarHBondContact O-OG 2.86Å
478	K	88.1	Confident	85.5	Confident	37 Å²	37	58.4 Å²	58.4	16%	0.161	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-36.7	177.1	-75.4	-176.5	-178.2	179	0	112.7	S474 I475 Q476 V480 D482 T483 L485 D486 E489	S474-K478 WeakPolarHBondContact O-CB 3.27Å; S474-K478 WeakPolarHBondContact O-CG 3.28Å; S474-K478 PolarHBondContact O-N 2.95Å; I475-K478 PolarHBondContact O-N 3.37Å; Q476-K478 VanDerWaalsContact C-N 3.32Å; Q476-K478 PolarHBondContact O-N 3.47Å; K478-V480 VanDerWaalsContact C-N 3.32Å; K478-D482 PolarHBondContact O-N 2.73Å; K478-D482 VanDerWaalsContact O-N 3.09Å; K478-T483 WeakPolarHBondContact CB-O 3.4Å; K478-T483 HydrophobicContact CG-CG2 4.21Å; K478-T483 PolarHBondContact O-N 3.04Å; K478-L485 HydrophobicContact CB-CD2 3.93Å; K478-L485 HydrophobicContact CD-CD2 3.92Å; K478-D486 IonicContact NZ-OD2 2.57Å; K478-D486 PolarHBondContact NZ-OD2 2.92Å; K478-E489 WeakPolarHBondContact CD-OE1 3.42Å; K478-E489 VanDerWaalsContact CD-OE2 3.27Å; K478-E489 WeakPolarHBondContact CD-OE2 3.47Å; K478-E489 VanDerWaalsContact CE-OE1 3.28Å; K478-E489 WeakPolarHBondContact CE-OE1 3.27Å; K478-E489 WeakPolarHBondContact CE-OE2 3.45Å; K478-E489 IonicContact NZ-OE1 3.64Å; K478-E489 PolarHBondContact NZ-OE1 3.48Å; K478-E489 IonicContact NZ-OE2 3.53Å; K478-E489 PolarHBondContact NZ-OE2 2.7Å
479	A	81.3	Confident	85	Confident	38 Å²	38	58.4 Å²	58.4	31%	0.314	33%	0.326	S	S	.	.	H	α-helix	trans	-66.2	-34.4	173.4	0	0	0	0	0	112.3	I475 Q476 I505	I475-A479 WeakPolarHBondContact O-CB 3.39Å; I475-A479 PolarHBondContact O-N 2.92Å; Q476-A479 PolarHBondContact O-N 3.23Å; A479-I505 HydrophobicContact CB-CD1 4.19Å; A479-I505 HydrophobicContact CB-CG1 4.15Å
480	V	81.6	Confident	84.2	Confident	92 Å²	92	59 Å²	59	56%	0.558	33%	0.325	S	S	*	.	H	α-helix	trans	-73.7	-44	175.9	172.8	0	0	0	0	111.9	Q476 N477 K478 D482	Q476-V480 WeakPolarHBondContact O-CG2 2.89Å; Q476-V480 PolarHBondContact O-N 3.32Å; N477-V480 PolarHBondContact O-N 3.01Å; K478-V480 VanDerWaalsContact C-N 3.32Å; V480-D482 PolarHBondContact O-N 2.83Å
481	S	85	Confident	83.1	Confident	72 Å²	72	53.7 Å²	53.7	50%	0.503	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	9.2	-177.7	66.7	0	0	0	0	113.8	N477 T483	N477-S481 WeakPolarHBondContact O-CB 3.13Å; N477-S481 PolarHBondContact O-N 2.85Å; N477-S481 PolarHBondContact O-OG 2.86Å; S481-T483 PolarHBondContact O-N 2.92Å; S481-T483 PolarHBondContact O-OG1 3.45Å; S481-T483 PolarHBondContact OG-OG1 2.79Å
482	D	81.8	Confident	82.6	Confident	153 Å²	153	53.4 Å²	53.4	82%	0.818	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	43.4	-175.8	-163.3	32.1	0	0	0	112.9	K478 V480	K478-D482 PolarHBondContact O-N 2.73Å; K478-D482 VanDerWaalsContact O-N 3.09Å; V480-D482 PolarHBondContact O-N 2.83Å
483	T	85.8	Confident	81.9	Confident	67 Å²	67	53.4 Å²	53.4	41%	0.411	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-103.2	135.5	-177.3	-56.6	0	0	0	0	110.2	K478 S481 L485	K478-T483 WeakPolarHBondContact CB-O 3.4Å; K478-T483 HydrophobicContact CG-CG2 4.21Å; K478-T483 PolarHBondContact O-N 3.04Å; S481-T483 PolarHBondContact O-N 2.92Å; S481-T483 PolarHBondContact O-OG1 3.45Å; S481-T483 PolarHBondContact OG-OG1 2.79Å; T483-L485 PolarHBondContact O-N 3.24Å
484	P	82.8	Confident	80.9	Confident	110 Å²	110	53.1 Å²	53.1	71%	0.714	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-59.2	136.8	179.4	-26	34.7	0	0	0	113.2
485	L	80.9	Confident	79.7	Confident	20 Å²	20	52.1 Å²	52.1	11%	0.105	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-65.3	141.8	169.5	-64.6	-167.4	0	0	0	110.8	I475 K478 T483 E489 K490 I493 F501	I475-L485 HydrophobicContact CB-CD2 4.39Å; I475-L485 HydrophobicContact CG1-CD2 4.18Å; I475-L485 HydrophobicContact CG2-CD2 4.26Å; K478-L485 HydrophobicContact CB-CD2 3.93Å; K478-L485 HydrophobicContact CD-CD2 3.92Å; T483-L485 PolarHBondContact O-N 3.24Å; L485-E489 VanDerWaalsContact CA-OE2 3.24Å; L485-E489 WeakPolarHBondContact CA-OE2 3.37Å; L485-E489 HydrophobicContact CB-CB 4.08Å; L485-E489 HydrophobicContact CD1-CB 4.13Å; L485-E489 HydrophobicContact CD2-CB 4.16Å; L485-E489 WeakPolarHBondContact CD2-OE2 3.2Å; L485-E489 HydrophobicContact CG-CB 4.35Å; L485-K490 HydrophobicContact CB-CG 3.96Å; L485-K490 WeakPolarHBondContact O-CE 3.48Å; L485-K490 PolarHBondContact O-NZ 3.26Å; L485-K490 VanDerWaalsContact O-NZ 3.12Å; L485-I493 HydrophobicContact CD1-CD1 3.46Å; L485-I493 VanDerWaalsContact CD1-CD1 3.46Å; L485-F501 HydrophobicContact CD1-CE1 4.23Å; L485-F501 HydrophobicContact CD1-CE2 4.02Å; L485-F501 HydrophobicContact CD1-CZ 3.38Å; L485-F501 HydrophobicContact CG-CZ 4.2Å
486	D	81.1	Confident	78.8	Confident	67 Å²	67	52.6 Å²	52.6	36%	0.358	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-79.2	169.7	169.9	59.1	46.3	0	0	0	111	K478 R488 E489 K490	K478-D486 IonicContact NZ-OD2 2.57Å; K478-D486 PolarHBondContact NZ-OD2 2.92Å; D486-R488 PolarHBondContact O-N 3.49Å; D486-R488 VanDerWaalsContact OD1-CA 3.24Å; D486-R488 WeakPolarHBondContact OD1-CA 3.49Å; D486-R488 WeakPolarHBondContact OD1-CB 3.27Å; D486-R488 PolarHBondContact OD1-N 3.35Å; D486-E489 PolarHBondContact N-OE2 2.78Å; D486-E489 PolarHBondContact O-N 2.75Å; D486-E489 WeakPolarHBondContact OD1-CG 3.45Å; D486-E489 PolarHBondContact OD1-N 3.32Å; D486-K490 WeakPolarHBondContact O-CG 3.36Å; D486-K490 PolarHBondContact O-N 2.97Å
487	D	76.6	Confident	78	Confident	95 Å²	95	56.6 Å²	56.6	51%	0.508	33%	0.325	S	S	.	.	H	α-helix	trans	-62.5	-23.3	179.4	-59.7	-29.8	0	0	0	111.6	K490 G491	D487-K490 IonicContact OD1-NZ 3.62Å; D487-G491 PolarHBondContact O-N 2.81Å
488	R	74.2	Confident	77.3	Confident	94 Å²	94	52.7 Å²	52.7	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-54.8	174.4	-158.3	-176.6	178.4	-174.3	-1.5	110.6	N192 F196 L471 D486 K490 G491 F492	N192-R488 PolarHBondContact OD1-NH2 3.45Å; F196-R488 HydrophobicContact CD1-CB 3.94Å; F196-R488 HydrophobicContact CD1-CG 3.55Å; F196-R488 WeakPolarHBondContact CD1-O 3.41Å; F196-R488 HydrophobicContact CD2-CB 4.47Å; F196-R488 HydrophobicContact CD2-CG 3.42Å; F196-R488 VanDerWaalsContact CD2-CG 3.42Å; F196-R488 HydrophobicContact CE1-CB 4.05Å; F196-R488 HydrophobicContact CE1-CG 3.42Å; F196-R488 VanDerWaalsContact CE1-CG 3.42Å; F196-R488 WeakPolarHBondContact CE1-O 3.36Å; F196-R488 HydrophobicContact CE2-CB 4.49Å; F196-R488 HydrophobicContact CE2-CG 3.2Å; F196-R488 HydrophobicContact CG-CB 4.24Å; F196-R488 HydrophobicContact CG-CG 3.62Å; F196-R488 HydrophobicContact CZ-CB 4.27Å; F196-R488 HydrophobicContact CZ-CG 3.2Å; F196-R488 WeakPolarHBondContact CZ-O 3.35Å; L471-R488 HydrophobicContact CD2-CG 4.16Å; D486-R488 PolarHBondContact O-N 3.49Å; D486-R488 VanDerWaalsContact OD1-CA 3.24Å; D486-R488 WeakPolarHBondContact OD1-CA 3.49Å; D486-R488 WeakPolarHBondContact OD1-CB 3.27Å; D486-R488 PolarHBondContact OD1-N 3.35Å; R488-K490 PolarHBondContact O-N 2.88Å; R488-G491 PolarHBondContact O-N 3.28Å; R488-F492 PolarHBondContact O-N 2.75Å
489	E	82.3	Confident	76.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-39	-177.4	-66.7	156.1	159.9	0	0	112.2	L471 S474 I475 K478 L485 D486 G491 F492 I493	L471-E489 HydrophobicContact CD2-CG 4.08Å; S474-E489 VanDerWaalsContact CB-OE1 3.27Å; S474-E489 WeakPolarHBondContact CB-OE1 3.45Å; S474-E489 PolarHBondContact OG-OE1 3.22Å; I475-E489 HydrophobicContact CD1-CB 4.14Å; I475-E489 HydrophobicContact CD1-CG 4.38Å; I475-E489 HydrophobicContact CG1-CB 3.73Å; I475-E489 HydrophobicContact CG1-CG 3.75Å; K478-E489 WeakPolarHBondContact CD-OE1 3.42Å; K478-E489 VanDerWaalsContact CD-OE2 3.27Å; K478-E489 WeakPolarHBondContact CD-OE2 3.47Å; K478-E489 VanDerWaalsContact CE-OE1 3.28Å; K478-E489 WeakPolarHBondContact CE-OE1 3.27Å; K478-E489 WeakPolarHBondContact CE-OE2 3.45Å; K478-E489 IonicContact NZ-OE1 3.64Å; K478-E489 PolarHBondContact NZ-OE1 3.48Å; K478-E489 IonicContact NZ-OE2 3.53Å; K478-E489 PolarHBondContact NZ-OE2 2.7Å; L485-E489 VanDerWaalsContact CA-OE2 3.24Å; L485-E489 WeakPolarHBondContact CA-OE2 3.37Å; L485-E489 HydrophobicContact CB-CB 4.08Å; L485-E489 HydrophobicContact CD1-CB 4.13Å; L485-E489 HydrophobicContact CD2-CB 4.16Å; L485-E489 WeakPolarHBondContact CD2-OE2 3.2Å; L485-E489 HydrophobicContact CG-CB 4.35Å; D486-E489 PolarHBondContact N-OE2 2.78Å; D486-E489 PolarHBondContact O-N 2.75Å; D486-E489 WeakPolarHBondContact OD1-CG 3.45Å; D486-E489 PolarHBondContact OD1-N 3.32Å; E489-G491 PolarHBondContact O-N 3.06Å; E489-F492 PolarHBondContact O-N 3.02Å; E489-I493 WeakPolarHBondContact O-CD1 3.32Å; E489-I493 VanDerWaalsContact O-CG1 3.3Å; E489-I493 WeakPolarHBondContact O-CG1 3.34Å; E489-I493 PolarHBondContact O-N 3.01Å
490	K	74.8	Confident	76.4	Confident	53 Å²	53	50.7 Å²	50.7	23%	0.23	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-43.8	176.3	-69.3	171.4	-169.9	154.6	0	112.3	W206 L485 D486 D487 R488 I493 S494	W206-K490 HydrophobicContact CG-CG 4.45Å; L485-K490 HydrophobicContact CB-CG 3.96Å; L485-K490 WeakPolarHBondContact O-CE 3.48Å; L485-K490 PolarHBondContact O-NZ 3.26Å; L485-K490 VanDerWaalsContact O-NZ 3.12Å; D486-K490 WeakPolarHBondContact O-CG 3.36Å; D486-K490 PolarHBondContact O-N 2.97Å; D487-K490 IonicContact OD1-NZ 3.62Å; R488-K490 PolarHBondContact O-N 2.88Å; K490-I493 PolarHBondContact O-N 3.26Å; K490-S494 PolarHBondContact O-N 2.97Å; K490-S494 VanDerWaalsContact O-N 3.08Å; K490-S494 PolarHBondContact O-OG 3.44Å
491	G	69.4	Low	76.1	Confident	10 Å²	10	47 Å²	47	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-43.3	178.1	0	0	0	0	0	112	G195 D487 R488 E489 I493 S494 S495	G195-G491 VanDerWaalsContact CA-C 3.49Å; G195-G491 VanDerWaalsContact CA-CA 3.42Å; G195-G491 VanDerWaalsContact O-CA 3.31Å; G195-G491 WeakPolarHBondContact O-CA 3.34Å; D487-G491 PolarHBondContact O-N 2.81Å; R488-G491 PolarHBondContact O-N 3.28Å; E489-G491 PolarHBondContact O-N 3.06Å; G491-I493 PolarHBondContact O-N 2.91Å; G491-S494 CarbonylContact O-C 3.5Å; G491-S494 PolarHBondContact O-N 3.15Å; G491-S494 VanDerWaalsContact O-N 3.12Å; G491-S495 WeakPolarHBondContact O-CB 3.21Å; G491-S495 PolarHBondContact O-N 2.65Å
492	F	79.3	Confident	75.4	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.013	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-46.7	176.5	169.6	-101.2	0	0	0	111.7	F196 I468 L471 L472 I475 R488 E489 S494 S495 V500 I524 I528	F196-F492 HydrophobicContact CE1-CB 4.29Å; F196-F492 HydrophobicContact CZ-CB 4.27Å; I468-F492 HydrophobicContact CG1-CE2 4.24Å; I468-F492 HydrophobicContact CG2-CE2 4.45Å; I468-F492 HydrophobicContact CG2-CZ 4.04Å; L471-F492 HydrophobicContact CB-CD1 4.47Å; L471-F492 HydrophobicContact CD1-CB 4.02Å; L471-F492 HydrophobicContact CD1-CD1 4.46Å; L471-F492 HydrophobicContact CD1-CD2 3.77Å; L471-F492 HydrophobicContact CD1-CE2 4.35Å; L471-F492 HydrophobicContact CD1-CG 3.82Å; L472-F492 HydrophobicContact CD2-CE1 3.77Å; L472-F492 HydrophobicContact CD2-CZ 4.22Å; L472-F492 HydrophobicContact CG-CE1 4.34Å; L472-F492 HydrophobicContact CG-CZ 4.45Å; I475-F492 HydrophobicContact CD1-CD1 3.83Å; I475-F492 HydrophobicContact CD1-CE1 4.22Å; R488-F492 PolarHBondContact O-N 2.75Å; E489-F492 PolarHBondContact O-N 3.02Å; F492-S494 PolarHBondContact O-N 3.1Å; F492-S495 PolarHBondContact O-N 3.17Å; F492-S495 VanDerWaalsContact O-N 3.11Å; F492-S495 PolarHBondContact O-OG 3.12Å; F492-V500 HydrophobicContact CE1-CG2 4.37Å; F492-I524 HydrophobicContact CE1-CD1 4.25Å; F492-I524 HydrophobicContact CE2-CG2 3.67Å; F492-I524 HydrophobicContact CZ-CD1 3.74Å; F492-I524 HydrophobicContact CZ-CG2 3.72Å; F492-I528 HydrophobicContact CE2-CD1 4.06Å
493	I	74.6	Confident	75.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-34.6	176.9	-65.6	162.5	0	0	0	111.6	I475 L485 E489 K490 G491 S495 V500 F501	I475-I493 HydrophobicContact CD1-CD1 4.03Å; I475-I493 HydrophobicContact CD1-CG1 4.02Å; I475-I493 HydrophobicContact CG2-CD1 4.41Å; L485-I493 HydrophobicContact CD1-CD1 3.46Å; L485-I493 VanDerWaalsContact CD1-CD1 3.46Å; E489-I493 WeakPolarHBondContact O-CD1 3.32Å; E489-I493 VanDerWaalsContact O-CG1 3.3Å; E489-I493 WeakPolarHBondContact O-CG1 3.34Å; E489-I493 PolarHBondContact O-N 3.01Å; K490-I493 PolarHBondContact O-N 3.26Å; G491-I493 PolarHBondContact O-N 2.91Å; I493-S495 VanDerWaalsContact C-N 3.32Å; I493-V500 HydrophobicContact CG1-CB 4.3Å; I493-V500 HydrophobicContact CG1-CG1 4.39Å; I493-F501 HydrophobicContact CD1-CD2 4.03Å; I493-F501 HydrophobicContact CD1-CE2 3.52Å; I493-F501 HydrophobicContact CD1-CZ 3.93Å; I493-F501 HydrophobicContact CG2-CD2 4.46Å
494	S	68.8	Low	74.8	Confident	49 Å²	49	35.5 Å²	35.5	34%	0.343	20%	0.197	S	C	.	.	H	α-helix	trans	-78.6	-17.5	179.5	-52.5	0	0	0	0	113.1	K490 G491 F492	K490-S494 PolarHBondContact O-N 2.97Å; K490-S494 VanDerWaalsContact O-N 3.08Å; K490-S494 PolarHBondContact O-OG 3.44Å; G491-S494 CarbonylContact O-C 3.5Å; G491-S494 PolarHBondContact O-N 3.15Å; G491-S494 VanDerWaalsContact O-N 3.12Å; F492-S494 PolarHBondContact O-N 3.1Å
495	S	66.1	Low	74.4	Confident	19 Å²	19	32.6 Å²	32.6	13%	0.133	17%	0.174	C	C	.	.	H	α-helix	trans	-84.6	-18.6	-178.4	75.6	0	0	0	0	114	L194 G491 F492 I493	L194-S495 WeakPolarHBondContact O-CB 3.43Å; G491-S495 WeakPolarHBondContact O-CB 3.21Å; G491-S495 PolarHBondContact O-N 2.65Å; F492-S495 PolarHBondContact O-N 3.17Å; F492-S495 VanDerWaalsContact O-N 3.11Å; F492-S495 PolarHBondContact O-OG 3.12Å; I493-S495 VanDerWaalsContact C-N 3.32Å
496	T	69	Low	74	Confident	11 Å²	11	31.7 Å²	31.7	7%	0.067	17%	0.17	C	C	.	.			trans	-110	144.4	179.9	-174.8	0	0	0	0	110.9	I498 V500 I524	T496-I498 HydrophobicContact CG2-CB 4.49Å; T496-I498 PolarHBondContact O-N 3.17Å; T496-I498 PolarHBondContact OG1-N 3.37Å; T496-V500 HydrophobicContact CG2-CG2 3.68Å; T496-I524 HydrophobicContact CG2-CD1 4.48Å
497	T	67.3	Low	73.4	Confident	104 Å²	104	28.7 Å²	28.7	64%	0.638	15%	0.154	S	C	*	.	S	Bend	trans	-75.5	-10.1	172.4	54.6	0	0	0	0	112.5
498	I	71.7	Confident	73	Confident	12 Å²	12	27.2 Å²	27.2	6%	0.062	14%	0.144	C	C	.	.	S	Bend	trans	-81.2	129.4	-176.4	-55.7	172.9	0	0	0	109.5	T496 V500 Y503 L520 I524 L582	T496-I498 HydrophobicContact CG2-CB 4.49Å; T496-I498 PolarHBondContact O-N 3.17Å; T496-I498 PolarHBondContact OG1-N 3.37Å; I498-V500 WeakPolarHBondContact O-CG2 3.35Å; I498-V500 PolarHBondContact O-N 2.93Å; I498-Y503 HydrophobicContact CG2-CD2 3.99Å; I498-Y503 HydrophobicContact CG2-CE2 3.82Å; I498-L520 HydrophobicContact CB-CD1 4.31Å; I498-L520 HydrophobicContact CD1-CD1 4.49Å; I498-L520 HydrophobicContact CG2-CD1 3.35Å; I498-I524 HydrophobicContact CD1-CG1 3.73Å; I498-L582 HydrophobicContact CG2-CD2 4.06Å
499	P	71.1	Confident	72.6	Confident	32 Å²	32	29.5 Å²	29.5	21%	0.208	16%	0.16	C	C	.	.			trans	-73.9	75.6	-179.7	29.9	-36.1	0	0	0	111.6	F501 K502 Y503	P499-F501 VanDerWaalsContact C-N 3.33Å; P499-F501 PolarHBondContact O-N 2.93Å; P499-K502 HydrophobicContact CB-CB 4.22Å; P499-K502 WeakPolarHBondContact O-CB 3.26Å; P499-K502 PolarHBondContact O-N 3.03Å; P499-K502 VanDerWaalsContact O-N 3.08Å; P499-Y503 HydrophobicContact CG-CD2 4.18Å; P499-Y503 HydrophobicContact CG-CE2 3.62Å; P499-Y503 WeakPolarHBondContact O-CD2 3.06Å; P499-Y503 PolarHBondContact O-N 3.21Å
500	V	80.5	Confident	72	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-48.8	-48.7	-173	175.3	0	0	0	0	112.5	L472 F492 I493 T496 I498 K502 Y503 L504 L520 I524	L472-V500 HydrophobicContact CD2-CG1 3.54Å; F492-V500 HydrophobicContact CE1-CG2 4.37Å; I493-V500 HydrophobicContact CG1-CB 4.3Å; I493-V500 HydrophobicContact CG1-CG1 4.39Å; T496-V500 HydrophobicContact CG2-CG2 3.68Å; I498-V500 WeakPolarHBondContact O-CG2 3.35Å; I498-V500 PolarHBondContact O-N 2.93Å; V500-K502 VanDerWaalsContact C-N 3.31Å; V500-K502 PolarHBondContact O-N 3.23Å; V500-Y503 PolarHBondContact O-N 3.25Å; V500-L504 HydrophobicContact CG1-CD1 3.54Å; V500-L504 HydrophobicContact CG1-CG 4.04Å; V500-L504 WeakPolarHBondContact O-CG 3.47Å; V500-L504 PolarHBondContact O-N 3.45Å; V500-L520 HydrophobicContact CG1-CD2 4.37Å; V500-I524 HydrophobicContact CG2-CD1 3.94Å
501	F	74.4	Confident	71.8	Confident	14 Å²	14	32.2 Å²	32.2	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-38	-177.4	-85.3	-65.9	0	0	0	113.3	W206 Q209 I475 L485 I493 P499 Y503 L504 I505	W206-F501 HydrophobicContact CB-CE2 4.34Å; Q209-F501 HydrophobicContact CB-CB 4.08Å; Q209-F501 HydrophobicContact CB-CD2 3.74Å; Q209-F501 HydrophobicContact CB-CG 4.36Å; I475-F501 HydrophobicContact CG2-CD1 4.39Å; I475-F501 HydrophobicContact CG2-CE1 4.03Å; L485-F501 HydrophobicContact CD1-CE1 4.23Å; L485-F501 HydrophobicContact CD1-CE2 4.02Å; L485-F501 HydrophobicContact CD1-CZ 3.38Å; L485-F501 HydrophobicContact CG-CZ 4.2Å; I493-F501 HydrophobicContact CD1-CD2 4.03Å; I493-F501 HydrophobicContact CD1-CE2 3.52Å; I493-F501 HydrophobicContact CD1-CZ 3.93Å; I493-F501 HydrophobicContact CG2-CD2 4.46Å; P499-F501 VanDerWaalsContact C-N 3.33Å; P499-F501 PolarHBondContact O-N 2.93Å; F501-Y503 VanDerWaalsContact C-N 3.31Å; F501-Y503 PolarHBondContact O-N 3.4Å; F501-L504 PolarHBondContact O-N 3.47Å; F501-I505 HydrophobicContact CB-CD1 4.38Å; F501-I505 HydrophobicContact CD1-CD1 3.67Å; F501-I505 HydrophobicContact CD1-CG1 4.33Å; F501-I505 HydrophobicContact CE1-CD1 4.38Å; F501-I505 HydrophobicContact CG-CD1 4.45Å; F501-I505 WeakPolarHBondContact O-CB 3.25Å; F501-I505 WeakPolarHBondContact O-CG1 3.35Å; F501-I505 PolarHBondContact O-N 3.12Å
502	K	71.5	Confident	71.7	Confident	46 Å²	46	35.1 Å²	35.1	20%	0.2	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-45.6	178.7	-169.5	178	-177.8	-171.2	0	110.1	P499 V500 D506 D586 S590	P499-K502 HydrophobicContact CB-CB 4.22Å; P499-K502 WeakPolarHBondContact O-CB 3.26Å; P499-K502 PolarHBondContact O-N 3.03Å; P499-K502 VanDerWaalsContact O-N 3.08Å; V500-K502 VanDerWaalsContact C-N 3.31Å; V500-K502 PolarHBondContact O-N 3.23Å; K502-D506 VanDerWaalsContact CG-OD2 3.23Å; K502-D506 WeakPolarHBondContact CG-OD2 3.25Å; K502-D506 WeakPolarHBondContact O-CB 3.11Å; K502-D506 PolarHBondContact O-N 3.34Å; K502-D506 VanDerWaalsContact O-N 3.17Å; K502-D586 WeakPolarHBondContact CD-OD1 3.05Å; K502-D586 WeakPolarHBondContact CE-OD1 3.21Å; K502-D586 IonicContact NZ-OD1 2.83Å; K502-D586 PolarHBondContact NZ-OD1 3.11Å; K502-D586 IonicContact NZ-OD2 2.63Å; K502-D586 PolarHBondContact NZ-OD2 3.42Å; K502-S590 PolarHBondContact NZ-OG 3.44Å; K502-S590 VanDerWaalsContact NZ-OG 3.16Å
503	Y	76.6	Confident	71	Confident	5 Å²	5	39.1 Å²	39.1	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-75	-22.7	179.3	-65.7	-69.8	0	0	0	114.2	I498 P499 V500 F501 P507 V516 L520 L582 D586 M589	I498-Y503 HydrophobicContact CG2-CD2 3.99Å; I498-Y503 HydrophobicContact CG2-CE2 3.82Å; P499-Y503 HydrophobicContact CG-CD2 4.18Å; P499-Y503 HydrophobicContact CG-CE2 3.62Å; P499-Y503 WeakPolarHBondContact O-CD2 3.06Å; P499-Y503 PolarHBondContact O-N 3.21Å; V500-Y503 PolarHBondContact O-N 3.25Å; F501-Y503 VanDerWaalsContact C-N 3.31Å; F501-Y503 PolarHBondContact O-N 3.4Å; Y503-P507 VanDerWaalsContact O-CD 3.27Å; Y503-P507 WeakPolarHBondContact O-CD 3.29Å; Y503-P507 WeakPolarHBondContact O-CG 3.26Å; Y503-V516 HydrophobicContact CD1-CG1 3.91Å; Y503-V516 HydrophobicContact CG-CG1 4.33Å; Y503-L520 HydrophobicContact CD2-CD1 4.32Å; Y503-L582 HydrophobicContact CD1-CD1 4.2Å; Y503-L582 HydrophobicContact CE1-CD1 3.85Å; Y503-L582 HydrophobicContact CE1-CD2 4.31Å; Y503-L582 HydrophobicContact CE1-CG 3.82Å; Y503-L582 HydrophobicContact CE2-CD2 3.85Å; Y503-L582 HydrophobicContact CE2-CG 4.25Å; Y503-D586 HydrophobicContact CE1-CB 4.14Å; Y503-D586 WeakPolarHBondContact OH-CB 3.38Å; Y503-M589 HydrophobicContact CD1-CE 3.46Å; Y503-M589 VanDerWaalsContact CD1-CE 3.46Å; Y503-M589 HydrophobicContact CE1-CE 3.69Å; Y503-M589 HydrophobicContact CG-CE 4.42Å
504	L	78.8	Confident	70.5	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-88.5	-33.6	179	-68.7	-175.9	0	0	0	114.1	L472 I475 V500 F501 Q508 V517 L520	L472-L504 HydrophobicContact CD2-CD1 4.06Å; L472-L504 HydrophobicContact CD2-CD2 4.46Å; I475-L504 HydrophobicContact CB-CD1 3.99Å; I475-L504 HydrophobicContact CG2-CD1 3.58Å; V500-L504 HydrophobicContact CG1-CD1 3.54Å; V500-L504 HydrophobicContact CG1-CG 4.04Å; V500-L504 WeakPolarHBondContact O-CG 3.47Å; V500-L504 PolarHBondContact O-N 3.45Å; F501-L504 PolarHBondContact O-N 3.47Å; L504-Q508 PolarHBondContact O-NE2 2.8Å; L504-V517 HydrophobicContact CD2-CG2 3.75Å; L504-L520 HydrophobicContact CD2-CD2 4.28Å; L504-L520 HydrophobicContact CG-CD2 4.46Å
505	I	73.7	Confident	70.5	Confident	48 Å²	48	42.7 Å²	42.7	25%	0.246	26%	0.259	C	S	.	.	H	α-helix	trans	-94.3	-40.6	-174.6	-61.5	177.4	0	0	0	111.3	A479 F501 Q508 M509	A479-I505 HydrophobicContact CB-CD1 4.19Å; A479-I505 HydrophobicContact CB-CG1 4.15Å; F501-I505 HydrophobicContact CB-CD1 4.38Å; F501-I505 HydrophobicContact CD1-CD1 3.67Å; F501-I505 HydrophobicContact CD1-CG1 4.33Å; F501-I505 HydrophobicContact CE1-CD1 4.38Å; F501-I505 HydrophobicContact CG-CD1 4.45Å; F501-I505 WeakPolarHBondContact O-CB 3.25Å; F501-I505 WeakPolarHBondContact O-CG1 3.35Å; F501-I505 PolarHBondContact O-N 3.12Å; I505-Q508 WeakPolarHBondContact O-CB 3.46Å; I505-Q508 PolarHBondContact O-N 2.91Å; I505-Q508 VanDerWaalsContact O-N 3.09Å; I505-M509 HydrophobicContact CG2-CE 3.96Å; I505-M509 HydrophobicContact CG2-CG 4.07Å; I505-M509 PolarHBondContact O-N 3.47Å; I505-M509 VanDerWaalsContact O-N 3.15Å
506	D	71.3	Confident	70.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-47.2	-172.9	-64.5	5.6	0	0	0	112.9	K502 Q508 M509 L510 M589 R593	K502-D506 VanDerWaalsContact CG-OD2 3.23Å; K502-D506 WeakPolarHBondContact CG-OD2 3.25Å; K502-D506 WeakPolarHBondContact O-CB 3.11Å; K502-D506 PolarHBondContact O-N 3.34Å; K502-D506 VanDerWaalsContact O-N 3.17Å; D506-Q508 PolarHBondContact O-N 3.28Å; D506-M509 PolarHBondContact O-N 2.92Å; D506-L510 VanDerWaalsContact O-CG 3.23Å; D506-L510 WeakPolarHBondContact O-CG 3.43Å; D506-L510 PolarHBondContact O-N 3.2Å; D506-L510 VanDerWaalsContact O-N 3.15Å; D506-M589 HydrophobicContact CB-CE 4.37Å; D506-M589 HydrophobicContact CB-SD 3.87Å; D506-R593 VanDerWaalsContact CG-NE 3.31Å; D506-R593 VanDerWaalsContact CG-NH2 3.3Å; D506-R593 IonicContact OD1-CZ 2.87Å; D506-R593 IonicContact OD1-NE 3.37Å; D506-R593 PolarHBondContact OD1-NE 2.84Å; D506-R593 IonicContact OD1-NH1 2.69Å; D506-R593 PolarHBondContact OD1-NH1 3Å; D506-R593 IonicContact OD1-NH2 2.73Å; D506-R593 PolarHBondContact OD1-NH2 3.06Å; D506-R593 IonicContact OD2-CZ 2.85Å; D506-R593 IonicContact OD2-NE 3.09Å; D506-R593 PolarHBondContact OD2-NE 3.4Å; D506-R593 VanDerWaalsContact OD2-NE 3.09Å; D506-R593 IonicContact OD2-NH1 2.77Å; D506-R593 PolarHBondContact OD2-NH1 3.44Å; D506-R593 IonicContact OD2-NH2 3.52Å; D506-R593 PolarHBondContact OD2-NH2 2.61Å
507	P	69.8	Low	70.7	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-58.8	-33	178.7	-24.8	36.2	0	0	0	112.6	Y503 L510 G511 V512 V516 M589	Y503-P507 VanDerWaalsContact O-CD 3.27Å; Y503-P507 WeakPolarHBondContact O-CD 3.29Å; Y503-P507 WeakPolarHBondContact O-CG 3.26Å; P507-L510 CarbonylContact O-C 3.56Å; P507-L510 PolarHBondContact O-N 2.97Å; P507-G511 PolarHBondContact O-N 2.96Å; P507-V512 HydrophobicContact CB-CB 4.28Å; P507-V512 PolarHBondContact O-N 3.39Å; P507-V516 HydrophobicContact CG-CG2 4.35Å; P507-M589 HydrophobicContact CG-SD 4.14Å
508	Q	67.8	Low	71.1	Confident	65 Å²	65	45.3 Å²	45.3	30%	0.304	26%	0.256	S	S	.	.	H	α-helix	trans	-71.6	-41	179.7	-59.6	-170.7	53.7	0	0	112.2	L504 I505 D506 L510 G511	L504-Q508 PolarHBondContact O-NE2 2.8Å; I505-Q508 WeakPolarHBondContact O-CB 3.46Å; I505-Q508 PolarHBondContact O-N 2.91Å; I505-Q508 VanDerWaalsContact O-N 3.09Å; D506-Q508 PolarHBondContact O-N 3.28Å; Q508-L510 PolarHBondContact O-N 2.96Å; Q508-G511 PolarHBondContact O-N 2.85Å; Q508-G511 VanDerWaalsContact O-N 3.16Å
509	M	66.8	Low	71.2	Confident	141 Å²	141	48.9 Å²	48.9	70%	0.695	27%	0.273	S	S	*	.	H	α-helix	trans	-62.6	-24.7	173.2	-63.2	-65.3	142.9	0	0	112.1	I505 D506	I505-M509 HydrophobicContact CG2-CE 3.96Å; I505-M509 HydrophobicContact CG2-CG 4.07Å; I505-M509 PolarHBondContact O-N 3.47Å; I505-M509 VanDerWaalsContact O-N 3.15Å; D506-M509 PolarHBondContact O-N 2.92Å
510	L	69.6	Low	71.5	Confident	40 Å²	40	47.4 Å²	47.4	21%	0.209	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-9.5	178.6	-60.2	177.7	0	0	0	113.9	D506 P507 Q508 V512 M592 L596	D506-L510 VanDerWaalsContact O-CG 3.23Å; D506-L510 WeakPolarHBondContact O-CG 3.43Å; D506-L510 PolarHBondContact O-N 3.2Å; D506-L510 VanDerWaalsContact O-N 3.15Å; P507-L510 CarbonylContact O-C 3.56Å; P507-L510 PolarHBondContact O-N 2.97Å; Q508-L510 PolarHBondContact O-N 2.96Å; L510-V512 VanDerWaalsContact C-N 3.32Å; L510-V512 HydrophobicContact CB-CG2 3.88Å; L510-M592 HydrophobicContact CD1-CB 4.09Å; L510-M592 HydrophobicContact CD1-CE 3.59Å; L510-M592 HydrophobicContact CD1-SD 4.03Å; L510-M592 HydrophobicContact CD2-CB 4.16Å; L510-L596 HydrophobicContact CD2-CD1 3.06Å; L510-L596 HydrophobicContact CD2-CG 4.34Å; L510-L596 HydrophobicContact CG-CD1 4.5Å
511	G	69.1	Low	71.8	Confident	72 Å²	72	47.5 Å²	47.5	74%	0.742	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	23.4	-173.4	0	0	0	0	0	114.7	P507 Q508	P507-G511 PolarHBondContact O-N 2.96Å; Q508-G511 PolarHBondContact O-N 2.85Å; Q508-G511 VanDerWaalsContact O-N 3.16Å
512	V	68.9	Low	72.3	Confident	71 Å²	71	49.5 Å²	49.5	43%	0.43	28%	0.275	S	S	.	.			trans	-92.8	145.1	179.7	-179	0	0	0	0	110.2	P507 L510	P507-V512 HydrophobicContact CB-CB 4.28Å; P507-V512 PolarHBondContact O-N 3.39Å; L510-V512 VanDerWaalsContact C-N 3.32Å; L510-V512 HydrophobicContact CB-CG2 3.88Å
513	S	63.1	Low	72.7	Confident	87 Å²	87	48.4 Å²	48.4	61%	0.608	27%	0.27	S	S	*	.			trans	-64.7	145.5	177.6	64.1	0	0	0	0	112.5	S515	S513-S515 PolarHBondContact O-N 3.14Å
514	N	65.1	Low	73	Confident	56 Å²	56	48.1 Å²	48.1	30%	0.299	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	28	-176	-76.5	-28.9	0	0	0	115.5	Q476 V516 V517	Q476-N514 VanDerWaalsContact CD-ND2 3.28Å; Q476-N514 PolarHBondContact NE2-ND2 3.14Å; Q476-N514 PolarHBondContact NE2-OD1 3.02Å; Q476-N514 VanDerWaalsContact NE2-OD1 3.12Å; Q476-N514 PolarHBondContact OE1-ND2 2.8Å; Q476-N514 VanDerWaalsContact OE1-ND2 3.08Å; N514-V516 PolarHBondContact O-N 3.2Å; N514-V516 VanDerWaalsContact O-N 3.1Å; N514-V517 HydrophobicContact CB-CG2 3.87Å; N514-V517 WeakPolarHBondContact O-CB 3.49Å; N514-V517 WeakPolarHBondContact O-CG2 3.44Å; N514-V517 PolarHBondContact O-N 2.89Å
515	S	68.1	Low	73.5	Confident	68 Å²	68	48.1 Å²	48.1	48%	0.476	27%	0.269	S	S	.	.	H	α-helix	trans	-55.4	-28.4	176.4	57.1	0	0	0	0	113.1	S513 V517 Y518	S513-S515 PolarHBondContact O-N 3.14Å; S515-V517 PolarHBondContact O-N 3.06Å; S515-Y518 PolarHBondContact O-N 3.01Å
516	V	68.8	Low	74.1	Confident	13 Å²	13	48.4 Å²	48.4	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-29.6	175.4	-175.3	0	0	0	0	112.5	Y503 P507 N514 Y518 Q519 L520 V585	Y503-V516 HydrophobicContact CD1-CG1 3.91Å; Y503-V516 HydrophobicContact CG-CG1 4.33Å; P507-V516 HydrophobicContact CG-CG2 4.35Å; N514-V516 PolarHBondContact O-N 3.2Å; N514-V516 VanDerWaalsContact O-N 3.1Å; V516-Y518 VanDerWaalsContact C-N 3.34Å; V516-Y518 PolarHBondContact O-N 3.33Å; V516-Q519 PolarHBondContact O-N 3.04Å; V516-L520 VanDerWaalsContact O-CB 3.31Å; V516-L520 WeakPolarHBondContact O-CB 3.19Å; V516-L520 PolarHBondContact O-N 3.43Å; V516-V585 HydrophobicContact CG2-CG1 4.46Å
517	V	71.2	Confident	74.4	Confident	10 Å²	10	49.8 Å²	49.8	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-41.5	-179.5	178.8	0	0	0	0	111.2	L472 L504 N514 S515 L520 T521	L472-V517 HydrophobicContact CB-CG1 4.22Å; L472-V517 HydrophobicContact CD1-CG1 4.24Å; L504-V517 HydrophobicContact CD2-CG2 3.75Å; N514-V517 HydrophobicContact CB-CG2 3.87Å; N514-V517 WeakPolarHBondContact O-CB 3.49Å; N514-V517 WeakPolarHBondContact O-CG2 3.44Å; N514-V517 PolarHBondContact O-N 2.89Å; S515-V517 PolarHBondContact O-N 3.06Å; V517-L520 WeakPolarHBondContact O-CB 3.47Å; V517-L520 PolarHBondContact O-N 3.11Å; V517-T521 PolarHBondContact O-N 3.41Å; V517-T521 PolarHBondContact O-OG1 3.36Å; V517-T521 VanDerWaalsContact O-OG1 3.05Å
518	Y	74.3	Confident	75	Confident	165 Å²	165	49.7 Å²	49.7	65%	0.647	27%	0.274	S	S	*	.	H	α-helix	trans	-67.5	-41.5	179.8	-68.2	-67.6	0	0	0	112.3	S515 V516 L520 T521 D522	S515-Y518 PolarHBondContact O-N 3.01Å; V516-Y518 VanDerWaalsContact C-N 3.34Å; V516-Y518 PolarHBondContact O-N 3.33Å; Y518-L520 VanDerWaalsContact C-N 3.33Å; Y518-T521 WeakPolarHBondContact O-CB 3.41Å; Y518-T521 PolarHBondContact O-N 3.41Å; Y518-D522 PolarHBondContact O-N 3.49Å; Y518-D522 VanDerWaalsContact O-N 3.13Å
519	Q	74.6	Confident	76	Confident	88 Å²	88	46.6 Å²	46.6	41%	0.411	26%	0.259	S	S	.	.	H	α-helix	trans	-62.1	-44.5	174.4	-67.3	-178.6	-22.5	0	0	110.6	V516 T521 D522 Y523	V516-Q519 PolarHBondContact O-N 3.04Å; Q519-T521 VanDerWaalsContact C-N 3.34Å; Q519-T521 PolarHBondContact O-N 3.13Å; Q519-D522 PolarHBondContact O-N 2.79Å; Q519-Y523 HydrophobicContact CB-CE2 4.06Å; Q519-Y523 WeakPolarHBondContact O-CD2 3.4Å; Q519-Y523 WeakPolarHBondContact O-CE2 3.41Å; Q519-Y523 PolarHBondContact O-N 3.27Å; Q519-Y523 VanDerWaalsContact O-N 3.12Å
520	L	78.4	Confident	76.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-42.4	176.5	-175.3	64.5	0	0	0	112.1	L472 I498 V500 Y503 L504 V516 V517 Y518 D522 Y523 I524	L472-L520 HydrophobicContact CD1-CB 4.46Å; L472-L520 HydrophobicContact CD1-CD2 4.1Å; L472-L520 HydrophobicContact CD1-CG 4.15Å; L472-L520 HydrophobicContact CD2-CD2 3.83Å; L472-L520 HydrophobicContact CD2-CG 4.5Å; I498-L520 HydrophobicContact CB-CD1 4.31Å; I498-L520 HydrophobicContact CD1-CD1 4.49Å; I498-L520 HydrophobicContact CG2-CD1 3.35Å; V500-L520 HydrophobicContact CG1-CD2 4.37Å; Y503-L520 HydrophobicContact CD2-CD1 4.32Å; L504-L520 HydrophobicContact CD2-CD2 4.28Å; L504-L520 HydrophobicContact CG-CD2 4.46Å; V516-L520 VanDerWaalsContact O-CB 3.31Å; V516-L520 WeakPolarHBondContact O-CB 3.19Å; V516-L520 PolarHBondContact O-N 3.43Å; V517-L520 WeakPolarHBondContact O-CB 3.47Å; V517-L520 PolarHBondContact O-N 3.11Å; Y518-L520 VanDerWaalsContact C-N 3.33Å; L520-D522 PolarHBondContact O-N 3.34Å; L520-Y523 PolarHBondContact O-N 2.84Å; L520-I524 HydrophobicContact CD1-CD1 3.77Å; L520-I524 HydrophobicContact CD1-CG1 4.1Å; L520-I524 HydrophobicContact CD2-CD1 4.29Å; L520-I524 HydrophobicContact CG-CD1 3.66Å; L520-I524 HydrophobicContact CG-CG1 4.33Å; L520-I524 VanDerWaalsContact O-CG1 3.32Å; L520-I524 WeakPolarHBondContact O-CG1 3.44Å; L520-I524 PolarHBondContact O-N 3.12Å
521	T	85.9	Confident	77.4	Confident	3 Å²	3	41 Å²	41	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-47.4	175.4	-66.8	0	0	0	0	111.7	K465 I468 T469 L472 V517 Y518 Q519 G525	K465-T521 HydrophobicContact CB-CG2 3.91Å; K465-T521 HydrophobicContact CG-CG2 4.09Å; K465-T521 WeakPolarHBondContact O-CG2 3.06Å; I468-T521 HydrophobicContact CB-CG2 4.18Å; I468-T521 HydrophobicContact CG2-CG2 3.96Å; T469-T521 WeakPolarHBondContact OG1-CG2 3.35Å; T469-T521 PolarHBondContact OG1-OG1 3.2Å; L472-T521 WeakPolarHBondContact CD1-OG1 3.08Å; V517-T521 PolarHBondContact O-N 3.41Å; V517-T521 PolarHBondContact O-OG1 3.36Å; V517-T521 VanDerWaalsContact O-OG1 3.05Å; Y518-T521 WeakPolarHBondContact O-CB 3.41Å; Y518-T521 PolarHBondContact O-N 3.41Å; Q519-T521 VanDerWaalsContact C-N 3.34Å; Q519-T521 PolarHBondContact O-N 3.13Å; T521-G525 PolarHBondContact O-N 2.97Å
522	D	85.3	Confident	78.2	Confident	55 Å²	55	37.7 Å²	37.7	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-44.4	-179.3	-73.6	-17.3	0	0	0	110.9	K465 Y518 Q519 L520 G525 Y526	K465-D522 WeakPolarHBondContact CD-OD1 3.45Å; K465-D522 WeakPolarHBondContact CE-OD1 3.36Å; K465-D522 IonicContact NZ-OD1 3.1Å; K465-D522 PolarHBondContact NZ-OD1 3.39Å; K465-D522 IonicContact NZ-OD2 3.41Å; Y518-D522 PolarHBondContact O-N 3.49Å; Y518-D522 VanDerWaalsContact O-N 3.13Å; Q519-D522 PolarHBondContact O-N 2.79Å; L520-D522 PolarHBondContact O-N 3.34Å; D522-G525 PolarHBondContact O-N 3.19Å; D522-Y526 HydrophobicContact CB-CE2 4.47Å; D522-Y526 WeakPolarHBondContact O-CD2 3.41Å; D522-Y526 PolarHBondContact O-N 3.33Å
523	Y	79.8	Confident	79.2	Confident	23 Å²	23	34.4 Å²	34.4	9%	0.09	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-50.1	179.5	-65.8	-48.4	0	0	0	113.8	Q519 L520 G525 Y526 D527 Q578 Q579 L582	Q519-Y523 HydrophobicContact CB-CE2 4.06Å; Q519-Y523 WeakPolarHBondContact O-CD2 3.4Å; Q519-Y523 WeakPolarHBondContact O-CE2 3.41Å; Q519-Y523 PolarHBondContact O-N 3.27Å; Q519-Y523 VanDerWaalsContact O-N 3.12Å; L520-Y523 PolarHBondContact O-N 2.84Å; Y523-G525 PolarHBondContact O-N 2.86Å; Y523-Y526 PolarHBondContact O-N 2.87Å; Y523-D527 PolarHBondContact O-N 2.86Å; Y523-D527 VanDerWaalsContact O-N 3.11Å; Y523-Q578 HydrophobicContact CD1-CB 4.44Å; Y523-Q578 HydrophobicContact CE1-CB 3.41Å; Y523-Q578 VanDerWaalsContact CE1-CB 3.41Å; Y523-Q578 PolarHBondContact OH-O 3.13Å; Y523-Q579 HydrophobicContact CD1-CG 4.43Å; Y523-L582 HydrophobicContact CD2-CB 4.36Å; Y523-L582 HydrophobicContact CD2-CD1 4.36Å; Y523-L582 HydrophobicContact CD2-CD2 3.97Å; Y523-L582 HydrophobicContact CD2-CG 4.46Å; Y523-L582 HydrophobicContact CE2-CB 3.97Å; Y523-L582 HydrophobicContact CE2-CD1 4.17Å; Y523-L582 HydrophobicContact CE2-CD2 4.39Å; Y523-L582 HydrophobicContact CE2-CG 4.39Å
524	I	82.7	Confident	80.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62	-36.6	176.7	-62.9	171.3	0	0	0	109.5	I468 L472 F492 T496 I498 V500 L520 D527 I528	I468-I524 HydrophobicContact CD1-CB 4.46Å; I468-I524 HydrophobicContact CD1-CG2 4.12Å; I468-I524 HydrophobicContact CG1-CG2 4.47Å; I468-I524 HydrophobicContact CG2-CB 4.35Å; I468-I524 HydrophobicContact CG2-CG2 4.4Å; L472-I524 HydrophobicContact CD1-CD1 4.48Å; L472-I524 HydrophobicContact CD2-CD1 4.23Å; F492-I524 HydrophobicContact CE1-CD1 4.25Å; F492-I524 HydrophobicContact CE2-CG2 3.67Å; F492-I524 HydrophobicContact CZ-CD1 3.74Å; F492-I524 HydrophobicContact CZ-CG2 3.72Å; T496-I524 HydrophobicContact CG2-CD1 4.48Å; I498-I524 HydrophobicContact CD1-CG1 3.73Å; V500-I524 HydrophobicContact CG2-CD1 3.94Å; L520-I524 HydrophobicContact CD1-CD1 3.77Å; L520-I524 HydrophobicContact CD1-CG1 4.1Å; L520-I524 HydrophobicContact CD2-CD1 4.29Å; L520-I524 HydrophobicContact CG-CD1 3.66Å; L520-I524 HydrophobicContact CG-CG1 4.33Å; L520-I524 VanDerWaalsContact O-CG1 3.32Å; L520-I524 WeakPolarHBondContact O-CG1 3.44Å; L520-I524 PolarHBondContact O-N 3.12Å; I524-D527 PolarHBondContact O-N 2.86Å; I524-I528 HydrophobicContact CG2-CD1 3.61Å; I524-I528 HydrophobicContact CG2-CG1 4.12Å; I524-I528 WeakPolarHBondContact O-CB 3.44Å; I524-I528 VanDerWaalsContact O-CG1 3.27Å; I524-I528 WeakPolarHBondContact O-CG1 3.28Å; I524-I528 PolarHBondContact O-N 2.91Å
525	G	88.8	Confident	81	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-45.8	177.1	0	0	0	0	0	112.8	T521 D522 Y523 I528 M529	T521-G525 PolarHBondContact O-N 2.97Å; D522-G525 PolarHBondContact O-N 3.19Å; Y523-G525 PolarHBondContact O-N 2.86Å; G525-I528 PolarHBondContact O-N 3.11Å; G525-M529 VanDerWaalsContact O-CB 3.22Å; G525-M529 WeakPolarHBondContact O-CB 3.42Å; G525-M529 PolarHBondContact O-N 2.84Å
526	Y	86.2	Confident	82	Confident	55 Å²	55	32.4 Å²	32.4	22%	0.216	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-42.1	176.7	-73.3	-57.9	0	0	0	112.5	M431 D522 Y523 M529 L530 F571 V575	M431-Y526 HydrophobicContact CE-CD1 4.01Å; M431-Y526 HydrophobicContact CE-CD2 4.36Å; M431-Y526 HydrophobicContact CE-CE1 4.07Å; M431-Y526 HydrophobicContact CE-CE2 4.43Å; M431-Y526 HydrophobicContact CE-CG 4.14Å; M431-Y526 HydrophobicContact CG-CE1 4.46Å; M431-Y526 HydrophobicContact SD-CD1 4.33Å; D522-Y526 HydrophobicContact CB-CE2 4.47Å; D522-Y526 WeakPolarHBondContact O-CD2 3.41Å; D522-Y526 PolarHBondContact O-N 3.33Å; Y523-Y526 PolarHBondContact O-N 2.87Å; Y526-M529 HydrophobicContact CD1-CE 3.72Å; Y526-M529 HydrophobicContact CE1-CE 4.23Å; Y526-M529 PolarHBondContact O-N 2.98Å; Y526-L530 WeakPolarHBondContact O-CB 3.29Å; Y526-L530 WeakPolarHBondContact O-CG 3.36Å; Y526-L530 PolarHBondContact O-N 3Å; Y526-F571 AromaticContact CD1-CE1 3.83Å; Y526-F571 HydrophobicContact CD1-CE1 3.83Å; Y526-F571 AromaticContact CD1-CZ 3.67Å; Y526-F571 HydrophobicContact CD1-CZ 3.67Å; Y526-F571 HydrophobicContact CE1-CE1 4.3Å; Y526-F571 AromaticContact CE1-CZ 3.66Å; Y526-F571 HydrophobicContact CE1-CZ 3.66Å; Y526-V575 HydrophobicContact CD1-CG2 4.14Å; Y526-V575 HydrophobicContact CD2-CG1 4.17Å; Y526-V575 HydrophobicContact CD2-CG2 4.16Å; Y526-V575 HydrophobicContact CG-CG1 4.14Å; Y526-V575 HydrophobicContact CG-CG2 3.84Å
527	D	78	Confident	82.9	Confident	30 Å²	30	32 Å²	32	16%	0.16	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-51.2	176	-177.8	35.3	0	0	0	111.1	Y523 I524 M529 L530 Q531	Y523-D527 PolarHBondContact O-N 2.86Å; Y523-D527 VanDerWaalsContact O-N 3.11Å; I524-D527 PolarHBondContact O-N 2.86Å; D527-M529 PolarHBondContact O-N 2.79Å; D527-L530 PolarHBondContact O-N 3.41Å; D527-Q531 VanDerWaalsContact CG-NE2 3.29Å; D527-Q531 WeakPolarHBondContact O-CG 3.35Å; D527-Q531 PolarHBondContact O-N 2.96Å; D527-Q531 PolarHBondContact OD1-NE2 3.27Å; D527-Q531 PolarHBondContact OD2-NE2 2.87Å
528	I	83.5	Confident	83.4	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-43.3	178.3	-70.5	-179.4	0	0	0	112.1	F190 F191 L194 L464 I468 F492 I524 G525 L530 Q531 Y532	F190-I528 HydrophobicContact CE1-CG2 4.19Å; F191-I528 HydrophobicContact CD2-CD1 4.28Å; F191-I528 HydrophobicContact CD2-CG2 4.18Å; F191-I528 HydrophobicContact CE2-CD1 3.82Å; L194-I528 HydrophobicContact CD1-CB 4.18Å; L194-I528 HydrophobicContact CD1-CD1 3.85Å; L194-I528 HydrophobicContact CD1-CG1 3.81Å; L194-I528 HydrophobicContact CD1-CG2 3.45Å; L194-I528 VanDerWaalsContact CD1-CG2 3.45Å; L464-I528 HydrophobicContact CD1-CG2 4.03Å; L464-I528 HydrophobicContact CD2-CG2 3.73Å; I468-I528 HydrophobicContact CD1-CD1 4.12Å; I468-I528 HydrophobicContact CG1-CD1 4.36Å; F492-I528 HydrophobicContact CE2-CD1 4.06Å; I524-I528 HydrophobicContact CG2-CD1 3.61Å; I524-I528 HydrophobicContact CG2-CG1 4.12Å; I524-I528 WeakPolarHBondContact O-CB 3.44Å; I524-I528 VanDerWaalsContact O-CG1 3.27Å; I524-I528 WeakPolarHBondContact O-CG1 3.28Å; I524-I528 PolarHBondContact O-N 2.91Å; G525-I528 PolarHBondContact O-N 3.11Å; I528-L530 VanDerWaalsContact C-N 3.35Å; I528-Q531 PolarHBondContact O-N 2.64Å; I528-Y532 WeakPolarHBondContact O-CB 3.48Å; I528-Y532 PolarHBondContact O-N 3.4Å
529	M	88.9	Confident	83.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.8	-44.1	177.7	179.4	179.2	71.4	0	0	111.3	L427 I430 M431 L464 G525 Y526 D527 Y532 I533 F571	L427-M529 HydrophobicContact CB-CE 4.28Å; L427-M529 HydrophobicContact CB-SD 4.08Å; L427-M529 HydrophobicContact CD1-CE 4.46Å; L427-M529 HydrophobicContact CD2-CE 3.87Å; L427-M529 HydrophobicContact CD2-SD 3.8Å; L427-M529 HydrophobicContact CG-CE 4.42Å; L427-M529 HydrophobicContact CG-SD 4.49Å; I430-M529 HydrophobicContact CB-CG 4.46Å; I430-M529 HydrophobicContact CB-SD 4.21Å; I430-M529 HydrophobicContact CG2-CB 4.34Å; I430-M529 HydrophobicContact CG2-CG 3.74Å; I430-M529 HydrophobicContact CG2-SD 4.05Å; M431-M529 HydrophobicContact CG-CE 4.33Å; M431-M529 HydrophobicContact CG-SD 3.6Å; M431-M529 HydrophobicContact SD-CB 4.13Å; M431-M529 HydrophobicContact SD-SD 4.05Å; L464-M529 HydrophobicContact CD1-CB 3.66Å; L464-M529 HydrophobicContact CD1-CG 4.44Å; G525-M529 VanDerWaalsContact O-CB 3.22Å; G525-M529 WeakPolarHBondContact O-CB 3.42Å; G525-M529 PolarHBondContact O-N 2.84Å; Y526-M529 HydrophobicContact CD1-CE 3.72Å; Y526-M529 HydrophobicContact CE1-CE 4.23Å; Y526-M529 PolarHBondContact O-N 2.98Å; D527-M529 PolarHBondContact O-N 2.79Å; M529-Y532 WeakPolarHBondContact O-CB 3.29Å; M529-Y532 PolarHBondContact O-N 3.45Å; M529-I533 HydrophobicContact CG-CD1 4.01Å; M529-I533 WeakPolarHBondContact O-CG1 3.35Å; M529-I533 PolarHBondContact O-N 3.12Å; M529-F571 HydrophobicContact CE-CE1 3.57Å; M529-F571 HydrophobicContact CE-CZ 3.75Å
530	L	84.2	Confident	84.3	Confident	9 Å²	9	25.2 Å²	25.2	5%	0.047	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-42.3	179.5	-72.1	169.1	0	0	0	111	Y526 D527 I528 Y532 I533 Q534 I568 F571 Q572	Y526-L530 WeakPolarHBondContact O-CB 3.29Å; Y526-L530 WeakPolarHBondContact O-CG 3.36Å; Y526-L530 PolarHBondContact O-N 3Å; D527-L530 PolarHBondContact O-N 3.41Å; I528-L530 VanDerWaalsContact C-N 3.35Å; L530-Y532 VanDerWaalsContact C-N 3.31Å; L530-Y532 PolarHBondContact O-N 2.88Å; L530-I533 PolarHBondContact O-N 3.04Å; L530-Q534 VanDerWaalsContact O-CB 3.27Å; L530-Q534 WeakPolarHBondContact O-CB 3.49Å; L530-Q534 WeakPolarHBondContact O-CG 3.49Å; L530-Q534 PolarHBondContact O-N 2.82Å; L530-I568 HydrophobicContact CD2-CG2 3.83Å; L530-F571 HydrophobicContact CD1-CD1 4.07Å; L530-F571 HydrophobicContact CD1-CE1 4.32Å; L530-F571 HydrophobicContact CD2-CD1 3.49Å; L530-F571 VanDerWaalsContact CD2-CD1 3.49Å; L530-F571 HydrophobicContact CD2-CE1 3.98Å; L530-F571 HydrophobicContact CG-CD1 4.13Å; L530-F571 HydrophobicContact CG-CE1 4.27Å; L530-Q572 HydrophobicContact CD1-CB 3.94Å; L530-Q572 HydrophobicContact CD1-CG 4.07Å
531	Q	81.6	Confident	84.6	Confident	53 Å²	53	28.7 Å²	28.7	25%	0.248	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-42.1	173.4	-68.8	176.1	37.2	0	0	111.6	F190 D527 I528 Q534 E535	F190-Q531 HydrophobicContact CZ-CB 4.05Å; D527-Q531 VanDerWaalsContact CG-NE2 3.29Å; D527-Q531 WeakPolarHBondContact O-CG 3.35Å; D527-Q531 PolarHBondContact O-N 2.96Å; D527-Q531 PolarHBondContact OD1-NE2 3.27Å; D527-Q531 PolarHBondContact OD2-NE2 2.87Å; I528-Q531 PolarHBondContact O-N 2.64Å; Q531-Q534 PolarHBondContact O-N 2.81Å; Q531-E535 WeakPolarHBondContact O-CB 3.42Å; Q531-E535 PolarHBondContact O-N 3.14Å
532	Y	85.7	Confident	84.4	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-51.2	176.7	178.7	-124.1	0	0	0	112.2	D186 M187 F190 F398 I528 M529 L530 Q534 E535 L536	D186-Y532 WeakPolarHBondContact OD2-CE2 3.02Å; D186-Y532 VanDerWaalsContact OD2-CZ 3.29Å; D186-Y532 PolarHBondContact OD2-OH 2.93Å; M187-Y532 HydrophobicContact CB-CE1 4.38Å; M187-Y532 HydrophobicContact CG-CE1 4.45Å; F190-Y532 HydrophobicContact CB-CD2 3.74Å; F190-Y532 HydrophobicContact CB-CE2 3.95Å; F190-Y532 AromaticContact CD1-CD2 3.67Å; F190-Y532 HydrophobicContact CD1-CD2 3.67Å; F190-Y532 HydrophobicContact CD1-CG 4.01Å; F190-Y532 AromaticContact CD2-CD2 3.82Å; F190-Y532 HydrophobicContact CD2-CD2 3.82Å; F190-Y532 HydrophobicContact CE1-CD2 4.21Å; F190-Y532 HydrophobicContact CE1-CG 4.29Å; F190-Y532 HydrophobicContact CE2-CD2 4.35Å; F190-Y532 AromaticContact CG-CD2 3.45Å; F190-Y532 HydrophobicContact CG-CD2 3.45Å; F190-Y532 VanDerWaalsContact CG-CD2 3.45Å; F190-Y532 HydrophobicContact CG-CE2 4.17Å; F190-Y532 HydrophobicContact CG-CG 4.26Å; F398-Y532 AromaticContact CE1-CE1 3.96Å; F398-Y532 HydrophobicContact CE1-CE1 3.96Å; I528-Y532 WeakPolarHBondContact O-CB 3.48Å; I528-Y532 PolarHBondContact O-N 3.4Å; M529-Y532 WeakPolarHBondContact O-CB 3.29Å; M529-Y532 PolarHBondContact O-N 3.45Å; L530-Y532 VanDerWaalsContact C-N 3.31Å; L530-Y532 PolarHBondContact O-N 2.88Å; Y532-Q534 PolarHBondContact O-N 2.76Å; Y532-E535 PolarHBondContact O-N 3.42Å; Y532-L536 HydrophobicContact CD1-CD1 4.48Å; Y532-L536 HydrophobicContact CE1-CD1 3.93Å; Y532-L536 HydrophobicContact CE2-CD1 4.09Å; Y532-L536 HydrophobicContact CE2-CD2 4.32Å; Y532-L536 HydrophobicContact CE2-CG 4.18Å; Y532-L536 WeakPolarHBondContact O-CG 3.47Å; Y532-L536 PolarHBondContact O-N 3.27Å; Y532-L536 VanDerWaalsContact O-N 3.12Å
533	I	89.7	Confident	84.2	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-64	-42.8	179.7	-64.4	172.4	0	0	0	110.4	L402 T421 L427 I430 M529 L530 E535 L536 L537 I568	L402-I533 HydrophobicContact CD1-CG2 4.24Å; L402-I533 HydrophobicContact CD2-CG2 4.44Å; T421-I533 HydrophobicContact CG2-CG2 3.77Å; L427-I533 HydrophobicContact CD2-CD1 3.54Å; I430-I533 HydrophobicContact CD1-CD1 4.43Å; M529-I533 HydrophobicContact CG-CD1 4.01Å; M529-I533 WeakPolarHBondContact O-CG1 3.35Å; M529-I533 PolarHBondContact O-N 3.12Å; L530-I533 PolarHBondContact O-N 3.04Å; I533-E535 VanDerWaalsContact C-N 3.33Å; I533-E535 PolarHBondContact O-N 3.21Å; I533-L536 PolarHBondContact O-N 3.24Å; I533-L537 HydrophobicContact CG2-CD1 4.33Å; I533-L537 HydrophobicContact CG2-CG 4.31Å; I533-L537 WeakPolarHBondContact O-CG 3.28Å; I533-L537 PolarHBondContact O-N 3.47Å; I533-I568 HydrophobicContact CB-CD1 4.35Å; I533-I568 HydrophobicContact CG2-CD1 3.49Å; I533-I568 VanDerWaalsContact CG2-CD1 3.49Å; I533-I568 HydrophobicContact CG2-CG1 4.28Å
534	Q	84.5	Confident	84.5	Confident	80 Å²	80	28.1 Å²	28.1	37%	0.374	14%	0.136	S	C	.	.	H	α-helix	trans	-59.9	-42.8	178	-76.6	173.2	-8.2	0	0	112.1	L530 Q531 Y532 L537 Q538 I568	L530-Q534 VanDerWaalsContact O-CB 3.27Å; L530-Q534 WeakPolarHBondContact O-CB 3.49Å; L530-Q534 WeakPolarHBondContact O-CG 3.49Å; L530-Q534 PolarHBondContact O-N 2.82Å; Q531-Q534 PolarHBondContact O-N 2.81Å; Y532-Q534 PolarHBondContact O-N 2.76Å; Q534-L537 PolarHBondContact O-N 2.7Å; Q534-Q538 VanDerWaalsContact O-CB 3.27Å; Q534-Q538 WeakPolarHBondContact O-CB 3.3Å; Q534-Q538 PolarHBondContact O-N 3.37Å; Q534-I568 HydrophobicContact CG-CD1 4.23Å; Q534-I568 HydrophobicContact CG-CG2 4.02Å
535	E	82.2	Confident	84.4	Confident	85 Å²	85	30.8 Å²	30.8	40%	0.397	16%	0.158	S	C	.	.	H	α-helix	trans	-61.3	-44.7	176.7	-177	64.2	-153	0	0	111.1	F190 Q531 Y532 I533 Q538 Q539	F190-E535 HydrophobicContact CE2-CB 4.36Å; F190-E535 HydrophobicContact CE2-CG 4.42Å; Q531-E535 WeakPolarHBondContact O-CB 3.42Å; Q531-E535 PolarHBondContact O-N 3.14Å; Y532-E535 PolarHBondContact O-N 3.42Å; I533-E535 VanDerWaalsContact C-N 3.33Å; I533-E535 PolarHBondContact O-N 3.21Å; E535-Q538 PolarHBondContact O-N 3.49Å; E535-Q539 VanDerWaalsContact O-CG 3.27Å; E535-Q539 WeakPolarHBondContact O-CG 3.46Å; E535-Q539 PolarHBondContact O-N 3.1Å; E535-Q539 PolarHBondContact OE1-NE2 2.94Å
536	L	87.6	Confident	83.9	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-45.6	175.3	-68.2	-176.3	0	0	0	112.7	L395 F398 I399 L402 Y532 I533 Q539 A540	L395-L536 HydrophobicContact CD1-CD1 4.37Å; L395-L536 HydrophobicContact CD1-CD2 4Å; F398-L536 HydrophobicContact CD1-CD1 3.81Å; F398-L536 HydrophobicContact CE1-CD1 3.63Å; I399-L536 HydrophobicContact CD1-CD2 4.08Å; I399-L536 HydrophobicContact CG1-CB 4.23Å; I399-L536 HydrophobicContact CG1-CD1 4.31Å; I399-L536 HydrophobicContact CG1-CD2 4.09Å; I399-L536 HydrophobicContact CG1-CG 4.44Å; L402-L536 HydrophobicContact CD1-CB 4.4Å; L402-L536 HydrophobicContact CD1-CD1 3.77Å; Y532-L536 HydrophobicContact CD1-CD1 4.48Å; Y532-L536 HydrophobicContact CE1-CD1 3.93Å; Y532-L536 HydrophobicContact CE2-CD1 4.09Å; Y532-L536 HydrophobicContact CE2-CD2 4.32Å; Y532-L536 HydrophobicContact CE2-CG 4.18Å; Y532-L536 WeakPolarHBondContact O-CG 3.47Å; Y532-L536 PolarHBondContact O-N 3.27Å; Y532-L536 VanDerWaalsContact O-N 3.12Å; I533-L536 PolarHBondContact O-N 3.24Å; L536-Q539 PolarHBondContact O-N 3.5Å; L536-A540 PolarHBondContact O-N 3.35Å
537	L	87.4	Confident	83.6	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-39.7	177.7	-68.6	-174.3	0	0	0	112	L402 T403 T421 I533 Q534 Q539 A540 R541 A564 Q565 I568	L402-L537 HydrophobicContact CB-CD2 4.1Å; T403-L537 HydrophobicContact CG2-CD2 3.45Å; T403-L537 VanDerWaalsContact CG2-CD2 3.45Å; T421-L537 HydrophobicContact CG2-CD1 4.11Å; I533-L537 HydrophobicContact CG2-CD1 4.33Å; I533-L537 HydrophobicContact CG2-CG 4.31Å; I533-L537 WeakPolarHBondContact O-CG 3.28Å; I533-L537 PolarHBondContact O-N 3.47Å; Q534-L537 PolarHBondContact O-N 2.7Å; L537-Q539 VanDerWaalsContact C-N 3.33Å; L537-A540 PolarHBondContact O-N 3.47Å; L537-R541 WeakPolarHBondContact O-CB 3.4Å; L537-R541 PolarHBondContact O-N 3.47Å; L537-A564 HydrophobicContact CD1-CB 3.83Å; L537-A564 HydrophobicContact CD2-CB 4.16Å; L537-Q565 HydrophobicContact CD1-CG 4.36Å; L537-I568 HydrophobicContact CD1-CD1 3.34Å; L537-I568 HydrophobicContact CG-CD1 4.44Å
538	Q	82.7	Confident	83.8	Confident	97 Å²	97	33.6 Å²	33.6	45%	0.453	18%	0.181	S	C	.	.	H	α-helix	trans	-65.1	-40	178.6	-175.7	58.8	44.6	0	0	111	Q534 E535 R541 A542	Q534-Q538 VanDerWaalsContact O-CB 3.27Å; Q534-Q538 WeakPolarHBondContact O-CB 3.3Å; Q534-Q538 PolarHBondContact O-N 3.37Å; E535-Q538 PolarHBondContact O-N 3.49Å; Q538-R541 PolarHBondContact O-N 2.96Å; Q538-A542 WeakPolarHBondContact O-CB 3.19Å; Q538-A542 PolarHBondContact O-N 3.33Å
539	Q	81.2	Confident	84	Confident	25 Å²	25	34.2 Å²	34.2	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-44.2	173.8	-70.3	171.9	29.5	0	0	111.6	M388 F389 E535 L536 L537 R541 A542 M543	M388-Q539 PolarHBondContact SD-OE1 3.01Å; F389-Q539 HydrophobicContact CZ-CB 4.06Å; F389-Q539 VanDerWaalsContact CZ-OE1 3.27Å; E535-Q539 VanDerWaalsContact O-CG 3.27Å; E535-Q539 WeakPolarHBondContact O-CG 3.46Å; E535-Q539 PolarHBondContact O-N 3.1Å; E535-Q539 PolarHBondContact OE1-NE2 2.94Å; L536-Q539 PolarHBondContact O-N 3.5Å; L537-Q539 VanDerWaalsContact C-N 3.33Å; Q539-R541 PolarHBondContact O-N 3.46Å; Q539-A542 PolarHBondContact O-N 2.91Å; Q539-M543 WeakPolarHBondContact O-CG 3.1Å; Q539-M543 PolarHBondContact O-N 3.22Å
540	A	86.4	Confident	84	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-47.6	175	0	0	0	0	0	111.7	L383 I399 T403 L536 L537 A542 M543 I544 L561	L383-A540 HydrophobicContact CD2-CB 4.37Å; I399-A540 HydrophobicContact CG2-CB 3.71Å; T403-A540 HydrophobicContact CG2-CB 3.81Å; L536-A540 PolarHBondContact O-N 3.35Å; L537-A540 PolarHBondContact O-N 3.47Å; A540-A542 VanDerWaalsContact C-N 3.33Å; A540-A542 PolarHBondContact O-N 2.84Å; A540-M543 PolarHBondContact O-N 3.44Å; A540-M543 VanDerWaalsContact O-N 3.14Å; A540-I544 VanDerWaalsContact O-CG1 3.3Å; A540-I544 WeakPolarHBondContact O-CG1 3.16Å; A540-I544 PolarHBondContact O-N 3.27Å; A540-L561 HydrophobicContact CB-CD2 4.41Å
541	R	85.6	Confident	84	Confident	73 Å²	73	40.9 Å²	40.9	28%	0.275	22%	0.215	S	C	.	.	H	α-helix	trans	-58.1	-43.9	176.7	-172.1	175.2	-172.9	135.6	5.8	112.1	L537 Q538 Q539 I544 A545 L561 N562	L537-R541 WeakPolarHBondContact O-CB 3.4Å; L537-R541 PolarHBondContact O-N 3.47Å; Q538-R541 PolarHBondContact O-N 2.96Å; Q539-R541 PolarHBondContact O-N 3.46Å; R541-I544 PolarHBondContact O-N 3.33Å; R541-A545 PolarHBondContact O-N 3.37Å; R541-A545 VanDerWaalsContact O-N 3.13Å; R541-L561 HydrophobicContact CB-CD1 3.96Å; R541-L561 HydrophobicContact CG-CD1 4.14Å; R541-N562 PolarHBondContact NH1-OD1 3.48Å; R541-N562 PolarHBondContact NH2-OD1 2.9Å
542	A	80.3	Confident	84.2	Confident	47 Å²	47	39.3 Å²	39.3	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-61.4	-44.8	176	0	0	0	0	0	111.3	Q538 Q539 A540 I544 A545 T546	Q538-A542 WeakPolarHBondContact O-CB 3.19Å; Q538-A542 PolarHBondContact O-N 3.33Å; Q539-A542 PolarHBondContact O-N 2.91Å; A540-A542 VanDerWaalsContact C-N 3.33Å; A540-A542 PolarHBondContact O-N 2.84Å; A542-I544 PolarHBondContact O-N 3.49Å; A542-A545 PolarHBondContact O-N 2.63Å; A542-T546 WeakPolarHBondContact O-CG2 3.28Å; A542-T546 PolarHBondContact O-N 3.35Å
543	M	81.5	Confident	84.4	Confident	21 Å²	21	39.1 Å²	39.1	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-38.8	-180	-68	-45.2	-58.2	0	0	113	A382 K385 N386 F389 Q539 A540 A545 T546	A382-M543 HydrophobicContact CB-CB 4.2Å; A382-M543 WeakPolarHBondContact O-CE 3.4Å; K385-M543 HydrophobicContact CB-CE 3.66Å; N386-M543 HydrophobicContact CB-CE 3.62Å; N386-M543 HydrophobicContact CB-CG 3.97Å; N386-M543 HydrophobicContact CB-SD 3.54Å; N386-M543 VanDerWaalsContact CB-SD 3.54Å; N386-M543 PolarHBondContact ND2-SD 2.61Å; N386-M543 VanDerWaalsContact ND2-SD 3.37Å; F389-M543 HydrophobicContact CE2-CG 4.39Å; Q539-M543 WeakPolarHBondContact O-CG 3.1Å; Q539-M543 PolarHBondContact O-N 3.22Å; A540-M543 PolarHBondContact O-N 3.44Å; A540-M543 VanDerWaalsContact O-N 3.14Å; M543-A545 VanDerWaalsContact C-N 3.34Å; M543-T546 PolarHBondContact O-N 3.3Å; M543-T546 PolarHBondContact O-OG1 2.69Å
544	I	85.5	Confident	84.3	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-41.1	177.1	-66.3	-130.8	0	0	0	111.5	I378 I379 A382 A540 R541 A542 T546 G547 M554 V557	I378-I544 HydrophobicContact CG2-CD1 4.14Å; I379-I544 HydrophobicContact CD1-CD1 3.21Å; I379-I544 HydrophobicContact CD1-CG1 4.05Å; I379-I544 HydrophobicContact CG1-CD1 3.71Å; A382-I544 HydrophobicContact CB-CD1 4.23Å; A382-I544 HydrophobicContact CB-CG1 3.73Å; A540-I544 VanDerWaalsContact O-CG1 3.3Å; A540-I544 WeakPolarHBondContact O-CG1 3.16Å; A540-I544 PolarHBondContact O-N 3.27Å; R541-I544 PolarHBondContact O-N 3.33Å; A542-I544 PolarHBondContact O-N 3.49Å; I544-T546 PolarHBondContact O-N 3.28Å; I544-T546 VanDerWaalsContact O-N 3.15Å; I544-G547 PolarHBondContact O-N 3.23Å; I544-M554 HydrophobicContact CG2-CE 3.86Å; I544-M554 HydrophobicContact CG2-SD 3.52Å; I544-M554 VanDerWaalsContact CG2-SD 3.52Å; I544-V557 HydrophobicContact CD1-CG1 3.22Å; I544-V557 HydrophobicContact CG1-CG1 4.46Å; I544-V557 HydrophobicContact CG2-CG1 4.16Å
545	A	81.3	Confident	84.5	Confident	55 Å²	55	40.2 Å²	40.2	46%	0.455	22%	0.219	S	C	.	.	H	α-helix	trans	-62.5	-19.8	176.7	0	0	0	0	0	113.4	R541 A542 M543 G547	R541-A545 PolarHBondContact O-N 3.37Å; R541-A545 VanDerWaalsContact O-N 3.13Å; A542-A545 PolarHBondContact O-N 2.63Å; M543-A545 VanDerWaalsContact C-N 3.34Å; A545-G547 VanDerWaalsContact C-N 3.31Å
546	T	78.5	Confident	84.7	Confident	59 Å²	59	37.9 Å²	37.9	36%	0.362	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.7	173.9	71	0	0	0	0	113.8	N132 A542 M543 I544	N132-T546 PolarHBondContact ND2-O 2.83Å; A542-T546 WeakPolarHBondContact O-CG2 3.28Å; A542-T546 PolarHBondContact O-N 3.35Å; M543-T546 PolarHBondContact O-N 3.3Å; M543-T546 PolarHBondContact O-OG1 2.69Å; I544-T546 PolarHBondContact O-N 3.28Å; I544-T546 VanDerWaalsContact O-N 3.15Å
547	G	78.8	Confident	84.7	Confident	9 Å²	9	37.8 Å²	37.8	9%	0.093	21%	0.209	C	C	.	.	S	Bend	trans	-93.8	147.4	-176.6	0	0	0	0	0	114.5	E370 I544 A545 Y549	E370-G547 WeakPolarHBondContact OE2-CA 3.46Å; I544-G547 PolarHBondContact O-N 3.23Å; A545-G547 VanDerWaalsContact C-N 3.31Å; G547-Y549 VanDerWaalsContact C-N 3.35Å; G547-Y549 PolarHBondContact O-N 3.48Å
548	N	83.8	Confident	84.6	Confident	77 Å²	77	39.9 Å²	39.9	41%	0.412	22%	0.22	S	C	.	.			trans	-91.3	66.6	178.3	-171.7	15.9	0	0	0	110.9	K367 E370 R371	K367-N548 PolarHBondContact O-ND2 3.1Å; E370-N548 CarbonylContact C-O 3.59Å; E370-N548 VanDerWaalsContact C-O 3.32Å; E370-N548 HydrophobicContact CB-CB 4.4Å; E370-N548 WeakPolarHBondContact CB-O 3.24Å; E370-N548 PolarHBondContact OE2-N 3.23Å; R371-N548 WeakPolarHBondContact CD-ND2 3.46Å; R371-N548 WeakPolarHBondContact CG-O 3.24Å; R371-N548 PolarHBondContact N-O 3.31Å
549	Y	87.7	Confident	84.7	Confident	14 Å²	14	40 Å²	40	6%	0.055	22%	0.22	C	C	.	.			trans	-91	150.1	179.2	-55.3	-72.8	0	0	0	111.2	E370 I378 G547 M554	E370-Y549 HydrophobicContact CB-CD1 4.36Å; E370-Y549 HydrophobicContact CB-CE1 4.23Å; E370-Y549 HydrophobicContact CG-CE1 4.44Å; I378-Y549 HydrophobicContact CD1-CD1 3.9Å; I378-Y549 HydrophobicContact CD1-CE1 3.94Å; I378-Y549 HydrophobicContact CG2-CD1 4.25Å; I378-Y549 HydrophobicContact CG2-CE1 4.03Å; I378-Y549 HydrophobicContact CG2-CE2 4.3Å; I378-Y549 HydrophobicContact CG2-CG 4.49Å; G547-Y549 VanDerWaalsContact C-N 3.35Å; G547-Y549 PolarHBondContact O-N 3.48Å; Y549-M554 HydrophobicContact CD2-CE 3.75Å; Y549-M554 HydrophobicContact CG-CE 4.5Å
550	P	87.1	Confident	84.8	Confident	15 Å²	15	39.9 Å²	39.9	10%	0.097	22%	0.22	C	C	.	.			trans	-56.2	142.3	170.8	-27.4	39.4	0	0	0	111.9	S326 L373 A552 V553 M554	S326-P550 WeakPolarHBondContact OG-CB 3.44Å; S326-P550 WeakPolarHBondContact OG-CG 3.35Å; L373-P550 HydrophobicContact CD1-CB 4.45Å; L373-P550 HydrophobicContact CD1-CG 3.84Å; L373-P550 HydrophobicContact CD2-CG 4.25Å; L373-P550 HydrophobicContact CG-CG 3.98Å; P550-A552 VanDerWaalsContact C-N 3.28Å; P550-A552 PolarHBondContact O-N 3.14Å; P550-V553 HydrophobicContact CB-CG2 4.41Å; P550-V553 WeakPolarHBondContact O-CA 3.37Å; P550-V553 WeakPolarHBondContact O-CB 3.45Å; P550-V553 PolarHBondContact O-N 3.4Å; P550-M554 PolarHBondContact O-N 3.18Å
551	Q	85.3	Confident	84.7	Confident	134 Å²	134	40 Å²	40	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-51.4	-45.3	-175.2	-171.4	66.3	30.4	0	0	112.7	V553 M554 D555	Q551-V553 VanDerWaalsContact C-N 3.26Å; Q551-V553 PolarHBondContact O-N 3.33Å; Q551-M554 WeakPolarHBondContact O-CB 3.43Å; Q551-M554 PolarHBondContact O-N 3.5Å; Q551-M554 VanDerWaalsContact O-N 3.12Å; Q551-D555 PolarHBondContact NE2-OD1 3.13Å; Q551-D555 PolarHBondContact O-N 2.73Å
552	A	86	Confident	84.6	Confident	21 Å²	21	39.3 Å²	39.3	17%	0.174	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-34.9	179.2	0	0	0	0	0	113.1	L319 Q322 P550 N556	L319-A552 HydrophobicContact CD2-CB 4.12Å; L319-A552 WeakPolarHBondContact CD2-O 3.46Å; Q322-A552 HydrophobicContact CB-CB 3.75Å; Q322-A552 HydrophobicContact CG-CB 4.28Å; P550-A552 VanDerWaalsContact C-N 3.28Å; P550-A552 PolarHBondContact O-N 3.14Å; A552-N556 PolarHBondContact O-N 2.82Å; A552-N556 PolarHBondContact O-ND2 3.28Å
553	V	89.4	Confident	84.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-73.1	-43.8	175.5	177.2	0	0	0	0	110.2	T323 L373 I378 L406 F408 P550 Q551 D555 N556 V557	T323-V553 HydrophobicContact CG2-CG2 4.25Å; L373-V553 HydrophobicContact CD1-CG2 3.46Å; L373-V553 VanDerWaalsContact CD1-CG2 3.46Å; L373-V553 HydrophobicContact CD2-CG2 3.94Å; L373-V553 HydrophobicContact CG-CG2 4.34Å; I378-V553 HydrophobicContact CD1-CG1 3.86Å; I378-V553 HydrophobicContact CG1-CG1 3.77Å; I378-V553 HydrophobicContact CG2-CG1 4.38Å; L406-V553 HydrophobicContact CD1-CG1 4.12Å; F408-V553 HydrophobicContact CE2-CG1 4.08Å; F408-V553 HydrophobicContact CE2-CG2 4.1Å; F408-V553 HydrophobicContact CZ-CG1 4.42Å; F408-V553 HydrophobicContact CZ-CG2 3.68Å; P550-V553 HydrophobicContact CB-CG2 4.41Å; P550-V553 WeakPolarHBondContact O-CA 3.37Å; P550-V553 WeakPolarHBondContact O-CB 3.45Å; P550-V553 PolarHBondContact O-N 3.4Å; Q551-V553 VanDerWaalsContact C-N 3.26Å; Q551-V553 PolarHBondContact O-N 3.33Å; V553-D555 PolarHBondContact O-N 2.86Å; V553-N556 PolarHBondContact O-N 3.47Å; V553-V557 HydrophobicContact CG1-CG2 4.31Å; V553-V557 WeakPolarHBondContact O-CB 3.42Å; V553-V557 VanDerWaalsContact O-CG2 3.25Å; V553-V557 WeakPolarHBondContact O-CG2 3.47Å; V553-V557 PolarHBondContact O-N 2.93Å
554	M	88.3	Confident	84.5	Confident	27 Å²	27	39.5 Å²	39.5	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-47.2	177	-174.8	59.9	71	0	0	111.6	I544 Y549 P550 Q551 N556 V557 L558	I544-M554 HydrophobicContact CG2-CE 3.86Å; I544-M554 HydrophobicContact CG2-SD 3.52Å; I544-M554 VanDerWaalsContact CG2-SD 3.52Å; Y549-M554 HydrophobicContact CD2-CE 3.75Å; Y549-M554 HydrophobicContact CG-CE 4.5Å; P550-M554 PolarHBondContact O-N 3.18Å; Q551-M554 WeakPolarHBondContact O-CB 3.43Å; Q551-M554 PolarHBondContact O-N 3.5Å; Q551-M554 VanDerWaalsContact O-N 3.12Å; M554-N556 PolarHBondContact O-N 3.2Å; M554-V557 PolarHBondContact O-N 2.95Å; M554-L558 HydrophobicContact CG-CD1 3.75Å; M554-L558 HydrophobicContact CG-CG 4.16Å; M554-L558 WeakPolarHBondContact O-CB 3.38Å; M554-L558 VanDerWaalsContact O-CG 3.25Å; M554-L558 WeakPolarHBondContact O-CG 3.34Å; M554-L558 PolarHBondContact O-N 2.75Å; M554-L558 HydrophobicContact SD-CD1 3.98Å; M554-L558 HydrophobicContact SD-CD2 4.36Å; M554-L558 HydrophobicContact SD-CG 3.9Å
555	D	87.2	Confident	84.3	Confident	78 Å²	78	42.8 Å²	42.8	42%	0.417	23%	0.231	S	C	.	.	H	α-helix	trans	-58.7	-46	-179.1	-66.3	-20.9	0	0	0	111.4	Q551 V553 L558 E559	Q551-D555 PolarHBondContact NE2-OD1 3.13Å; Q551-D555 PolarHBondContact O-N 2.73Å; V553-D555 PolarHBondContact O-N 2.86Å; D555-L558 PolarHBondContact O-N 3.33Å; D555-E559 VanDerWaalsContact O-CB 3.31Å; D555-E559 WeakPolarHBondContact O-CB 3.4Å; D555-E559 PolarHBondContact O-N 3.3Å
556	N	86.2	Confident	84.3	Confident	35 Å²	35	46.3 Å²	46.3	19%	0.187	24%	0.238	C	C	.	.	H	α-helix	trans	-68	-38.5	179.4	-79.9	-78.5	0	0	0	112.8	L315 L319 L406 A552 V553 M554 E559 N560	L315-N556 HydrophobicContact CD1-CB 4.27Å; L315-N556 WeakPolarHBondContact CD1-OD1 3.08Å; L319-N556 HydrophobicContact CD1-CB 4.49Å; L319-N556 WeakPolarHBondContact CD2-ND2 3.36Å; L406-N556 HydrophobicContact CD1-CB 4.04Å; A552-N556 PolarHBondContact O-N 2.82Å; A552-N556 PolarHBondContact O-ND2 3.28Å; V553-N556 PolarHBondContact O-N 3.47Å; M554-N556 PolarHBondContact O-N 3.2Å; N556-E559 PolarHBondContact O-N 2.97Å; N556-N560 PolarHBondContact O-N 3.11Å
557	V	88.6	Confident	84.3	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.23	C	C	.	.	H	α-helix	trans	-72.5	-38.7	179.2	174.9	0	0	0	0	111.3	I378 I379 L406 I544 V553 M554 E559 N560 L561	I378-V557 HydrophobicContact CB-CG2 4.42Å; I378-V557 HydrophobicContact CG2-CG2 4.02Å; I379-V557 HydrophobicContact CD1-CG1 4.02Å; I379-V557 HydrophobicContact CG1-CG1 4.29Å; L406-V557 HydrophobicContact CD1-CG2 3.83Å; L406-V557 HydrophobicContact CG-CG2 4.11Å; I544-V557 HydrophobicContact CD1-CG1 3.22Å; I544-V557 HydrophobicContact CG1-CG1 4.46Å; I544-V557 HydrophobicContact CG2-CG1 4.16Å; V553-V557 HydrophobicContact CG1-CG2 4.31Å; V553-V557 WeakPolarHBondContact O-CB 3.42Å; V553-V557 VanDerWaalsContact O-CG2 3.25Å; V553-V557 WeakPolarHBondContact O-CG2 3.47Å; V553-V557 PolarHBondContact O-N 2.93Å; M554-V557 PolarHBondContact O-N 2.95Å; V557-E559 VanDerWaalsContact C-N 3.3Å; V557-N560 PolarHBondContact O-N 2.96Å; V557-L561 WeakPolarHBondContact O-CG 3.44Å; V557-L561 PolarHBondContact O-N 3.35Å; V557-L561 VanDerWaalsContact O-N 3.07Å
558	L	85.2	Confident	84.4	Confident	47 Å²	47	45.3 Å²	45.3	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-35.3	171.3	-70.9	177.7	0	0	0	111.7	M554 D555 L561 N562	M554-L558 HydrophobicContact CG-CD1 3.75Å; M554-L558 HydrophobicContact CG-CG 4.16Å; M554-L558 WeakPolarHBondContact O-CB 3.38Å; M554-L558 VanDerWaalsContact O-CG 3.25Å; M554-L558 WeakPolarHBondContact O-CG 3.34Å; M554-L558 PolarHBondContact O-N 2.75Å; M554-L558 HydrophobicContact SD-CD1 3.98Å; M554-L558 HydrophobicContact SD-CD2 4.36Å; M554-L558 HydrophobicContact SD-CG 3.9Å; D555-L558 PolarHBondContact O-N 3.33Å; L558-L561 HydrophobicContact CD2-CD1 4.33Å; L558-L561 PolarHBondContact O-N 3.36Å; L558-N562 WeakPolarHBondContact O-CB 3.42Å; L558-N562 PolarHBondContact O-N 3.24Å; L558-N562 PolarHBondContact O-ND2 3.38Å; L558-N562 VanDerWaalsContact O-ND2 3.16Å
559	E	84	Confident	84.1	Confident	101 Å²	101	44.2 Å²	44.2	47%	0.472	23%	0.228	S	C	.	.	H	α-helix	trans	-62.4	-47.3	173.1	-176.3	166.8	-169.4	0	0	111.6	D555 N556 V557 L561 N562 Q563	D555-E559 VanDerWaalsContact O-CB 3.31Å; D555-E559 WeakPolarHBondContact O-CB 3.4Å; D555-E559 PolarHBondContact O-N 3.3Å; N556-E559 PolarHBondContact O-N 2.97Å; V557-E559 VanDerWaalsContact C-N 3.3Å; E559-L561 VanDerWaalsContact C-N 3.29Å; E559-L561 PolarHBondContact O-N 3.47Å; E559-N562 PolarHBondContact O-N 3.46Å; E559-N562 VanDerWaalsContact O-N 3.13Å; E559-Q563 HydrophobicContact CG-CG 4.46Å; E559-Q563 WeakPolarHBondContact O-CB 3.44Å; E559-Q563 WeakPolarHBondContact O-CG 3.5Å; E559-Q563 PolarHBondContact O-N 3.19Å
560	N	83.9	Confident	83.6	Confident	21 Å²	21	47.5 Å²	47.5	11%	0.112	25%	0.25	C	C	.	.	H	α-helix	trans	-56.6	-42.6	173.3	-78.2	-12.6	0	0	0	112.4	N556 V557 Q563 A564	N556-N560 PolarHBondContact O-N 3.11Å; V557-N560 PolarHBondContact O-N 2.96Å; N560-Q563 PolarHBondContact O-N 2.81Å; N560-A564 WeakPolarHBondContact O-CB 2.91Å; N560-A564 PolarHBondContact O-N 2.01Å
561	L	84.8	Confident	83.1	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-40	176.4	-71.7	170.4	0	0	0	112.3	T403 A540 R541 V557 L558 E559 A564 Q565	T403-L561 HydrophobicContact CG2-CD2 3.48Å; T403-L561 VanDerWaalsContact CG2-CD2 3.48Å; A540-L561 HydrophobicContact CB-CD2 4.41Å; R541-L561 HydrophobicContact CB-CD1 3.96Å; R541-L561 HydrophobicContact CG-CD1 4.14Å; V557-L561 WeakPolarHBondContact O-CG 3.44Å; V557-L561 PolarHBondContact O-N 3.35Å; V557-L561 VanDerWaalsContact O-N 3.07Å; L558-L561 HydrophobicContact CD2-CD1 4.33Å; L558-L561 PolarHBondContact O-N 3.36Å; E559-L561 VanDerWaalsContact C-N 3.29Å; E559-L561 PolarHBondContact O-N 3.47Å; L561-A564 WeakPolarHBondContact O-CB 3.45Å; L561-A564 PolarHBondContact O-N 2.89Å; L561-Q565 WeakPolarHBondContact O-CG 3.38Å; L561-Q565 PolarHBondContact O-N 2.68Å
562	N	82.7	Confident	82.6	Confident	60 Å²	60	45.4 Å²	45.4	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-67.3	-39.3	176	-69.4	-29	0	0	0	111	R541 L558 E559 Q565 Q566	R541-N562 PolarHBondContact NH1-OD1 3.48Å; R541-N562 PolarHBondContact NH2-OD1 2.9Å; L558-N562 WeakPolarHBondContact O-CB 3.42Å; L558-N562 PolarHBondContact O-N 3.24Å; L558-N562 PolarHBondContact O-ND2 3.38Å; L558-N562 VanDerWaalsContact O-ND2 3.16Å; E559-N562 PolarHBondContact O-N 3.46Å; E559-N562 VanDerWaalsContact O-N 3.13Å; N562-Q565 PolarHBondContact O-N 2.85Å; N562-Q566 VanDerWaalsContact O-CG 3.3Å; N562-Q566 WeakPolarHBondContact O-CG 3.37Å; N562-Q566 PolarHBondContact O-N 3.39Å
563	Q	80	Confident	81.9	Confident	71 Å²	71	47 Å²	47	33%	0.332	25%	0.248	S	C	.	.	H	α-helix	trans	-62.6	-44.7	173.7	-72.5	177.4	6.9	0	0	111	E559 N560 Q565 Q566 Q567	E559-Q563 HydrophobicContact CG-CG 4.46Å; E559-Q563 WeakPolarHBondContact O-CB 3.44Å; E559-Q563 WeakPolarHBondContact O-CG 3.5Å; E559-Q563 PolarHBondContact O-N 3.19Å; N560-Q563 PolarHBondContact O-N 2.81Å; Q563-Q565 VanDerWaalsContact C-N 3.31Å; Q563-Q565 PolarHBondContact O-N 2.86Å; Q563-Q566 PolarHBondContact O-N 3.5Å; Q563-Q566 VanDerWaalsContact O-N 3.17Å; Q563-Q567 VanDerWaalsContact O-CG 3.32Å; Q563-Q567 WeakPolarHBondContact O-CG 3.49Å; Q563-Q567 PolarHBondContact O-N 3.47Å
564	A	81.2	Confident	81.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56.6	-44.9	173.4	0	0	0	0	0	111.8	A419 T421 L537 N560 L561 Q567 I568	A419-A564 HydrophobicContact CB-CB 4.42Å; T421-A564 HydrophobicContact CG2-CB 4.14Å; T421-A564 WeakPolarHBondContact OG1-CA 3.33Å; T421-A564 WeakPolarHBondContact OG1-CB 3.41Å; L537-A564 HydrophobicContact CD1-CB 3.83Å; L537-A564 HydrophobicContact CD2-CB 4.16Å; N560-A564 WeakPolarHBondContact O-CB 2.91Å; N560-A564 PolarHBondContact O-N 2.01Å; L561-A564 WeakPolarHBondContact O-CB 3.45Å; L561-A564 PolarHBondContact O-N 2.89Å; A564-Q567 PolarHBondContact O-N 3.35Å; A564-I568 WeakPolarHBondContact O-CG1 3.28Å; A564-I568 PolarHBondContact O-N 3Å
565	Q	81.3	Confident	80.3	Confident	71 Å²	71	51.6 Å²	51.6	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-39.7	175.4	-73.5	-179.8	-24.6	0	0	112.8	L537 L561 N562 Q563 I568 A569	L537-Q565 HydrophobicContact CD1-CG 4.36Å; L561-Q565 WeakPolarHBondContact O-CG 3.38Å; L561-Q565 PolarHBondContact O-N 2.68Å; N562-Q565 PolarHBondContact O-N 2.85Å; Q563-Q565 VanDerWaalsContact C-N 3.31Å; Q563-Q565 PolarHBondContact O-N 2.86Å; Q565-I568 WeakPolarHBondContact O-CB 3.24Å; Q565-I568 PolarHBondContact O-N 2.88Å; Q565-A569 PolarHBondContact O-N 2.99Å
566	Q	79.7	Confident	79.2	Confident	128 Å²	128	52.4 Å²	52.4	60%	0.598	27%	0.271	S	S	*	.	H	α-helix	trans	-64.9	-42.4	175.4	-74.8	172.9	-9.8	0	0	111.7	N562 Q563 I568 A569 V570	N562-Q566 VanDerWaalsContact O-CG 3.3Å; N562-Q566 WeakPolarHBondContact O-CG 3.37Å; N562-Q566 PolarHBondContact O-N 3.39Å; Q563-Q566 PolarHBondContact O-N 3.5Å; Q563-Q566 VanDerWaalsContact O-N 3.17Å; Q566-I568 VanDerWaalsContact C-N 3.3Å; Q566-I568 PolarHBondContact O-N 2.93Å; Q566-A569 PolarHBondContact O-N 2.79Å; Q566-A569 VanDerWaalsContact O-N 3.15Å; Q566-V570 WeakPolarHBondContact O-CG2 3.38Å; Q566-V570 PolarHBondContact O-N 3.45Å
567	Q	80.1	Confident	78	Confident	43 Å²	43	54 Å²	54	20%	0.201	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-41.6	175.5	-71.4	178.8	13.8	0	0	111.2	T422 Q563 A564 V570 F571	T422-Q567 HydrophobicContact CG2-CB 3.63Å; T422-Q567 PolarHBondContact OG1-OE1 3.07Å; Q563-Q567 VanDerWaalsContact O-CG 3.32Å; Q563-Q567 WeakPolarHBondContact O-CG 3.49Å; Q563-Q567 PolarHBondContact O-N 3.47Å; A564-Q567 PolarHBondContact O-N 3.35Å; Q567-V570 PolarHBondContact O-N 2.84Å; Q567-F571 WeakPolarHBondContact O-CB 3.42Å; Q567-F571 PolarHBondContact O-N 3.47Å
568	I	79.9	Confident	76.8	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-44.9	173	-71.8	172.2	0	0	0	111.5	T421 L530 I533 Q534 L537 A564 Q565 Q566 V570 F571 Q572	T421-I568 HydrophobicContact CG2-CD1 3.75Å; T421-I568 HydrophobicContact CG2-CG1 3.73Å; L530-I568 HydrophobicContact CD2-CG2 3.83Å; I533-I568 HydrophobicContact CB-CD1 4.35Å; I533-I568 HydrophobicContact CG2-CD1 3.49Å; I533-I568 VanDerWaalsContact CG2-CD1 3.49Å; I533-I568 HydrophobicContact CG2-CG1 4.28Å; Q534-I568 HydrophobicContact CG-CD1 4.23Å; Q534-I568 HydrophobicContact CG-CG2 4.02Å; L537-I568 HydrophobicContact CD1-CD1 3.34Å; L537-I568 HydrophobicContact CG-CD1 4.44Å; A564-I568 WeakPolarHBondContact O-CG1 3.28Å; A564-I568 PolarHBondContact O-N 3Å; Q565-I568 WeakPolarHBondContact O-CB 3.24Å; Q565-I568 PolarHBondContact O-N 2.88Å; Q566-I568 VanDerWaalsContact C-N 3.3Å; Q566-I568 PolarHBondContact O-N 2.93Å; I568-V570 PolarHBondContact O-N 3.08Å; I568-F571 PolarHBondContact O-N 2.96Å; I568-Q572 VanDerWaalsContact O-CB 3.29Å; I568-Q572 WeakPolarHBondContact O-CB 3.42Å; I568-Q572 PolarHBondContact O-N 2.77Å
569	A	77.6	Confident	75.6	Confident	54 Å²	54	58.6 Å²	58.6	45%	0.446	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-41.7	179.7	0	0	0	0	0	111.9	Q565 Q566 Q572 S573	Q565-A569 PolarHBondContact O-N 2.99Å; Q566-A569 PolarHBondContact O-N 2.79Å; Q566-A569 VanDerWaalsContact O-N 3.15Å; A569-Q572 PolarHBondContact O-N 3.28Å; A569-S573 PolarHBondContact O-N 2.88Å
570	V	77.8	Confident	74.6	Confident	82 Å²	82	58.6 Å²	58.6	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-47.5	173.7	172.9	0	0	0	0	110.3	Q566 Q567 I568 Q572 S573 Q574	Q566-V570 WeakPolarHBondContact O-CG2 3.38Å; Q566-V570 PolarHBondContact O-N 3.45Å; Q567-V570 PolarHBondContact O-N 2.84Å; I568-V570 PolarHBondContact O-N 3.08Å; V570-Q572 VanDerWaalsContact C-N 3.33Å; V570-Q572 PolarHBondContact O-N 3.02Å; V570-S573 PolarHBondContact O-N 2.79Å; V570-S573 PolarHBondContact O-OG 3.37Å; V570-Q574 WeakPolarHBondContact O-CG 3.32Å; V570-Q574 PolarHBondContact O-N 2.88Å; V570-Q574 VanDerWaalsContact O-N 3.16Å
571	F	77	Confident	73.7	Confident	33 Å²	33	60.1 Å²	60.1	15%	0.145	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-42.1	177.3	-177.1	-93.5	0	0	0	112	T422 L427 Y526 M529 L530 Q567 I568 S573 Q574 V575	T422-F571 HydrophobicContact CG2-CB 4.18Å; L427-F571 HydrophobicContact CD1-CD2 4.05Å; L427-F571 HydrophobicContact CD1-CE2 3.67Å; L427-F571 HydrophobicContact CD1-CZ 3.93Å; Y526-F571 AromaticContact CD1-CE1 3.83Å; Y526-F571 HydrophobicContact CD1-CE1 3.83Å; Y526-F571 AromaticContact CD1-CZ 3.67Å; Y526-F571 HydrophobicContact CD1-CZ 3.67Å; Y526-F571 HydrophobicContact CE1-CE1 4.3Å; Y526-F571 AromaticContact CE1-CZ 3.66Å; Y526-F571 HydrophobicContact CE1-CZ 3.66Å; M529-F571 HydrophobicContact CE-CE1 3.57Å; M529-F571 HydrophobicContact CE-CZ 3.75Å; L530-F571 HydrophobicContact CD1-CD1 4.07Å; L530-F571 HydrophobicContact CD1-CE1 4.32Å; L530-F571 HydrophobicContact CD2-CD1 3.49Å; L530-F571 VanDerWaalsContact CD2-CD1 3.49Å; L530-F571 HydrophobicContact CD2-CE1 3.98Å; L530-F571 HydrophobicContact CG-CD1 4.13Å; L530-F571 HydrophobicContact CG-CE1 4.27Å; Q567-F571 WeakPolarHBondContact O-CB 3.42Å; Q567-F571 PolarHBondContact O-N 3.47Å; I568-F571 PolarHBondContact O-N 2.96Å; F571-S573 VanDerWaalsContact C-N 3.34Å; F571-S573 PolarHBondContact O-N 3.34Å; F571-Q574 WeakPolarHBondContact O-CB 3.47Å; F571-Q574 PolarHBondContact O-N 2.67Å; F571-Q574 VanDerWaalsContact O-N 3.15Å; F571-V575 HydrophobicContact CD1-CG2 4.14Å; F571-V575 HydrophobicContact CE1-CG2 3.76Å; F571-V575 HydrophobicContact CZ-CG2 4.15Å; F571-V575 WeakPolarHBondContact O-CG2 3.15Å; F571-V575 PolarHBondContact O-N 2.84Å
572	Q	73.1	Confident	72.8	Confident	72 Å²	72	60.4 Å²	60.4	34%	0.336	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-41.3	176	-173.6	175.4	4.2	0	0	111.7	L530 I568 A569 V570 Q574 V575 Q576	L530-Q572 HydrophobicContact CD1-CB 3.94Å; L530-Q572 HydrophobicContact CD1-CG 4.07Å; I568-Q572 VanDerWaalsContact O-CB 3.29Å; I568-Q572 WeakPolarHBondContact O-CB 3.42Å; I568-Q572 PolarHBondContact O-N 2.77Å; A569-Q572 PolarHBondContact O-N 3.28Å; V570-Q572 VanDerWaalsContact C-N 3.33Å; V570-Q572 PolarHBondContact O-N 3.02Å; Q572-Q574 VanDerWaalsContact C-N 3.29Å; Q572-Q574 PolarHBondContact O-N 3.2Å; Q572-V575 PolarHBondContact O-N 3.22Å; Q572-Q576 WeakPolarHBondContact O-CG 3.02Å; Q572-Q576 PolarHBondContact O-N 3.41Å
573	S	72.9	Confident	71.9	Confident	55 Å²	55	62 Å²	62	39%	0.385	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-36.5	175.5	76.4	0	0	0	0	112.4	A569 V570 F571 Q576 V577	A569-S573 PolarHBondContact O-N 2.88Å; V570-S573 PolarHBondContact O-N 2.79Å; V570-S573 PolarHBondContact O-OG 3.37Å; F571-S573 VanDerWaalsContact C-N 3.34Å; F571-S573 PolarHBondContact O-N 3.34Å; S573-Q576 PolarHBondContact O-N 3.2Å; S573-V577 WeakPolarHBondContact O-CG2 3.01Å; S573-V577 PolarHBondContact O-N 3.18Å
574	Q	71.7	Confident	71.4	Confident	115 Å²	115	62.4 Å²	62.4	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-67.6	-38.3	175.9	-66.5	173.3	4.7	0	0	111.7	V570 F571 Q572	V570-Q574 WeakPolarHBondContact O-CG 3.32Å; V570-Q574 PolarHBondContact O-N 2.88Å; V570-Q574 VanDerWaalsContact O-N 3.16Å; F571-Q574 WeakPolarHBondContact O-CB 3.47Å; F571-Q574 PolarHBondContact O-N 2.67Å; F571-Q574 VanDerWaalsContact O-N 3.15Å; Q572-Q574 VanDerWaalsContact C-N 3.29Å; Q572-Q574 PolarHBondContact O-N 3.2Å
575	V	71.4	Confident	70.7	Confident	8 Å²	8	64 Å²	64	5%	0.048	35%	0.347	C	S	.	.	H	α-helix	trans	-68.6	-39.1	174.7	174.8	0	0	0	0	111.2	Y526 F571 Q572 V577 Q578 Q579	Y526-V575 HydrophobicContact CD1-CG2 4.14Å; Y526-V575 HydrophobicContact CD2-CG1 4.17Å; Y526-V575 HydrophobicContact CD2-CG2 4.16Å; Y526-V575 HydrophobicContact CG-CG1 4.14Å; Y526-V575 HydrophobicContact CG-CG2 3.84Å; F571-V575 HydrophobicContact CD1-CG2 4.14Å; F571-V575 HydrophobicContact CE1-CG2 3.76Å; F571-V575 HydrophobicContact CZ-CG2 4.15Å; F571-V575 WeakPolarHBondContact O-CG2 3.15Å; F571-V575 PolarHBondContact O-N 2.84Å; Q572-V575 PolarHBondContact O-N 3.22Å; V575-V577 VanDerWaalsContact C-N 3.34Å; V575-V577 PolarHBondContact O-N 2.93Å; V575-Q578 WeakPolarHBondContact O-CA 3.25Å; V575-Q578 WeakPolarHBondContact O-CB 3.42Å; V575-Q578 PolarHBondContact O-N 2.93Å; V575-Q579 PolarHBondContact O-N 3.5Å; V575-Q579 VanDerWaalsContact O-N 3.1Å
576	Q	63.7	Low	69.9	Low	96 Å²	96	62 Å²	62	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-40.2	176.8	-79.8	177.9	-21.1	0	0	112.7	Q572 S573 Q578 Q579 D580	Q572-Q576 WeakPolarHBondContact O-CG 3.02Å; Q572-Q576 PolarHBondContact O-N 3.41Å; S573-Q576 PolarHBondContact O-N 3.2Å; Q576-Q578 PolarHBondContact O-N 3.47Å; Q576-Q579 WeakPolarHBondContact O-CA 3Å; Q576-Q579 VanDerWaalsContact O-CB 3.29Å; Q576-Q579 WeakPolarHBondContact O-CB 3.44Å; Q576-Q579 PolarHBondContact O-N 3.48Å; Q576-D580 PolarHBondContact O-N 3.42Å; Q576-D580 VanDerWaalsContact O-N 3.15Å
577	V	61.8	Low	69.4	Low	69 Å²	69	65.2 Å²	65.2	42%	0.418	35%	0.345	S	S	.	.	H	α-helix	trans	-58.3	-30.8	174.2	171.1	0	0	0	0	111.7	F252 S573 V575	F252-V577 HydrophobicContact CD1-CG1 4.41Å; F252-V577 HydrophobicContact CE1-CG1 3.45Å; F252-V577 VanDerWaalsContact CE1-CG1 3.45Å; F252-V577 HydrophobicContact CZ-CG1 4.12Å; S573-V577 WeakPolarHBondContact O-CG2 3.01Å; S573-V577 PolarHBondContact O-N 3.18Å; V575-V577 VanDerWaalsContact C-N 3.34Å; V575-V577 PolarHBondContact O-N 2.93Å
578	Q	62.9	Low	68.9	Low	87 Å²	87	68.8 Å²	68.8	41%	0.407	36%	0.362	S	S	.	.	H	α-helix	trans	-78	-29.4	173.3	-55.1	-179.1	-15.3	0	0	112.5	Y523 V575 Q576 D580 A581 L582	Y523-Q578 HydrophobicContact CD1-CB 4.44Å; Y523-Q578 HydrophobicContact CE1-CB 3.41Å; Y523-Q578 VanDerWaalsContact CE1-CB 3.41Å; Y523-Q578 PolarHBondContact OH-O 3.13Å; V575-Q578 WeakPolarHBondContact O-CA 3.25Å; V575-Q578 WeakPolarHBondContact O-CB 3.42Å; V575-Q578 PolarHBondContact O-N 2.93Å; Q576-Q578 PolarHBondContact O-N 3.47Å; Q578-D580 VanDerWaalsContact C-N 3.33Å; Q578-D580 PolarHBondContact O-N 2.92Å; Q578-A581 VanDerWaalsContact O-CB 3.28Å; Q578-A581 WeakPolarHBondContact O-CB 3.36Å; Q578-A581 PolarHBondContact O-N 2.7Å; Q578-A581 VanDerWaalsContact O-N 3.13Å; Q578-L582 PolarHBondContact O-N 3.1Å
579	Q	59.9	Low	68.3	Low	58 Å²	58	68.9 Å²	68.9	27%	0.271	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-36.5	173.1	-65.2	179.3	-18.9	0	0	112.4	Y523 V575 Q576 A581 L582 L583	Y523-Q579 HydrophobicContact CD1-CG 4.43Å; V575-Q579 PolarHBondContact O-N 3.5Å; V575-Q579 VanDerWaalsContact O-N 3.1Å; Q576-Q579 WeakPolarHBondContact O-CA 3Å; Q576-Q579 VanDerWaalsContact O-CB 3.29Å; Q576-Q579 WeakPolarHBondContact O-CB 3.44Å; Q576-Q579 PolarHBondContact O-N 3.48Å; Q579-A581 PolarHBondContact O-N 2.96Å; Q579-L582 WeakPolarHBondContact O-CA 3.28Å; Q579-L582 VanDerWaalsContact O-CB 3.31Å; Q579-L582 WeakPolarHBondContact O-CB 3.39Å; Q579-L582 PolarHBondContact O-N 2.82Å; Q579-L583 PolarHBondContact O-N 3.06Å
580	D	62.9	Low	67.9	Low	100 Å²	100	68 Å²	68	54%	0.535	35%	0.353	S	S	.	.	H	α-helix	trans	-58.5	-32	174.1	-75.6	-22.9	0	0	0	111.9	Q576 Q578 L582 L583 V584	Q576-D580 PolarHBondContact O-N 3.42Å; Q576-D580 VanDerWaalsContact O-N 3.15Å; Q578-D580 VanDerWaalsContact C-N 3.33Å; Q578-D580 PolarHBondContact O-N 2.92Å; D580-L582 VanDerWaalsContact C-N 3.34Å; D580-L583 WeakPolarHBondContact O-CB 3.22Å; D580-L583 PolarHBondContact O-N 3.06Å; D580-V584 WeakPolarHBondContact O-CG2 3.43Å; D580-V584 PolarHBondContact O-N 2.95Å
581	A	65.6	Low	67.6	Low	53 Å²	53	70.6 Å²	70.6	44%	0.438	36%	0.355	S	S	.	.	H	α-helix	trans	-67	-34.8	173.5	0	0	0	0	0	112.1	Q578 Q579 V584 V585	Q578-A581 VanDerWaalsContact O-CB 3.28Å; Q578-A581 WeakPolarHBondContact O-CB 3.36Å; Q578-A581 PolarHBondContact O-N 2.7Å; Q578-A581 VanDerWaalsContact O-N 3.13Å; Q579-A581 PolarHBondContact O-N 2.96Å; A581-V584 WeakPolarHBondContact O-CB 3.5Å; A581-V584 PolarHBondContact O-N 3.08Å; A581-V585 PolarHBondContact O-N 2.82Å
582	L	66	Low	67.1	Low	8 Å²	8	72.2 Å²	72.2	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-36.9	173.7	-169.5	71.2	0	0	0	111.5	I498 Y503 Y523 Q578 Q579 D580 V584 V585 D586	I498-L582 HydrophobicContact CG2-CD2 4.06Å; Y503-L582 HydrophobicContact CD1-CD1 4.2Å; Y503-L582 HydrophobicContact CE1-CD1 3.85Å; Y503-L582 HydrophobicContact CE1-CD2 4.31Å; Y503-L582 HydrophobicContact CE1-CG 3.82Å; Y503-L582 HydrophobicContact CE2-CD2 3.85Å; Y503-L582 HydrophobicContact CE2-CG 4.25Å; Y523-L582 HydrophobicContact CD2-CB 4.36Å; Y523-L582 HydrophobicContact CD2-CD1 4.36Å; Y523-L582 HydrophobicContact CD2-CD2 3.97Å; Y523-L582 HydrophobicContact CD2-CG 4.46Å; Y523-L582 HydrophobicContact CE2-CB 3.97Å; Y523-L582 HydrophobicContact CE2-CD1 4.17Å; Y523-L582 HydrophobicContact CE2-CD2 4.39Å; Y523-L582 HydrophobicContact CE2-CG 4.39Å; Q578-L582 PolarHBondContact O-N 3.1Å; Q579-L582 WeakPolarHBondContact O-CA 3.28Å; Q579-L582 VanDerWaalsContact O-CB 3.31Å; Q579-L582 WeakPolarHBondContact O-CB 3.39Å; Q579-L582 PolarHBondContact O-N 2.82Å; D580-L582 VanDerWaalsContact C-N 3.34Å; L582-V584 PolarHBondContact O-N 3.4Å; L582-V585 WeakPolarHBondContact O-CA 3.29Å; L582-V585 WeakPolarHBondContact O-CB 2.92Å; L582-V585 PolarHBondContact O-N 2.85Å; L582-V585 VanDerWaalsContact O-N 3.08Å; L582-D586 PolarHBondContact O-N 3.19Å
583	L	64.4	Low	66.7	Low	94 Å²	94	73.6 Å²	73.6	49%	0.492	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-30.5	174	-66.5	176.8	0	0	0	112.6	Q579 D580 D586 R587	Q579-L583 PolarHBondContact O-N 3.06Å; D580-L583 WeakPolarHBondContact O-CB 3.22Å; D580-L583 PolarHBondContact O-N 3.06Å; L583-D586 WeakPolarHBondContact O-CB 3.42Å; L583-D586 PolarHBondContact O-N 3.48Å; L583-R587 WeakPolarHBondContact O-CB 3Å; L583-R587 PolarHBondContact O-N 3.23Å
584	V	68	Low	66.4	Low	80 Å²	80	77 Å²	77	49%	0.485	38%	0.376	S	S	.	.	H	α-helix	trans	-65.6	-43.2	171.8	176.3	0	0	0	0	110.7	D580 A581 L582 D586 R587 Q588	D580-V584 WeakPolarHBondContact O-CG2 3.43Å; D580-V584 PolarHBondContact O-N 2.95Å; A581-V584 WeakPolarHBondContact O-CB 3.5Å; A581-V584 PolarHBondContact O-N 3.08Å; L582-V584 PolarHBondContact O-N 3.4Å; V584-D586 VanDerWaalsContact C-N 3.3Å; V584-D586 PolarHBondContact O-N 3.24Å; V584-R587 PolarHBondContact O-N 2.95Å; V584-Q588 WeakPolarHBondContact O-CG 3.37Å; V584-Q588 PolarHBondContact O-N 2.61Å
585	V	67.2	Low	66.3	Low	33 Å²	33	75.2 Å²	75.2	20%	0.2	37%	0.367	C	S	.	.	H	α-helix	trans	-60.2	-43.2	173.7	179.1	0	0	0	0	110.3	V516 A581 L582 R587 Q588 M589	V516-V585 HydrophobicContact CG2-CG1 4.46Å; A581-V585 PolarHBondContact O-N 2.82Å; L582-V585 WeakPolarHBondContact O-CA 3.29Å; L582-V585 WeakPolarHBondContact O-CB 2.92Å; L582-V585 PolarHBondContact O-N 2.85Å; L582-V585 VanDerWaalsContact O-N 3.08Å; V585-R587 PolarHBondContact O-N 3.3Å; V585-Q588 WeakPolarHBondContact O-CB 3.38Å; V585-Q588 PolarHBondContact O-N 3.39Å; V585-M589 HydrophobicContact CG1-CG 4.39Å; V585-M589 HydrophobicContact CG1-SD 4.47Å; V585-M589 WeakPolarHBondContact O-CG 3.32Å; V585-M589 PolarHBondContact O-N 3.4Å
586	D	65.3	Low	66	Low	29 Å²	29	78.3 Å²	78.3	16%	0.155	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-43.1	177.6	-165.6	52.2	0	0	0	113.3	K502 Y503 L582 L583 V584 Q588 M589 S590	K502-D586 WeakPolarHBondContact CD-OD1 3.05Å; K502-D586 WeakPolarHBondContact CE-OD1 3.21Å; K502-D586 IonicContact NZ-OD1 2.83Å; K502-D586 PolarHBondContact NZ-OD1 3.11Å; K502-D586 IonicContact NZ-OD2 2.63Å; K502-D586 PolarHBondContact NZ-OD2 3.42Å; Y503-D586 HydrophobicContact CE1-CB 4.14Å; Y503-D586 WeakPolarHBondContact OH-CB 3.38Å; L582-D586 PolarHBondContact O-N 3.19Å; L583-D586 WeakPolarHBondContact O-CB 3.42Å; L583-D586 PolarHBondContact O-N 3.48Å; V584-D586 VanDerWaalsContact C-N 3.3Å; V584-D586 PolarHBondContact O-N 3.24Å; D586-Q588 VanDerWaalsContact C-N 3.33Å; D586-Q588 PolarHBondContact O-N 3.25Å; D586-M589 PolarHBondContact O-N 3.21Å; D586-S590 VanDerWaalsContact O-CB 3.32Å; D586-S590 WeakPolarHBondContact O-CB 3.42Å; D586-S590 PolarHBondContact O-N 3.35Å; D586-S590 PolarHBondContact O-OG 2.03Å
587	R	68	Low	66	Low	196 Å²	196	77.1 Å²	77.1	74%	0.74	39%	0.385	S	S	*	.	H	α-helix	trans	-63.1	-41	176.6	-168.2	180	-64.5	-179.4	0.9	111.1	L583 V584 V585 S590 Y591	L583-R587 WeakPolarHBondContact O-CB 3Å; L583-R587 PolarHBondContact O-N 3.23Å; V584-R587 PolarHBondContact O-N 2.95Å; V585-R587 PolarHBondContact O-N 3.3Å; R587-S590 PolarHBondContact O-N 3.29Å; R587-Y591 WeakPolarHBondContact O-CB 3.4Å; R587-Y591 PolarHBondContact O-N 3.09Å
588	Q	70.1	Confident	66	Low	117 Å²	117	76.7 Å²	76.7	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-65.4	-44.7	175.7	-71.4	178.6	-3.9	0	0	112.1	V584 V585 D586 S590 Y591 M592	V584-Q588 WeakPolarHBondContact O-CG 3.37Å; V584-Q588 PolarHBondContact O-N 2.61Å; V585-Q588 WeakPolarHBondContact O-CB 3.38Å; V585-Q588 PolarHBondContact O-N 3.39Å; D586-Q588 VanDerWaalsContact C-N 3.33Å; D586-Q588 PolarHBondContact O-N 3.25Å; Q588-S590 VanDerWaalsContact C-N 3.34Å; Q588-S590 PolarHBondContact O-N 3.44Å; Q588-Y591 PolarHBondContact O-N 3.4Å; Q588-M592 WeakPolarHBondContact O-CG 3.26Å; Q588-M592 PolarHBondContact O-N 3.31Å
589	M	67.3	Low	65.8	Low	7 Å²	7	80.6 Å²	80.6	3%	0.034	40%	0.4	C	S	.	.	H	α-helix	trans	-62.8	-41.5	176	-69.7	-167	-50.3	0	0	112.1	Y503 D506 P507 V585 D586 Y591 M592 R593	Y503-M589 HydrophobicContact CD1-CE 3.46Å; Y503-M589 VanDerWaalsContact CD1-CE 3.46Å; Y503-M589 HydrophobicContact CE1-CE 3.69Å; Y503-M589 HydrophobicContact CG-CE 4.42Å; D506-M589 HydrophobicContact CB-CE 4.37Å; D506-M589 HydrophobicContact CB-SD 3.87Å; P507-M589 HydrophobicContact CG-SD 4.14Å; V585-M589 HydrophobicContact CG1-CG 4.39Å; V585-M589 HydrophobicContact CG1-SD 4.47Å; V585-M589 WeakPolarHBondContact O-CG 3.32Å; V585-M589 PolarHBondContact O-N 3.4Å; D586-M589 PolarHBondContact O-N 3.21Å; M589-Y591 VanDerWaalsContact C-N 3.3Å; M589-Y591 PolarHBondContact O-N 3.39Å; M589-M592 HydrophobicContact CB-CE 4.48Å; M589-M592 HydrophobicContact CG-CE 4.11Å; M589-M592 PolarHBondContact O-N 3.42Å; M589-R593 WeakPolarHBondContact O-CB 3.24Å; M589-R593 WeakPolarHBondContact O-CG 3.23Å; M589-R593 PolarHBondContact O-N 2.92Å
590	S	69.3	Low	65.6	Low	36 Å²	36	83.6 Å²	83.6	25%	0.252	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-39	176.8	-57.4	0	0	0	0	111.3	K502 D586 R587 Q588 R593 Q594	K502-S590 PolarHBondContact NZ-OG 3.44Å; K502-S590 VanDerWaalsContact NZ-OG 3.16Å; D586-S590 VanDerWaalsContact O-CB 3.32Å; D586-S590 WeakPolarHBondContact O-CB 3.42Å; D586-S590 PolarHBondContact O-N 3.35Å; D586-S590 PolarHBondContact O-OG 2.03Å; R587-S590 PolarHBondContact O-N 3.29Å; Q588-S590 VanDerWaalsContact C-N 3.34Å; Q588-S590 PolarHBondContact O-N 3.44Å; S590-R593 PolarHBondContact O-N 3.47Å; S590-Q594 WeakPolarHBondContact O-CG 3.5Å; S590-Q594 PolarHBondContact O-N 3.43Å
591	Y	70.6	Confident	65.3	Low	136 Å²	136	83.9 Å²	83.9	53%	0.533	42%	0.416	S	S	.	.	H	α-helix	trans	-66.5	-44	173.7	-176	-104.9	0	0	0	112.6	R587 Q588 M589 R593 Q594 Q595	R587-Y591 WeakPolarHBondContact O-CB 3.4Å; R587-Y591 PolarHBondContact O-N 3.09Å; Q588-Y591 PolarHBondContact O-N 3.4Å; M589-Y591 VanDerWaalsContact C-N 3.3Å; M589-Y591 PolarHBondContact O-N 3.39Å; Y591-R593 VanDerWaalsContact C-N 3.31Å; Y591-R593 PolarHBondContact O-N 3.21Å; Y591-Q594 WeakPolarHBondContact O-CB 3.42Å; Y591-Q594 PolarHBondContact O-N 3.07Å; Y591-Q595 HydrophobicContact CD1-CG 4.47Å; Y591-Q595 HydrophobicContact CE1-CG 4.15Å; Y591-Q595 WeakPolarHBondContact O-CG 3.3Å; Y591-Q595 PolarHBondContact O-N 2.9Å; Y591-Q595 PolarHBondContact OH-NE2 2.85Å
592	M	66.9	Low	64.8	Low	67 Å²	67	83.9 Å²	83.9	33%	0.33	41%	0.414	S	S	.	.	H	α-helix	trans	-60.3	-40.9	174.7	-72.9	-172.3	-74	0	0	112	L510 Q588 M589 Q595 L596	L510-M592 HydrophobicContact CD1-CB 4.09Å; L510-M592 HydrophobicContact CD1-CE 3.59Å; L510-M592 HydrophobicContact CD1-SD 4.03Å; L510-M592 HydrophobicContact CD2-CB 4.16Å; Q588-M592 WeakPolarHBondContact O-CG 3.26Å; Q588-M592 PolarHBondContact O-N 3.31Å; M589-M592 HydrophobicContact CB-CE 4.48Å; M589-M592 HydrophobicContact CG-CE 4.11Å; M589-M592 PolarHBondContact O-N 3.42Å; M592-Q595 PolarHBondContact O-N 3.36Å; M592-L596 WeakPolarHBondContact O-CG 3.39Å; M592-L596 PolarHBondContact O-N 2.88Å
593	R	63.9	Low	64.3	Low	101 Å²	101	92.5 Å²	92.5	38%	0.381	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-44.7	173.2	-82.2	171.8	147	-168.7	-17.6	112.3	D506 M589 S590 Y591 Q595 L596 S597	D506-R593 VanDerWaalsContact CG-NE 3.31Å; D506-R593 VanDerWaalsContact CG-NH2 3.3Å; D506-R593 IonicContact OD1-CZ 2.87Å; D506-R593 IonicContact OD1-NE 3.37Å; D506-R593 PolarHBondContact OD1-NE 2.84Å; D506-R593 IonicContact OD1-NH1 2.69Å; D506-R593 PolarHBondContact OD1-NH1 3Å; D506-R593 IonicContact OD1-NH2 2.73Å; D506-R593 PolarHBondContact OD1-NH2 3.06Å; D506-R593 IonicContact OD2-CZ 2.85Å; D506-R593 IonicContact OD2-NE 3.09Å; D506-R593 PolarHBondContact OD2-NE 3.4Å; D506-R593 VanDerWaalsContact OD2-NE 3.09Å; D506-R593 IonicContact OD2-NH1 2.77Å; D506-R593 PolarHBondContact OD2-NH1 3.44Å; D506-R593 IonicContact OD2-NH2 3.52Å; D506-R593 PolarHBondContact OD2-NH2 2.61Å; M589-R593 WeakPolarHBondContact O-CB 3.24Å; M589-R593 WeakPolarHBondContact O-CG 3.23Å; M589-R593 PolarHBondContact O-N 2.92Å; S590-R593 PolarHBondContact O-N 3.47Å; Y591-R593 VanDerWaalsContact C-N 3.31Å; Y591-R593 PolarHBondContact O-N 3.21Å; R593-Q595 VanDerWaalsContact C-N 3.31Å; R593-Q595 PolarHBondContact O-N 3.23Å; R593-L596 PolarHBondContact O-N 3.33Å; R593-S597 WeakPolarHBondContact O-CB 3.32Å; R593-S597 PolarHBondContact O-N 2.8Å; R593-S597 PolarHBondContact O-OG 3.22Å
594	Q	67.7	Low	63.7	Low	128 Å²	128	95.2 Å²	95.2	60%	0.598	45%	0.45	S	S	*	.	H	α-helix	trans	-61.1	-39.7	175.4	-75.7	177.2	-3.9	0	0	112.1	S590 Y591 S597 A598	S590-Q594 WeakPolarHBondContact O-CG 3.5Å; S590-Q594 PolarHBondContact O-N 3.43Å; Y591-Q594 WeakPolarHBondContact O-CB 3.42Å; Y591-Q594 PolarHBondContact O-N 3.07Å; Q594-S597 PolarHBondContact O-OG 2.63Å; Q594-A598 VanDerWaalsContact O-CB 3.27Å; Q594-A598 WeakPolarHBondContact O-CB 3.43Å; Q594-A598 PolarHBondContact O-N 3.28Å
595	Q	69.2	Low	63	Low	77 Å²	77	96.1 Å²	96.1	36%	0.36	45%	0.449	S	S	.	.	H	α-helix	trans	-67.8	-40.9	175.9	-70	-171	-14.5	0	0	112.4	Y591 M592 R593 A598 R599	Y591-Q595 HydrophobicContact CD1-CG 4.47Å; Y591-Q595 HydrophobicContact CE1-CG 4.15Å; Y591-Q595 WeakPolarHBondContact O-CG 3.3Å; Y591-Q595 PolarHBondContact O-N 2.9Å; Y591-Q595 PolarHBondContact OH-NE2 2.85Å; M592-Q595 PolarHBondContact O-N 3.36Å; R593-Q595 VanDerWaalsContact C-N 3.31Å; R593-Q595 PolarHBondContact O-N 3.23Å; Q595-A598 PolarHBondContact O-N 2.58Å; Q595-R599 WeakPolarHBondContact O-CB 3.37Å; Q595-R599 VanDerWaalsContact O-CG 3.3Å; Q595-R599 WeakPolarHBondContact O-CG 3.47Å; Q595-R599 PolarHBondContact O-N 3.36Å
596	L	65.2	Low	62.5	Low	72 Å²	72	98.6 Å²	98.6	38%	0.377	46%	0.461	S	S	.	.	H	α-helix	trans	-68.9	-41.2	177.1	-78.3	174	0	0	0	112.4	L510 M592 R593 A598 R599 M600	L510-L596 HydrophobicContact CD2-CD1 3.06Å; L510-L596 HydrophobicContact CD2-CG 4.34Å; L510-L596 HydrophobicContact CG-CD1 4.5Å; M592-L596 WeakPolarHBondContact O-CG 3.39Å; M592-L596 PolarHBondContact O-N 2.88Å; R593-L596 PolarHBondContact O-N 3.33Å; L596-A598 VanDerWaalsContact C-N 3.33Å; L596-R599 PolarHBondContact O-N 3.18Å; L596-M600 WeakPolarHBondContact O-CB 3.45Å; L596-M600 WeakPolarHBondContact O-CG 3.2Å; L596-M600 PolarHBondContact O-N 3.19Å
597	S	63.1	Low	61.9	Low	71 Å²	71	102.4 Å²	102.4	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175	68.9	0	0	0	0	110.5	R593 Q594 R599 M600 L601	R593-S597 WeakPolarHBondContact O-CB 3.32Å; R593-S597 PolarHBondContact O-N 2.8Å; R593-S597 PolarHBondContact O-OG 3.22Å; Q594-S597 PolarHBondContact O-OG 2.63Å; S597-R599 PolarHBondContact O-N 2.81Å; S597-M600 PolarHBondContact O-N 2.82Å; S597-L601 WeakPolarHBondContact O-CB 3.48Å; S597-L601 VanDerWaalsContact O-CB 3.24Å; S597-L601 PolarHBondContact O-N 3.43Å
598	A	62	Low	61	Low	60 Å²	60	101.3 Å²	101.3	50%	0.496	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-41.6	173.3	0	0	0	0	0	112.3	Q594 Q595 L596 S602	Q594-A598 VanDerWaalsContact O-CB 3.27Å; Q594-A598 WeakPolarHBondContact O-CB 3.43Å; Q594-A598 PolarHBondContact O-N 3.28Å; Q595-A598 PolarHBondContact O-N 2.58Å; L596-A598 VanDerWaalsContact C-N 3.33Å; A598-S602 VanDerWaalsContact O-CB 3.28Å; A598-S602 WeakPolarHBondContact O-CB 3.25Å; A598-S602 PolarHBondContact O-N 2.95Å
599	R	59.3	Low	60.1	Low	169 Å²	169	102.5 Å²	102.5	64%	0.638	48%	0.484	S	S	*	.	H	α-helix	trans	-69.1	-39.8	175.9	-76	177.6	-178.4	-176.4	2.8	112.9	Q595 L596 S597 S602 R603	Q595-R599 WeakPolarHBondContact O-CB 3.37Å; Q595-R599 VanDerWaalsContact O-CG 3.3Å; Q595-R599 WeakPolarHBondContact O-CG 3.47Å; Q595-R599 PolarHBondContact O-N 3.36Å; L596-R599 PolarHBondContact O-N 3.18Å; S597-R599 PolarHBondContact O-N 2.81Å; R599-S602 PolarHBondContact O-N 2.8Å; R599-R603 WeakPolarHBondContact O-CB 3.45Å; R599-R603 PolarHBondContact O-N 3.3Å
600	M	56.8	Low	59.3	Low	121 Å²	121	110.5 Å²	110.5	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-66.6	-46.2	175	-79.9	-152.8	167.7	0	0	110.3	L596 S597 S602 R603 Y604	L596-M600 WeakPolarHBondContact O-CB 3.45Å; L596-M600 WeakPolarHBondContact O-CG 3.2Å; L596-M600 PolarHBondContact O-N 3.19Å; S597-M600 PolarHBondContact O-N 2.82Å; M600-S602 VanDerWaalsContact C-N 3.28Å; M600-S602 PolarHBondContact O-N 3.42Å; M600-R603 CarbonylContact O-C 3.58Å; M600-R603 PolarHBondContact O-N 3.12Å; M600-R603 VanDerWaalsContact O-N 3.15Å; M600-Y604 VanDerWaalsContact O-CD2 3.29Å; M600-Y604 PolarHBondContact O-N 3.49Å; M600-Y604 WeakPolarHBondContact O-CD2 3.49Å; M600-Y604 WeakPolarHBondContact O-CB 3.45Å
601	L	55.6	Low	58.3	Low	106 Å²	106	111.6 Å²	111.6	56%	0.555	54%	0.536	S	S	*	.	H	α-helix	trans	-58	-43.8	175	-155.3	89.4	0	0	0	110.5	S597 Y604 Q605	S597-L601 WeakPolarHBondContact O-CB 3.48Å; S597-L601 VanDerWaalsContact O-CB 3.24Å; S597-L601 PolarHBondContact O-N 3.43Å; L601-Y604 PolarHBondContact O-N 3.45Å; L601-Q605 VanDerWaalsContact O-CB 3.25Å; L601-Q605 WeakPolarHBondContact O-CB 3.03Å; L601-Q605 WeakPolarHBondContact O-CG 3.4Å; L601-Q605 PolarHBondContact O-N 2.96Å
602	S	55.8	Low	57	Low	54 Å²	54	116.4 Å²	116.4	38%	0.378	55%	0.553	S	S	.	*	H	α-helix	trans	-64.8	-41.6	175.3	-175.8	0	0	0	0	112.5	A598 R599 M600 Q605 N606	A598-S602 VanDerWaalsContact O-CB 3.28Å; A598-S602 WeakPolarHBondContact O-CB 3.25Å; A598-S602 PolarHBondContact O-N 2.95Å; R599-S602 PolarHBondContact O-N 2.8Å; M600-S602 VanDerWaalsContact C-N 3.28Å; M600-S602 PolarHBondContact O-N 3.42Å; S602-Q605 PolarHBondContact O-N 3.03Å; S602-N606 VanDerWaalsContact O-CB 3.25Å; S602-N606 WeakPolarHBondContact O-CB 3.45Å; S602-N606 PolarHBondContact O-N 3.3Å; S602-N606 PolarHBondContact O-ND2 3.44Å
603	R	54.7	Low	56	Low	189 Å²	189	116 Å²	116	71%	0.713	57%	0.567	S	S	*	*	H	α-helix	trans	-63.2	-44	172.3	-89.2	-169.3	-175	-178.3	2.6	112.4	R599 M600 N606 N607	R599-R603 WeakPolarHBondContact O-CB 3.45Å; R599-R603 PolarHBondContact O-N 3.3Å; M600-R603 CarbonylContact O-C 3.58Å; M600-R603 PolarHBondContact O-N 3.12Å; M600-R603 VanDerWaalsContact O-N 3.15Å; R603-N606 PolarHBondContact O-N 3.34Å; R603-N607 PolarHBondContact O-N 2.97Å; R603-N607 PolarHBondContact O-ND2 3.09Å; R603-N607 WeakPolarHBondContact O-CB 3.38Å
604	Y	52.6	Low	55	Low	151 Å²	151	117 Å²	117	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-62.4	-48.3	176.2	-92.3	-80	0	0	0	110.2	M600 L601 N606 N607 Y608	M600-Y604 VanDerWaalsContact O-CD2 3.29Å; M600-Y604 PolarHBondContact O-N 3.49Å; M600-Y604 WeakPolarHBondContact O-CD2 3.49Å; M600-Y604 WeakPolarHBondContact O-CB 3.45Å; L601-Y604 PolarHBondContact O-N 3.45Å; Y604-N606 VanDerWaalsContact C-N 3.35Å; Y604-N606 PolarHBondContact O-N 3.13Å; Y604-N607 PolarHBondContact O-N 2.74Å; Y604-Y608 HydrophobicContact CD1-CE2 4.35Å; Y604-Y608 WeakPolarHBondContact O-CD2 3.43Å; Y604-Y608 PolarHBondContact O-N 3.49Å
605	Q	53	Low	53.6	Low	99 Å²	99	122.6 Å²	122.6	46%	0.463	62%	0.617	S	S	.	*	H	α-helix	trans	-57.8	-46.1	174.9	-76.2	174	-16.2	0	0	111.4	L601 S602 N607 Y608 H609	L601-Q605 VanDerWaalsContact O-CB 3.25Å; L601-Q605 WeakPolarHBondContact O-CB 3.03Å; L601-Q605 WeakPolarHBondContact O-CG 3.4Å; L601-Q605 PolarHBondContact O-N 2.96Å; S602-Q605 PolarHBondContact O-N 3.03Å; Q605-N607 PolarHBondContact O-N 3.02Å; Q605-Y608 WeakPolarHBondContact O-CB 3.43Å; Q605-Y608 PolarHBondContact O-N 2.86Å; Q605-H609 PolarHBondContact O-CD2 3.48Å; Q605-H609 PolarHBondContact O-N 2.87Å
606	N	55.5	Low	52.8	Low	84 Å²	84	124.9 Å²	124.9	45%	0.449	63%	0.63	S	S	.	*	H	α-helix	trans	-62.5	-41.7	176.1	-70	-18.7	0	0	0	111.8	S602 R603 Y604 Y608 H609 F610	S602-N606 VanDerWaalsContact O-CB 3.25Å; S602-N606 WeakPolarHBondContact O-CB 3.45Å; S602-N606 PolarHBondContact O-N 3.3Å; S602-N606 PolarHBondContact O-ND2 3.44Å; R603-N606 PolarHBondContact O-N 3.34Å; Y604-N606 VanDerWaalsContact C-N 3.35Å; Y604-N606 PolarHBondContact O-N 3.13Å; N606-Y608 VanDerWaalsContact C-N 3.34Å; N606-Y608 PolarHBondContact O-N 3.32Å; N606-H609 PolarHBondContact O-N 3.41Å; N606-F610 WeakPolarHBondContact O-CD2 3.21Å; N606-F610 PolarHBondContact O-N 2.89Å; N606-F610 VanDerWaalsContact O-N 3.07Å
607	N	54.3	Low	52.2	Low	109 Å²	109	127.7 Å²	127.7	58%	0.583	64%	0.643	S	S	*	*	H	α-helix	trans	-65.2	-36.4	174.8	-73	-14.4	0	0	0	112	R603 Y604 Q605 H609 F610 G611	R603-N607 PolarHBondContact O-N 2.97Å; R603-N607 PolarHBondContact O-ND2 3.09Å; R603-N607 WeakPolarHBondContact O-CB 3.38Å; Y604-N607 PolarHBondContact O-N 2.74Å; Q605-N607 PolarHBondContact O-N 3.02Å; N607-H609 VanDerWaalsContact C-N 3.32Å; N607-F610 PolarHBondContact O-N 3.16Å; N607-G611 PolarHBondContact O-N 3.45Å; N607-G611 VanDerWaalsContact O-N 3.07Å
608	Y	48.6	Very low	51.6	Low	174 Å²	174	130.8 Å²	130.8	68%	0.682	65%	0.651	S	S	*	*	H	α-helix	trans	-66.2	-33.5	172.8	-87.6	-71	0	0	0	112.3	Y604 Q605 N606 G611 R612	Y604-Y608 HydrophobicContact CD1-CE2 4.35Å; Y604-Y608 WeakPolarHBondContact O-CD2 3.43Å; Y604-Y608 PolarHBondContact O-N 3.49Å; Q605-Y608 WeakPolarHBondContact O-CB 3.43Å; Q605-Y608 PolarHBondContact O-N 2.86Å; N606-Y608 VanDerWaalsContact C-N 3.34Å; N606-Y608 PolarHBondContact O-N 3.32Å; Y608-G611 PolarHBondContact O-N 3.36Å; Y608-R612 PolarHBondContact O-N 3.15Å
609	H	51.6	Low	50.9	Low	141 Å²	141	135 Å²	135	65%	0.653	66%	0.66	S	S	*	*	H	α-helix	trans	-69.7	-34.8	173.6	-73.3	-60.2	0	0	0	112.5	Q605 N606 N607	Q605-H609 PolarHBondContact O-CD2 3.48Å; Q605-H609 PolarHBondContact O-N 2.87Å; N606-H609 PolarHBondContact O-N 3.41Å; N607-H609 VanDerWaalsContact C-N 3.32Å
610	F	50.6	Low	50.4	Low	175 Å²	175	132.9 Å²	132.9	77%	0.768	66%	0.662	S	S	*	*	H	α-helix	trans	-70.1	-29.6	172	-85.5	-80.1	0	0	0	113.2	N606 N607 R612	N606-F610 WeakPolarHBondContact O-CD2 3.21Å; N606-F610 PolarHBondContact O-N 2.89Å; N606-F610 VanDerWaalsContact O-N 3.07Å; N607-F610 PolarHBondContact O-N 3.16Å; F610-R612 VanDerWaalsContact C-N 3.33Å; F610-R612 PolarHBondContact O-N 2.99Å
611	G	47.7	Very low	50	Low	60 Å²	60	133.7 Å²	133.7	62%	0.619	67%	0.666	S	S	*	*	H	α-helix	trans	-74.8	-14.8	177.5	0	0	0	0	0	115.5	N607 Y608	N607-G611 PolarHBondContact O-N 3.45Å; N607-G611 VanDerWaalsContact O-N 3.07Å; Y608-G611 PolarHBondContact O-N 3.36Å
612	R	42.3	Very low	49.6	Very low	236 Å²	236	135.6 Å²	135.6	89%	0.891	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	0.9	179.8	-104.9	-177	178.3	172.8	0.1	114.6	Y608 F610	Y608-R612 PolarHBondContact O-N 3.15Å; F610-R612 VanDerWaalsContact C-N 3.33Å; F610-R612 PolarHBondContact O-N 2.99Å
613	G	46.9	Very low	49.1	Very low	60 Å²	60	141.9 Å²	141.9	62%	0.619	70%	0.697	S	S	*	*	S	Bend	trans	-96.5	-1.4	-177.2	0	0	0	0	0	116
614	T	41.7	Very low	48.6	Very low	120 Å²	120	138 Å²	138	74%	0.736	70%	0.696	S	S	*	*			trans	-135.5	75.6	-179.8	54.6	0	0	0	0	111
615	L	39.1	Very low	48.3	Very low	247 Å²	247	136.8 Å²	136.8	100%	1.293	71%	0.705	S	S	*	*			trans	-118.5	0	146.4	-78.3	168.2	0	0	0	105.6

Retrieved 615 of 615 residues in 2231.5 ms (Link to these results)

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