A0A077ZL98_TRITR Loading...

GST C domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZL98, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 223 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	39.8	Very low	37.6	Very low	240 Å²	240	128.8 Å²	128.8	100%	1.182	86%	0.859	S	S	*	*				0	120.1	0	-88.4	80.4	161.6	0	0	108.4
2	G	34.6	Very low	37.8	Very low	84 Å²	84	128.8 Å²	128.8	87%	0.866	85%	0.852	S	S	*	*			trans	-73.5	139.3	176.1	0	0	0	0	0	111.4
3	A	38.5	Very low	37.8	Very low	106 Å²	106	128.1 Å²	128.1	88%	0.876	85%	0.846	S	S	*	*			trans	-110	109.7	162.7	0	0	0	0	0	106.5
4	A	39.2	Very low	37.6	Very low	94 Å²	94	127.1 Å²	127.1	78%	0.777	84%	0.843	S	S	*	*			trans	-71.2	145	-176.6	0	0	0	0	0	111.3
5	V	41.2	Very low	37.7	Very low	141 Å²	141	126.1 Å²	126.1	86%	0.855	84%	0.839	S	S	*	*			trans	-58.8	130.4	163.3	-73.3	0	0	0	0	110.3
6	S	43.1	Very low	37.5	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	84%	0.838	S	S	*	*			trans	-127.1	102.5	164.2	-78.8	0	0	0	0	108.3
7	S	37.5	Very low	37.6	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	84%	0.842	S	S	*	*			trans	-75	127.2	163.8	30.8	0	0	0	0	109.4
8	T	35.9	Very low	37.9	Very low	139 Å²	139	130.1 Å²	130.1	85%	0.853	83%	0.829	S	S	*	*			trans	-123.9	104.9	164.6	44	0	0	0	0	109
9	S	33.5	Very low	37.6	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	83%	0.829	S	S	*	*			trans	-90.7	135.9	164.8	175.7	0	0	0	0	108.6
10	S	33.9	Very low	37.6	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	83%	0.826	S	S	*	*			trans	158.3	146.1	156.5	59.5	0	0	0	0	106.8
11	N	36.5	Very low	37.4	Very low	152 Å²	152	137.1 Å²	137.1	81%	0.813	83%	0.83	S	S	*	*			cis	-157.6	130.1	10.9	-151.3	0.1	0	0	0	105.9
12	V	39.5	Very low	37.3	Very low	128 Å²	128	132.5 Å²	132.5	78%	0.776	81%	0.806	S	S	*	*			trans	-95.3	119.5	172	-178.1	0	0	0	0	107	S14	V12-S14 PolarHBondContact O-N 3.07Å
13	P	38	Very low	37.3	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	80%	0.804	S	S	*	*			trans	-81.2	102.9	176.7	27.6	-24.6	0	0	0	110
14	S	35.3	Very low	37.5	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	80%	0.801	S	S	*	*			trans	-74	116.9	157.5	-63.3	0	0	0	0	108.6	V12	V12-S14 PolarHBondContact O-N 3.07Å
15	S	38.4	Very low	37.5	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	80%	0.802	S	S	*	*			trans	-130.7	88.8	168.9	178.8	0	0	0	0	109.6
16	S	34.5	Very low	37.4	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	80%	0.797	S	S	*	*			trans	-66.3	130.3	158.1	42.6	0	0	0	0	110.6
17	R	39	Very low	37.1	Very low	237 Å²	237	139 Å²	139	89%	0.894	80%	0.8	S	S	*	*			trans	-143.1	129.2	157.8	-169.9	171.6	179.3	163.9	-1.1	109.9
18	P	42.9	Very low	37.1	Very low	95 Å²	95	138.4 Å²	138.4	62%	0.617	80%	0.802	S	S	*	*			trans	-95.2	165.3	-177.1	38.8	-34.2	0	0	0	112.8
19	E	33.2	Very low	37	Very low	177 Å²	177	134.8 Å²	134.8	83%	0.827	79%	0.792	S	S	*	*			trans	64.2	113.8	146.9	-70.1	166.2	146.5	0	0	119.6
20	E	37.3	Very low	37.3	Very low	164 Å²	164	136.8 Å²	136.8	77%	0.766	79%	0.793	S	S	*	*				-159.2	100.9	123.8	-111.9	-178.8	105	0	0	109.6	Q22	E20-Q22 PolarHBondContact O-N 3.47Å; E20-Q22 PolarHBondContact OE1-NE2 3.13Å
21	E	34	Very low	37.6	Very low	196 Å²	196	136.3 Å²	136.3	92%	0.916	80%	0.797	S	S	*	*			trans	-83.6	95.6	170.3	-169.5	-178.9	141.9	0	0	107.6
22	Q	37.5	Very low	37.9	Very low	143 Å²	143	138 Å²	138	67%	0.668	80%	0.797	S	S	*	*			trans	-101.4	101.8	169.8	-72.7	-171.9	14.6	0	0	109.2	E20 I24	E20-Q22 PolarHBondContact O-N 3.47Å; E20-Q22 PolarHBondContact OE1-NE2 3.13Å; Q22-I24 PolarHBondContact O-N 3.24Å
23	A	34.3	Very low	38	Very low	100 Å²	100	139.2 Å²	139.2	83%	0.826	79%	0.794	S	S	*	*			trans	-64.1	116.1	164.7	0	0	0	0	0	109.1
24	I	43.1	Very low	37.9	Very low	158 Å²	158	145.3 Å²	145.3	81%	0.81	80%	0.801	S	S	*	*			trans	-116.6	130.5	163.3	47.3	169	0	0	0	109.2	Q22	Q22-I24 PolarHBondContact O-N 3.24Å
25	D	39.2	Very low	38.1	Very low	149 Å²	149	146.6 Å²	146.6	80%	0.797	79%	0.794	S	S	*	*			trans	-69	135.2	-163.1	-133	-32.2	0	0	0	113.1	D27	D25-D27 PolarHBondContact O-N 3.27Å
26	S	38.5	Very low	38.4	Very low	108 Å²	108	152.3 Å²	152.3	76%	0.755	80%	0.799	S	S	*	*			trans	1.2	104.4	143	-35.3	0	0	0	0	117
27	D	37.5	Very low	38.8	Very low	162 Å²	162	158.4 Å²	158.4	87%	0.866	80%	0.804	S	S	*	*			trans	-115.8	108.8	150.5	-168.3	21.8	0	0	0	109.1	D25	D25-D27 PolarHBondContact O-N 3.27Å
28	A	38	Very low	38.8	Very low	104 Å²	104	150.2 Å²	150.2	86%	0.86	79%	0.793	S	S	*	*			trans	-99	97.6	179.5	0	0	0	0	0	108.2
29	G	33.7	Very low	38.8	Very low	63 Å²	63	150.1 Å²	150.1	65%	0.649	80%	0.8	S	S	*	*			trans	-156.4	129.7	175.3	0	0	0	0	0	112.9
30	D	38.5	Very low	39.6	Very low	161 Å²	161	148.2 Å²	148.2	86%	0.861	80%	0.8	S	S	*	*			trans	81.8	64.4	166.8	-81.7	-63	0	0	0	119.8	K32	D30-K32 PolarHBondContact O-N 2.87Å
31	A	40	Very low	40.1	Very low	101 Å²	101	145 Å²	145	84%	0.835	80%	0.795	S	S	*	*			trans	-73.7	81.3	151.4	0	0	0	0	0	111.4
32	K	44.2	Very low	40.9	Very low	187 Å²	187	139.7 Å²	139.7	81%	0.813	79%	0.786	S	S	*	*			trans	-163.8	46.5	166.6	-119.4	171.8	-165.2	179	0	119.2	D30	D30-K32 PolarHBondContact O-N 2.87Å
33	H	40.3	Very low	41.9	Very low	154 Å²	154	139.8 Å²	139.8	71%	0.713	79%	0.786	S	S	*	*			trans	-162.2	75	145.6	-142.3	66.2	0	0	0	111.5	Q35	H33-Q35 PolarHBondContact CD2-OE1 3.16Å; H33-Q35 PolarHBondContact NE2-OE1 3.39Å; H33-Q35 PolarHBondContact O-N 3.27Å
34	R	36.6	Very low	43.6	Very low	247 Å²	247	141.7 Å²	141.7	93%	0.932	79%	0.787	S	S	*	*			trans	-75.7	72.7	167.1	-164.5	171.6	-177.6	163.4	-0.6	107.9	R36	R34-R36 PolarHBondContact O-N 2.96Å; R34-R36 VanDerWaalsContact O-N 3.08Å
35	Q	39	Very low	44.9	Very low	143 Å²	143	140.5 Å²	140.5	67%	0.668	77%	0.773	S	S	*	*			trans	-50.3	116.1	166.6	-165.8	86.5	-46.8	0	0	105.8	H33 R37	H33-Q35 PolarHBondContact CD2-OE1 3.16Å; H33-Q35 PolarHBondContact NE2-OE1 3.39Å; H33-Q35 PolarHBondContact O-N 3.27Å; Q35-R37 PolarHBondContact O-N 3.11Å
36	R	44.7	Very low	46.6	Very low	232 Å²	232	136 Å²	136	88%	0.875	75%	0.753	S	S	*	*			trans	-51.6	114.7	-175.2	-60.1	175.1	89.7	-171.6	6.1	107.1	R34 G38	R34-R36 PolarHBondContact O-N 2.96Å; R34-R36 VanDerWaalsContact O-N 3.08Å; R36-G38 PolarHBondContact O-N 3.12Å
37	R	42.4	Very low	48.3	Very low	246 Å²	246	139 Å²	139	93%	0.928	76%	0.756	S	S	*	*			trans	-48.1	117.4	170.8	-80.8	-175.5	168.3	-176.3	-4.2	106	Q35 A39	Q35-R37 PolarHBondContact O-N 3.11Å; R37-A39 PolarHBondContact O-N 2.97Å
38	G	39.2	Very low	50	Low	64 Å²	64	136.5 Å²	136.5	66%	0.66	74%	0.739	S	S	*	*			trans	-45.9	134.1	-172.4	0	0	0	0	0	109.6	R36 V40	R36-G38 PolarHBondContact O-N 3.12Å; G38-V40 PolarHBondContact O-N 2.61Å
39	A	44.3	Very low	51.7	Low	94 Å²	94	135.2 Å²	135.2	78%	0.777	72%	0.718	S	S	*	*			trans	-47.6	120.5	161.2	0	0	0	0	0	106.5	R37 S41	R37-A39 PolarHBondContact O-N 2.97Å; A39-S41 VanDerWaalsContact C-N 3.29Å; A39-S41 PolarHBondContact O-N 3.4Å
40	V	49.4	Very low	53.2	Low	137 Å²	137	135.8 Å²	135.8	83%	0.83	71%	0.708	S	S	*	*			trans	-57.7	105.7	165.3	170.7	0	0	0	0	104	G38 A42	G38-V40 PolarHBondContact O-N 2.61Å; V40-A42 PolarHBondContact O-N 3.38Å
41	S	48.1	Very low	54.4	Low	95 Å²	95	134.8 Å²	134.8	66%	0.664	70%	0.696	S	S	*	*			trans	-54	113.7	171	-72.2	0	0	0	0	105.5	A39 E43	A39-S41 VanDerWaalsContact C-N 3.29Å; A39-S41 PolarHBondContact O-N 3.4Å; S41-E43 PolarHBondContact O-N 2.98Å
42	A	50.6	Low	55.2	Low	86 Å²	86	134.6 Å²	134.6	71%	0.711	68%	0.681	S	S	*	*			trans	-62.3	96.2	161.6	0	0	0	0	0	104.5	V40 V44	V40-A42 PolarHBondContact O-N 3.38Å; A42-V44 VanDerWaalsContact C-N 3.33Å; A42-V44 PolarHBondContact O-N 2.87Å
43	E	59.2	Low	55.6	Low	145 Å²	145	134.4 Å²	134.4	68%	0.678	68%	0.676	S	S	*	*			trans	-59.9	105	171	-70.7	178.4	172.8	0	0	105.6	S41 Y45	S41-E43 PolarHBondContact O-N 2.98Å; E43-Y45 VanDerWaalsContact C-N 3.28Å; E43-Y45 WeakPolarHBondContact O-CD2 3.25Å; E43-Y45 PolarHBondContact O-N 2.9Å
44	V	68.8	Low	56.3	Low	140 Å²	140	132.3 Å²	132.3	85%	0.848	67%	0.674	S	S	*	*			trans	-69.4	96.8	172.8	179.4	0	0	0	0	104.9	A42 S46	A42-V44 VanDerWaalsContact C-N 3.33Å; A42-V44 PolarHBondContact O-N 2.87Å; V44-S46 PolarHBondContact O-N 3.17Å
45	Y	70.1	Confident	57	Low	132 Å²	132	128.4 Å²	128.4	52%	0.518	66%	0.664	S	S	.	*			trans	-55.7	135.5	174.1	-70	-82.2	0	0	0	109.3	E43 D49	E43-Y45 VanDerWaalsContact C-N 3.28Å; E43-Y45 WeakPolarHBondContact O-CD2 3.25Å; E43-Y45 PolarHBondContact O-N 2.9Å; Y45-D49 HydrophobicContact CD1-CB 4.16Å
46	S	75.1	Confident	58	Low	54 Å²	54	131.1 Å²	131.1	38%	0.378	67%	0.674	S	S	.	*			trans	-64.8	155	172.9	72.7	0	0	0	0	109.9	V44 E48 D49 V50	V44-S46 PolarHBondContact O-N 3.17Å; S46-E48 PolarHBondContact O-N 3.43Å; S46-D49 WeakPolarHBondContact CB-OD2 3.48Å; S46-D49 PolarHBondContact N-OD2 3.35Å; S46-D49 CarbonylContact O-C 3.57Å; S46-D49 WeakPolarHBondContact O-CA 3.25Å; S46-D49 WeakPolarHBondContact O-CB 3.31Å; S46-D49 PolarHBondContact O-N 2.8Å; S46-D49 WeakPolarHBondContact OG-CB 3.28Å; S46-D49 PolarHBondContact OG-N 3.49Å; S46-D49 PolarHBondContact OG-OD2 2.97Å; S46-V50 WeakPolarHBondContact O-CG2 3.21Å; S46-V50 PolarHBondContact O-N 3.1Å
47	E	74.1	Confident	59.1	Low	173 Å²	173	123 Å²	123	81%	0.808	65%	0.648	S	S	*	*	H	α-helix	trans	-58.4	-32.4	177	-167.7	173.2	-172.6	0	0	111.5	V50 K51	E47-V50 PolarHBondContact O-N 3.47Å; E47-K51 WeakPolarHBondContact O-CB 3.48Å; E47-K51 PolarHBondContact O-N 2.87Å
48	E	73	Confident	60.8	Low	108 Å²	108	116.5 Å²	116.5	51%	0.505	63%	0.631	S	S	.	*	H	α-helix	trans	-69.5	-39.8	173.2	-161.2	67.4	-159.3	0	0	111.5	S46 K51 N52	S46-E48 PolarHBondContact O-N 3.43Å; E48-K51 CarbonylContact O-C 3.59Å; E48-K51 PolarHBondContact O-N 3.06Å; E48-N52 WeakPolarHBondContact O-CB 3.36Å; E48-N52 PolarHBondContact O-N 3.33Å; E48-N52 PolarHBondContact O-ND2 3.27Å; E48-N52 VanDerWaalsContact O-ND2 3.14Å
49	D	74.3	Confident	62.9	Low	78 Å²	78	115.4 Å²	115.4	42%	0.417	61%	0.612	S	S	.	*	H	α-helix	trans	-63.6	-44.9	172.6	-64.3	-43.1	0	0	0	110.7	Y45 S46 K51 N52 Y53	Y45-D49 HydrophobicContact CD1-CB 4.16Å; S46-D49 WeakPolarHBondContact CB-OD2 3.48Å; S46-D49 PolarHBondContact N-OD2 3.35Å; S46-D49 CarbonylContact O-C 3.57Å; S46-D49 WeakPolarHBondContact O-CA 3.25Å; S46-D49 WeakPolarHBondContact O-CB 3.31Å; S46-D49 PolarHBondContact O-N 2.8Å; S46-D49 WeakPolarHBondContact OG-CB 3.28Å; S46-D49 PolarHBondContact OG-N 3.49Å; S46-D49 PolarHBondContact OG-OD2 2.97Å; D49-K51 VanDerWaalsContact C-N 3.31Å; D49-K51 PolarHBondContact O-N 3.2Å; D49-N52 CarbonylContact O-C 3.53Å; D49-N52 PolarHBondContact O-N 3.22Å; D49-Y53 WeakPolarHBondContact O-CA 3.42Å; D49-Y53 WeakPolarHBondContact O-CB 3.41Å; D49-Y53 PolarHBondContact O-N 3.38Å
50	V	66.4	Low	64.7	Low	75 Å²	75	114.8 Å²	114.8	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-60.9	-43.3	175.2	176.9	0	0	0	0	110.2	S46 E47 N52 Y53 V54	S46-V50 WeakPolarHBondContact O-CG2 3.21Å; S46-V50 PolarHBondContact O-N 3.1Å; E47-V50 PolarHBondContact O-N 3.47Å; V50-N52 VanDerWaalsContact C-N 3.32Å; V50-N52 PolarHBondContact O-N 2.85Å; V50-Y53 PolarHBondContact O-N 3.33Å; V50-V54 HydrophobicContact CG1-CG2 4.48Å; V50-V54 WeakPolarHBondContact O-CB 3.21Å; V50-V54 VanDerWaalsContact O-CG2 3.27Å; V50-V54 WeakPolarHBondContact O-CG2 3.49Å; V50-V54 PolarHBondContact O-N 3.4Å
51	K	62.2	Low	66.2	Low	140 Å²	140	111.4 Å²	111.4	61%	0.609	58%	0.578	S	S	*	*	H	α-helix	trans	-67.2	-31.6	177.8	-169.8	180	178.5	-169.8	0	112.8	E47 E48 D49	E47-K51 WeakPolarHBondContact O-CB 3.48Å; E47-K51 PolarHBondContact O-N 2.87Å; E48-K51 CarbonylContact O-C 3.59Å; E48-K51 PolarHBondContact O-N 3.06Å; D49-K51 VanDerWaalsContact C-N 3.31Å; D49-K51 PolarHBondContact O-N 3.2Å
52	N	56.4	Low	68	Low	96 Å²	96	108.3 Å²	108.3	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-80.1	-30.7	174	-72.2	-27.5	0	0	0	112.5	E48 D49 V50 K55	E48-N52 WeakPolarHBondContact O-CB 3.36Å; E48-N52 PolarHBondContact O-N 3.33Å; E48-N52 PolarHBondContact O-ND2 3.27Å; E48-N52 VanDerWaalsContact O-ND2 3.14Å; D49-N52 CarbonylContact O-C 3.53Å; D49-N52 PolarHBondContact O-N 3.22Å; V50-N52 VanDerWaalsContact C-N 3.32Å; V50-N52 PolarHBondContact O-N 2.85Å; N52-K55 VanDerWaalsContact O-CA 3.31Å; N52-K55 WeakPolarHBondContact O-CA 3.42Å; N52-K55 PolarHBondContact O-N 3.31Å
53	Y	52.7	Low	69.7	Low	183 Å²	183	106.4 Å²	106.4	72%	0.718	53%	0.532	S	S	*	.	H	α-helix	trans	-85.2	-27.2	-178.4	-154.1	-81.6	0	0	0	112.4	D49 V50 K55	D49-Y53 WeakPolarHBondContact O-CA 3.42Å; D49-Y53 WeakPolarHBondContact O-CB 3.41Å; D49-Y53 PolarHBondContact O-N 3.38Å; V50-Y53 PolarHBondContact O-N 3.33Å; Y53-K55 PolarHBondContact O-N 3.02Å
54	V	55.6	Low	70.9	Confident	110 Å²	110	102.4 Å²	102.4	67%	0.667	52%	0.524	S	S	*	.	S	Bend	trans	-66	61.4	145.9	-174.8	0	0	0	0	106.3	V50 K56	V50-V54 HydrophobicContact CG1-CG2 4.48Å; V50-V54 WeakPolarHBondContact O-CB 3.21Å; V50-V54 VanDerWaalsContact O-CG2 3.27Å; V50-V54 WeakPolarHBondContact O-CG2 3.49Å; V50-V54 PolarHBondContact O-N 3.4Å; V54-K56 PolarHBondContact O-N 3.21Å
55	K	52.4	Low	71.7	Confident	166 Å²	166	102.4 Å²	102.4	72%	0.722	52%	0.516	S	S	*	.			trans	-57.3	133.8	176.2	-143.6	171.1	-173.5	178.1	0	104.5	N52 Y53 D57	N52-K55 VanDerWaalsContact O-CA 3.31Å; N52-K55 WeakPolarHBondContact O-CA 3.42Å; N52-K55 PolarHBondContact O-N 3.31Å; Y53-K55 PolarHBondContact O-N 3.02Å; K55-D57 PolarHBondContact O-N 2.91Å
56	K	59.1	Low	72.4	Confident	199 Å²	199	96.7 Å²	96.7	87%	0.865	50%	0.495	S	S	*	.	S	Bend	trans	-50.7	23.8	174.7	-76.8	170.6	167.3	167.9	0	115.3	V54 D58	V54-K56 PolarHBondContact O-N 3.21Å; K56-D58 PolarHBondContact O-N 2.87Å
57	D	67.8	Low	72.9	Confident	63 Å²	63	98.5 Å²	98.5	34%	0.337	50%	0.503	S	S	.	.			trans	-80.2	71.1	177.7	-158.3	-21.8	0	0	0	108.5	K55 V59 N60 S61	K55-D57 PolarHBondContact O-N 2.91Å; D57-V59 PolarHBondContact O-N 2.96Å; D57-V59 VanDerWaalsContact O-N 3.14Å; D57-V59 WeakPolarHBondContact OD1-CB 3.42Å; D57-V59 PolarHBondContact OD1-N 3.35Å; D57-N60 HydrophobicContact CB-CB 4.21Å; D57-N60 PolarHBondContact O-N 3.07Å; D57-N60 PolarHBondContact OD1-N 3.21Å; D57-N60 PolarHBondContact OD2-ND2 3.26Å; D57-S61 PolarHBondContact O-N 3.45Å; D57-S61 PolarHBondContact O-OG 3.21Å
58	D	77.8	Confident	73.2	Confident	109 Å²	109	94.5 Å²	94.5	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-53.3	-30.2	174	-65.4	-19.7	0	0	0	109.7	K56 A62	K56-D58 PolarHBondContact O-N 2.87Å; D58-A62 VanDerWaalsContact O-CB 3.22Å; D58-A62 WeakPolarHBondContact O-CB 3.48Å; D58-A62 PolarHBondContact O-N 2.85Å
59	V	82.6	Confident	73.8	Confident	41 Å²	41	92.8 Å²	92.8	25%	0.248	50%	0.504	C	S	.	.	H	α-helix	trans	-70.3	-53	179.3	175.7	0	0	0	0	111.6	D57 S61 A62 R63 L89	D57-V59 PolarHBondContact O-N 2.96Å; D57-V59 VanDerWaalsContact O-N 3.14Å; D57-V59 WeakPolarHBondContact OD1-CB 3.42Å; D57-V59 PolarHBondContact OD1-N 3.35Å; V59-S61 VanDerWaalsContact C-N 3.26Å; V59-S61 PolarHBondContact O-N 3.45Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3.49Å; V59-A62 VanDerWaalsContact O-N 3.13Å; V59-R63 WeakPolarHBondContact O-CG 3.42Å; V59-R63 PolarHBondContact O-N 3.32Å; V59-L89 HydrophobicContact CG1-CD1 3.71Å; V59-L89 HydrophobicContact CG2-CB 4.3Å; V59-L89 HydrophobicContact CG2-CD2 4.24Å
60	N	82.3	Confident	74.4	Confident	81 Å²	81	95.6 Å²	95.6	43%	0.433	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-34.7	178.4	-81.3	-24.4	0	0	0	112	D57 R63 A64	D57-N60 HydrophobicContact CB-CB 4.21Å; D57-N60 PolarHBondContact O-N 3.07Å; D57-N60 PolarHBondContact OD1-N 3.21Å; D57-N60 PolarHBondContact OD2-ND2 3.26Å; N60-R63 PolarHBondContact O-N 3.24Å; N60-R63 PolarHBondContact OD1-NH1 3.35Å; N60-A64 WeakPolarHBondContact O-CB 3.22Å; N60-A64 PolarHBondContact O-N 3.02Å
61	S	81.1	Confident	75.3	Confident	66 Å²	66	93.1 Å²	93.1	46%	0.462	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-44	171.7	-56	0	0	0	0	111.4	D57 V59 A64 M65	D57-S61 PolarHBondContact O-N 3.45Å; D57-S61 PolarHBondContact O-OG 3.21Å; V59-S61 VanDerWaalsContact C-N 3.26Å; V59-S61 PolarHBondContact O-N 3.45Å; S61-A64 PolarHBondContact O-N 2.87Å; S61-M65 WeakPolarHBondContact O-CB 3.29Å; S61-M65 WeakPolarHBondContact O-CG 3.47Å; S61-M65 PolarHBondContact O-N 3.18Å
62	A	86	Confident	76.4	Confident	29 Å²	29	89.7 Å²	89.7	24%	0.24	50%	0.497	C	S	.	.	H	α-helix	trans	-63.1	-41.9	176.5	0	0	0	0	0	112.3	D58 V59 M65 I66 L127	D58-A62 VanDerWaalsContact O-CB 3.22Å; D58-A62 WeakPolarHBondContact O-CB 3.48Å; D58-A62 PolarHBondContact O-N 2.85Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3.49Å; V59-A62 VanDerWaalsContact O-N 3.13Å; A62-M65 PolarHBondContact O-N 3.07Å; A62-I66 WeakPolarHBondContact O-CG1 3.41Å; A62-I66 PolarHBondContact O-N 3.17Å; A62-L127 HydrophobicContact CB-CD1 3.83Å
63	R	86.6	Confident	77.8	Confident	47 Å²	47	90.4 Å²	90.4	18%	0.177	50%	0.501	C	S	.	.	H	α-helix	trans	-63.1	-44.1	174.6	-68.9	179.4	-174	146.3	-7.1	112	V59 N60 M65 I66 V67 D86 L127	V59-R63 WeakPolarHBondContact O-CG 3.42Å; V59-R63 PolarHBondContact O-N 3.32Å; N60-R63 PolarHBondContact O-N 3.24Å; N60-R63 PolarHBondContact OD1-NH1 3.35Å; R63-M65 VanDerWaalsContact C-N 3.3Å; R63-M65 PolarHBondContact O-N 3.34Å; R63-I66 WeakPolarHBondContact O-CB 3.24Å; R63-I66 PolarHBondContact O-N 2.85Å; R63-V67 WeakPolarHBondContact O-CG2 3.34Å; R63-V67 PolarHBondContact O-N 3.47Å; R63-V67 VanDerWaalsContact O-N 3.09Å; R63-D86 IonicContact CZ-OD1 3.94Å; R63-D86 IonicContact CZ-OD2 2.84Å; R63-D86 IonicContact NH2-OD1 2.86Å; R63-D86 PolarHBondContact NH2-OD1 3.37Å; R63-D86 IonicContact NH2-OD2 2.66Å; R63-D86 PolarHBondContact NH2-OD2 2.9Å; R63-L127 HydrophobicContact CG-CD2 3.77Å
64	A	84	Confident	79.3	Confident	61 Å²	61	82.8 Å²	82.8	50%	0.504	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-40.3	176	0	0	0	0	0	111.5	N60 S61 V67 A68	N60-A64 WeakPolarHBondContact O-CB 3.22Å; N60-A64 PolarHBondContact O-N 3.02Å; S61-A64 PolarHBondContact O-N 2.87Å; A64-V67 PolarHBondContact O-N 2.97Å; A64-A68 WeakPolarHBondContact O-CB 3.39Å; A64-A68 PolarHBondContact O-N 3Å
65	M	85.1	Confident	80.8	Confident	139 Å²	139	79.7 Å²	79.7	69%	0.685	45%	0.451	S	S	*	.	H	α-helix	trans	-65.5	-39	174.8	-75.5	-160.5	72.8	0	0	112.7	S61 A62 R63 V67 A68 A69	S61-M65 WeakPolarHBondContact O-CB 3.29Å; S61-M65 WeakPolarHBondContact O-CG 3.47Å; S61-M65 PolarHBondContact O-N 3.18Å; A62-M65 PolarHBondContact O-N 3.07Å; R63-M65 VanDerWaalsContact C-N 3.3Å; R63-M65 PolarHBondContact O-N 3.34Å; M65-V67 VanDerWaalsContact C-N 3.32Å; M65-V67 PolarHBondContact O-N 2.85Å; M65-A68 PolarHBondContact O-N 3.33Å; M65-A69 WeakPolarHBondContact O-CB 3.16Å; M65-A69 PolarHBondContact O-N 3.03Å
66	I	86	Confident	82.2	Confident	12 Å²	12	73.3 Å²	73.3	6%	0.062	43%	0.427	C	S	.	.	H	α-helix	trans	-58.2	-47.3	174.5	-76.5	165.3	0	0	0	110.4	A62 R63 A69 D70 A71 L74 M75 L127	A62-I66 WeakPolarHBondContact O-CG1 3.41Å; A62-I66 PolarHBondContact O-N 3.17Å; R63-I66 WeakPolarHBondContact O-CB 3.24Å; R63-I66 PolarHBondContact O-N 2.85Å; I66-A69 PolarHBondContact O-N 3.31Å; I66-D70 PolarHBondContact O-N 2.92Å; I66-A71 HydrophobicContact CG2-CB 4.43Å; I66-A71 WeakPolarHBondContact CG2-O 3.16Å; I66-A71 PolarHBondContact O-N 2.85Å; I66-L74 HydrophobicContact CD1-CB 4.07Å; I66-L74 HydrophobicContact CG1-CB 4.36Å; I66-L74 HydrophobicContact CG1-CD1 4.3Å; I66-M75 HydrophobicContact CD1-CG 4.23Å; I66-M75 HydrophobicContact CG2-CE 4.29Å; I66-M75 HydrophobicContact CG2-CG 3.89Å; I66-M75 HydrophobicContact CG2-SD 4.29Å; I66-L127 HydrophobicContact CD1-CB 4.13Å; I66-L127 HydrophobicContact CD1-CD1 4.01Å; I66-L127 HydrophobicContact CD1-CD2 4.09Å; I66-L127 HydrophobicContact CD1-CG 4.29Å
67	V	85.1	Confident	83.1	Confident	92 Å²	92	71.9 Å²	71.9	56%	0.558	43%	0.429	S	S	*	.	H	α-helix	trans	-65	-44.8	177.6	175.4	0	0	0	0	111.3	R63 A64 M65 A69 D70 M75	R63-V67 WeakPolarHBondContact O-CG2 3.34Å; R63-V67 PolarHBondContact O-N 3.47Å; R63-V67 VanDerWaalsContact O-N 3.09Å; A64-V67 PolarHBondContact O-N 2.97Å; M65-V67 VanDerWaalsContact C-N 3.32Å; M65-V67 PolarHBondContact O-N 2.85Å; V67-A69 VanDerWaalsContact C-N 3.29Å; V67-A69 PolarHBondContact O-N 3.12Å; V67-D70 PolarHBondContact O-N 3.46Å; V67-M75 HydrophobicContact CG2-CE 4.2Å
68	A	80.7	Confident	83.9	Confident	90 Å²	90	75.4 Å²	75.4	74%	0.744	44%	0.443	S	S	*	.	H	α-helix	trans	-66.4	-30.9	-179.3	0	0	0	0	0	113.3	A64 M65 D70	A64-A68 WeakPolarHBondContact O-CB 3.39Å; A64-A68 PolarHBondContact O-N 3Å; M65-A68 PolarHBondContact O-N 3.33Å; A68-D70 VanDerWaalsContact C-N 3.33Å
69	A	86.2	Confident	84	Confident	71 Å²	71	75.4 Å²	75.4	59%	0.587	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	1.9	178	0	0	0	0	0	113.5	M65 I66 V67 A71	M65-A69 WeakPolarHBondContact O-CB 3.16Å; M65-A69 PolarHBondContact O-N 3.03Å; I66-A69 PolarHBondContact O-N 3.31Å; V67-A69 VanDerWaalsContact C-N 3.29Å; V67-A69 PolarHBondContact O-N 3.12Å; A69-A71 HydrophobicContact CB-CB 4.38Å; A69-A71 PolarHBondContact O-N 3.05Å
70	D	86	Confident	83.9	Confident	137 Å²	137	76.3 Å²	76.3	73%	0.733	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	32.3	-173.3	-161.6	28.5	0	0	0	113.1	I66 V67 A68 V72	I66-D70 PolarHBondContact O-N 2.92Å; V67-D70 PolarHBondContact O-N 3.46Å; A68-D70 VanDerWaalsContact C-N 3.33Å; D70-V72 VanDerWaalsContact C-N 3.25Å; D70-V72 PolarHBondContact O-N 3.37Å
71	A	86.4	Confident	84.2	Confident	24 Å²	24	73.4 Å²	73.4	20%	0.198	45%	0.45	C	S	.	.			trans	-94.8	39.4	-179.8	0	0	0	0	0	111.3	I66 A69 D73 L74	I66-A71 HydrophobicContact CG2-CB 4.43Å; I66-A71 WeakPolarHBondContact CG2-O 3.16Å; I66-A71 PolarHBondContact O-N 2.85Å; A69-A71 HydrophobicContact CB-CB 4.38Å; A69-A71 PolarHBondContact O-N 3.05Å; A71-D73 VanDerWaalsContact C-OD1 3.24Å; A71-D73 PolarHBondContact O-N 2.9Å; A71-D73 VanDerWaalsContact O-N 3.07Å; A71-L74 HydrophobicContact CB-CD1 4.12Å; A71-L74 HydrophobicContact CB-CG 4.34Å; A71-L74 WeakPolarHBondContact O-CB 3.45Å; A71-L74 PolarHBondContact O-N 2.86Å
72	V	84.6	Confident	84.5	Confident	67 Å²	67	73.8 Å²	73.8	41%	0.406	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-61.6	-21.3	-170.3	-174.8	0	0	0	0	111.9	D70 L74 M75	D70-V72 VanDerWaalsContact C-N 3.25Å; D70-V72 PolarHBondContact O-N 3.37Å; V72-L74 PolarHBondContact O-N 3.39Å; V72-M75 HydrophobicContact CG1-CE 4.41Å; V72-M75 WeakPolarHBondContact O-CB 3.25Å; V72-M75 PolarHBondContact O-N 3.44Å
73	D	84.9	Confident	84.7	Confident	112 Å²	112	78.4 Å²	78.4	60%	0.599	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-63.9	-14.9	174.3	67.7	-40	0	0	0	114.5	A71 M75	A71-D73 VanDerWaalsContact C-OD1 3.24Å; A71-D73 PolarHBondContact O-N 2.9Å; A71-D73 VanDerWaalsContact O-N 3.07Å; D73-M75 VanDerWaalsContact C-N 3.27Å
74	L	84.8	Confident	85	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.12	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-79.7	-9.5	170.7	-59.4	-174.4	0	0	0	113.3	I66 A71 V72 S126 L127 Y130 L165	I66-L74 HydrophobicContact CD1-CB 4.07Å; I66-L74 HydrophobicContact CG1-CB 4.36Å; I66-L74 HydrophobicContact CG1-CD1 4.3Å; A71-L74 HydrophobicContact CB-CD1 4.12Å; A71-L74 HydrophobicContact CB-CG 4.34Å; A71-L74 WeakPolarHBondContact O-CB 3.45Å; A71-L74 PolarHBondContact O-N 2.86Å; V72-L74 PolarHBondContact O-N 3.39Å; L74-S126 WeakPolarHBondContact O-CA 3.23Å; L74-L127 PolarHBondContact O-N 3.35Å; L74-Y130 HydrophobicContact CD1-CE2 4.4Å; L74-Y130 HydrophobicContact CD2-CE2 3.78Å; L74-L165 HydrophobicContact CD1-CD1 4.27Å; L74-L165 HydrophobicContact CD2-CD1 4.34Å
75	M	86.5	Confident	85.4	Confident	44 Å²	44	76 Å²	76	22%	0.217	44%	0.443	C	S	.	.	S	Bend	trans	-105.1	150.7	174.6	-65.5	-158.5	-58.2	0	0	111.2	I66 V67 V72 D73	I66-M75 HydrophobicContact CD1-CG 4.23Å; I66-M75 HydrophobicContact CG2-CE 4.29Å; I66-M75 HydrophobicContact CG2-CG 3.89Å; I66-M75 HydrophobicContact CG2-SD 4.29Å; V67-M75 HydrophobicContact CG2-CE 4.2Å; V72-M75 HydrophobicContact CG1-CE 4.41Å; V72-M75 WeakPolarHBondContact O-CB 3.25Å; V72-M75 PolarHBondContact O-N 3.44Å; D73-M75 VanDerWaalsContact C-N 3.27Å
76	P	82.6	Confident	85.8	Confident	32 Å²	32	71.9 Å²	71.9	21%	0.208	42%	0.424	C	S	.	.			trans	-73.4	144	175.7	27.6	-31.1	0	0	0	112.1	A81 F82 V85	P76-A81 HydrophobicContact CB-CB 3.36Å; P76-A81 HydrophobicContact CG-CB 4.12Å; P76-F82 HydrophobicContact CG-CB 4.11Å; P76-F82 HydrophobicContact CG-CD2 4.27Å; P76-V85 HydrophobicContact CG-CG2 3.97Å
77	D	78.9	Confident	86.1	Confident	170 Å²	170	74.6 Å²	74.6	91%	0.909	44%	0.444	S	S	*	.	S	Bend	trans	-76.7	-28.6	175.4	-61.3	-44.4	0	0	0	112.8
78	E	82.7	Confident	86.6	Confident	137 Å²	137	71.3 Å²	71.3	64%	0.64	42%	0.421	S	S	*	.	S	Bend	trans	-100.3	135.9	-174.9	-170.6	177.1	-178.4	0	0	111.7	A80 A81 F82	E78-A80 HydrophobicContact CG-CB 4.34Å; E78-A80 PolarHBondContact O-N 3.02Å; E78-A81 WeakPolarHBondContact O-CB 3.47Å; E78-A81 PolarHBondContact O-N 3.01Å; E78-F82 PolarHBondContact O-N 3.49Å; E78-F82 VanDerWaalsContact O-N 3.17Å
79	C	80.5	Confident	87.3	Confident	109 Å²	109	67.5 Å²	67.5	74%	0.736	39%	0.389	S	S	*	.	H	α-helix	trans	-55.3	-37.5	-179.9	-60.5	0	0	0	0	113.3	A81 F82 I83	C79-A81 VanDerWaalsContact C-N 3.28Å; C79-A81 PolarHBondContact O-N 2.8Å; C79-F82 WeakPolarHBondContact O-CB 3.38Å; C79-F82 PolarHBondContact O-N 2.9Å; C79-F82 VanDerWaalsContact O-N 3.14Å; C79-I83 PolarHBondContact O-N 3.46Å
80	A	81.8	Confident	87.6	Confident	59 Å²	59	70.4 Å²	70.4	49%	0.488	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-37.7	177.8	0	0	0	0	0	112.1	E78 F82 I83 E84	E78-A80 HydrophobicContact CG-CB 4.34Å; E78-A80 PolarHBondContact O-N 3.02Å; A80-F82 VanDerWaalsContact C-N 3.32Å; A80-I83 PolarHBondContact O-N 3.05Å; A80-E84 PolarHBondContact O-N 2.94Å
81	A	87.3	Confident	88	Confident	21 Å²	21	64.9 Å²	64.9	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-72.8	-26.6	176.7	0	0	0	0	0	111.9	P76 E78 C79 E84 V85 V121	P76-A81 HydrophobicContact CB-CB 3.36Å; P76-A81 HydrophobicContact CG-CB 4.12Å; E78-A81 WeakPolarHBondContact O-CB 3.47Å; E78-A81 PolarHBondContact O-N 3.01Å; C79-A81 VanDerWaalsContact C-N 3.28Å; C79-A81 PolarHBondContact O-N 2.8Å; A81-E84 PolarHBondContact O-N 3.18Å; A81-V85 WeakPolarHBondContact O-CG2 3.46Å; A81-V85 PolarHBondContact O-N 3.07Å; A81-V121 HydrophobicContact CB-CG1 3.73Å
82	F	87.7	Confident	88.4	Confident	74 Å²	74	63.8 Å²	63.8	33%	0.325	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-45.5	171.8	-163.1	-85.7	0	0	0	112	P76 E78 C79 A80 E84 V85 D86	P76-F82 HydrophobicContact CG-CB 4.11Å; P76-F82 HydrophobicContact CG-CD2 4.27Å; E78-F82 PolarHBondContact O-N 3.49Å; E78-F82 VanDerWaalsContact O-N 3.17Å; C79-F82 WeakPolarHBondContact O-CB 3.38Å; C79-F82 PolarHBondContact O-N 2.9Å; C79-F82 VanDerWaalsContact O-N 3.14Å; A80-F82 VanDerWaalsContact C-N 3.32Å; F82-E84 PolarHBondContact O-N 3.34Å; F82-V85 PolarHBondContact O-N 2.93Å; F82-D86 WeakPolarHBondContact CE1-OD2 3.42Å; F82-D86 PolarHBondContact O-N 3.22Å
83	I	90	Very high	88.8	Confident	126 Å²	126	65.3 Å²	65.3	65%	0.646	36%	0.357	S	S	*	.	H	α-helix	trans	-59.9	-40.1	175.7	-61.1	169.9	0	0	0	110.4	C79 A80 D86 S87	C79-I83 PolarHBondContact O-N 3.46Å; A80-I83 PolarHBondContact O-N 3.05Å; I83-D86 PolarHBondContact O-N 2.84Å; I83-S87 PolarHBondContact O-N 3.41Å
84	E	92.9	Very high	89.2	Confident	54 Å²	54	63.1 Å²	63.1	25%	0.252	35%	0.345	S	S	.	.	H	α-helix	trans	-65.6	-45.8	178.1	-158.7	-172.6	151.9	0	0	111.7	A80 A81 F82 D86 S87 W88 R113 V121	A80-E84 PolarHBondContact O-N 2.94Å; A81-E84 PolarHBondContact O-N 3.18Å; F82-E84 PolarHBondContact O-N 3.34Å; E84-D86 PolarHBondContact O-N 3.49Å; E84-S87 PolarHBondContact O-N 3.45Å; E84-W88 PolarHBondContact O-N 2.99Å; E84-W88 VanDerWaalsContact O-N 3.13Å; E84-W88 PolarHBondContact OE1-NE1 3.14Å; E84-R113 IonicContact OE1-CZ 3.25Å; E84-R113 VanDerWaalsContact OE1-CZ 3.25Å; E84-R113 IonicContact OE1-NE 3.33Å; E84-R113 PolarHBondContact OE1-NE 3.22Å; E84-R113 IonicContact OE1-NH2 2.61Å; E84-R113 PolarHBondContact OE1-NH2 2.89Å; E84-R113 IonicContact OE2-NH2 3.12Å; E84-R113 PolarHBondContact OE2-NH2 2.85Å; E84-R113 VanDerWaalsContact OE2-NH2 3.12Å; E84-V121 HydrophobicContact CB-CG1 4.22Å; E84-V121 HydrophobicContact CB-CG2 4.04Å; E84-V121 HydrophobicContact CG-CG2 3.91Å
85	V	93.7	Very high	89.6	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-55.2	-44.1	175.1	166.3	0	0	0	0	110.7	P76 A81 F82 S87 W88 L89 V121 L127 A128	P76-V85 HydrophobicContact CG-CG2 3.97Å; A81-V85 WeakPolarHBondContact O-CG2 3.46Å; A81-V85 PolarHBondContact O-N 3.07Å; F82-V85 PolarHBondContact O-N 2.93Å; V85-S87 PolarHBondContact O-N 3.15Å; V85-W88 PolarHBondContact O-N 2.85Å; V85-L89 HydrophobicContact CG1-CD1 3.69Å; V85-L89 HydrophobicContact CG1-CG 4.32Å; V85-L89 VanDerWaalsContact O-CG 3.29Å; V85-L89 WeakPolarHBondContact O-CG 3.42Å; V85-L89 PolarHBondContact O-N 3.41Å; V85-V121 HydrophobicContact CG2-CB 4.02Å; V85-V121 HydrophobicContact CG2-CG1 4.1Å; V85-V121 HydrophobicContact CG2-CG2 3.78Å; V85-L127 HydrophobicContact CG1-CB 4.39Å; V85-A128 HydrophobicContact CB-CB 4.45Å; V85-A128 HydrophobicContact CG1-CB 4.2Å; V85-A128 HydrophobicContact CG2-CB 4.31Å
86	D	92.3	Very high	89.8	Confident	52 Å²	52	64.8 Å²	64.8	28%	0.278	35%	0.35	S	S	.	.	H	α-helix	trans	-64.7	-41	-179.1	-75.1	18.8	0	0	0	112.4	R63 F82 I83 E84 W88 L89 E90	R63-D86 IonicContact CZ-OD1 3.94Å; R63-D86 IonicContact CZ-OD2 2.84Å; R63-D86 IonicContact NH2-OD1 2.86Å; R63-D86 PolarHBondContact NH2-OD1 3.37Å; R63-D86 IonicContact NH2-OD2 2.66Å; R63-D86 PolarHBondContact NH2-OD2 2.9Å; F82-D86 WeakPolarHBondContact CE1-OD2 3.42Å; F82-D86 PolarHBondContact O-N 3.22Å; I83-D86 PolarHBondContact O-N 2.84Å; E84-D86 PolarHBondContact O-N 3.49Å; D86-W88 VanDerWaalsContact C-N 3.28Å; D86-W88 PolarHBondContact O-N 3.19Å; D86-L89 PolarHBondContact O-N 3.31Å; D86-E90 PolarHBondContact O-N 2.95Å
87	S	93.5	Very high	90.1	Very high	69 Å²	69	66.8 Å²	66.8	48%	0.483	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-38.4	174.7	-174.8	0	0	0	0	112.1	I83 E84 V85 L91	I83-S87 PolarHBondContact O-N 3.41Å; E84-S87 PolarHBondContact O-N 3.45Å; V85-S87 PolarHBondContact O-N 3.15Å; S87-L91 PolarHBondContact O-N 3.41Å
88	W	95.5	Very high	90.8	Very high	22 Å²	22	59.7 Å²	59.7	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-71.7	-33.5	175.9	-68.6	115.9	0	0	0	113.1	E84 V85 D86 L91 A92 L110 R113 L120 A128	E84-W88 PolarHBondContact O-N 2.99Å; E84-W88 VanDerWaalsContact O-N 3.13Å; E84-W88 PolarHBondContact OE1-NE1 3.14Å; V85-W88 PolarHBondContact O-N 2.85Å; D86-W88 VanDerWaalsContact C-N 3.28Å; D86-W88 PolarHBondContact O-N 3.19Å; W88-L91 HydrophobicContact CE3-CD1 4.13Å; W88-L91 HydrophobicContact CZ3-CD1 3.86Å; W88-L91 PolarHBondContact O-N 3.06Å; W88-A92 WeakPolarHBondContact O-CB 3.32Å; W88-A92 PolarHBondContact O-N 3.27Å; W88-L110 HydrophobicContact CE3-CD1 4.35Å; W88-L110 HydrophobicContact CH2-CD1 4.43Å; W88-L110 HydrophobicContact CZ3-CD1 3.76Å; W88-R113 HydrophobicContact CH2-CB 3.73Å; W88-R113 HydrophobicContact CH2-CG 3.57Å; W88-R113 HydrophobicContact CZ2-CB 4.11Å; W88-R113 HydrophobicContact CZ2-CG 3.41Å; W88-R113 VanDerWaalsContact CZ2-CG 3.41Å; W88-L120 HydrophobicContact CB-CD1 4.26Å; W88-L120 HydrophobicContact CD2-CB 4.43Å; W88-L120 HydrophobicContact CD2-CD1 4.22Å; W88-L120 HydrophobicContact CD2-CD2 4.01Å; W88-L120 HydrophobicContact CD2-CG 4.46Å; W88-L120 HydrophobicContact CE3-CD1 4.47Å; W88-L120 HydrophobicContact CE3-CD2 4.04Å; W88-L120 HydrophobicContact CG-CB 4.3Å; W88-L120 HydrophobicContact CG-CD1 4.08Å; W88-L120 HydrophobicContact CH2-CD2 4.42Å; W88-L120 HydrophobicContact CZ2-CD2 4.39Å; W88-L120 HydrophobicContact CZ3-CD2 4.23Å; W88-A128 HydrophobicContact CB-CB 3.62Å; W88-A128 HydrophobicContact CG-CB 4.23Å
89	L	94.2	Very high	91.3	Very high	11 Å²	11	57 Å²	57	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-66.5	-40.6	175.2	-70.5	164.4	0	0	0	111.4	V59 V85 D86 A92 D93 L127 A131	V59-L89 HydrophobicContact CG1-CD1 3.71Å; V59-L89 HydrophobicContact CG2-CB 4.3Å; V59-L89 HydrophobicContact CG2-CD2 4.24Å; V85-L89 HydrophobicContact CG1-CD1 3.69Å; V85-L89 HydrophobicContact CG1-CG 4.32Å; V85-L89 VanDerWaalsContact O-CG 3.29Å; V85-L89 WeakPolarHBondContact O-CG 3.42Å; V85-L89 PolarHBondContact O-N 3.41Å; D86-L89 PolarHBondContact O-N 3.31Å; L89-A92 WeakPolarHBondContact O-CB 3.49Å; L89-A92 PolarHBondContact O-N 3.48Å; L89-D93 PolarHBondContact O-N 2.86Å; L89-D93 VanDerWaalsContact O-N 3.11Å; L89-L127 HydrophobicContact CD1-CD2 4.06Å; L89-L127 HydrophobicContact CD1-CG 4.33Å; L89-L127 HydrophobicContact CD2-CG 4.1Å; L89-A131 HydrophobicContact CD2-CB 3.33Å
90	E	93.5	Very high	91.9	Very high	132 Å²	132	57.3 Å²	57.3	62%	0.617	33%	0.325	S	S	*	.	H	α-helix	trans	-62.2	-45.5	172.5	-174.6	175	-166.4	0	0	111.1	D86 A92 D93 I94	D86-E90 PolarHBondContact O-N 2.95Å; E90-A92 VanDerWaalsContact C-N 3.31Å; E90-A92 PolarHBondContact O-N 2.89Å; E90-D93 PolarHBondContact O-N 3.39Å; E90-D93 VanDerWaalsContact O-N 3.14Å; E90-I94 HydrophobicContact CG-CD1 4.06Å; E90-I94 WeakPolarHBondContact O-CG1 3.21Å; E90-I94 PolarHBondContact O-N 3.38Å
91	L	94.9	Very high	92.5	Very high	20 Å²	20	64 Å²	64	11%	0.105	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-42.7	175.2	-173.6	152.8	0	0	0	111.6	S87 W88 D93 I94 L95 L132	S87-L91 PolarHBondContact O-N 3.41Å; W88-L91 HydrophobicContact CE3-CD1 4.13Å; W88-L91 HydrophobicContact CZ3-CD1 3.86Å; W88-L91 PolarHBondContact O-N 3.06Å; L91-D93 VanDerWaalsContact C-N 3.26Å; L91-D93 PolarHBondContact O-N 3.45Å; L91-I94 PolarHBondContact O-N 3.23Å; L91-L95 HydrophobicContact CD2-CD1 3.6Å; L91-L95 HydrophobicContact CD2-CD2 4.43Å; L91-L95 HydrophobicContact CD2-CG 3.8Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 2.99Å; L91-L132 HydrophobicContact CD2-CD1 3.52Å
92	A	94.5	Very high	92.9	Very high	2 Å²	2	66.9 Å²	66.9	2%	0.017	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-39.6	177.5	0	0	0	0	0	111.6	W88 L89 E90 A131 L132 S135	W88-A92 WeakPolarHBondContact O-CB 3.32Å; W88-A92 PolarHBondContact O-N 3.27Å; L89-A92 WeakPolarHBondContact O-CB 3.49Å; L89-A92 PolarHBondContact O-N 3.48Å; E90-A92 VanDerWaalsContact C-N 3.31Å; E90-A92 PolarHBondContact O-N 2.89Å; A92-A131 HydrophobicContact CB-CB 4.26Å; A92-L132 HydrophobicContact CB-CD1 4.2Å; A92-S135 WeakPolarHBondContact O-CB 3.3Å; A92-S135 PolarHBondContact O-OG 3.39Å; A92-S135 VanDerWaalsContact O-OG 3.08Å
93	D	92.3	Very high	93.3	Very high	99 Å²	99	63.9 Å²	63.9	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-69.4	-43.2	176	-156.6	53.7	0	0	0	112.6	L89 E90 L91 L95 K96	L89-D93 PolarHBondContact O-N 2.86Å; L89-D93 VanDerWaalsContact O-N 3.11Å; E90-D93 PolarHBondContact O-N 3.39Å; E90-D93 VanDerWaalsContact O-N 3.14Å; L91-D93 VanDerWaalsContact C-N 3.26Å; L91-D93 PolarHBondContact O-N 3.45Å; D93-L95 VanDerWaalsContact C-N 3.27Å; D93-L95 PolarHBondContact O-N 3.12Å; D93-K96 WeakPolarHBondContact O-CB 3.43Å; D93-K96 PolarHBondContact O-N 3.13Å; D93-K96 IonicContact OD1-NZ 3.71Å; D93-K96 PolarHBondContact OD1-NZ 3.18Å
94	I	93.3	Very high	93.5	Very high	65 Å²	65	58.5 Å²	58.5	33%	0.333	31%	0.31	S	S	.	.	H	α-helix	trans	-56.5	-41.7	175.2	-67.6	166.2	0	0	0	111	E90 L91 K96 G97 C98	E90-I94 HydrophobicContact CG-CD1 4.06Å; E90-I94 WeakPolarHBondContact O-CG1 3.21Å; E90-I94 PolarHBondContact O-N 3.38Å; L91-I94 PolarHBondContact O-N 3.23Å; I94-K96 PolarHBondContact O-N 3.38Å; I94-K96 VanDerWaalsContact O-N 3.1Å; I94-G97 PolarHBondContact O-N 3.23Å; I94-G97 VanDerWaalsContact O-N 3.1Å; I94-C98 HydrophobicContact CG2-CB 3.96Å; I94-C98 WeakPolarHBondContact O-CB 3.44Å; I94-C98 PolarHBondContact O-N 3.05Å; I94-C98 PolarHBondContact O-SG 3.47Å
95	L	93.6	Very high	93.7	Very high	9 Å²	9	58.6 Å²	58.6	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-58.9	-24.6	179.4	-73.6	-179.5	0	0	0	113.6	L91 D93 G97 L103 H106 L132 L136	L91-L95 HydrophobicContact CD2-CD1 3.6Å; L91-L95 HydrophobicContact CD2-CD2 4.43Å; L91-L95 HydrophobicContact CD2-CG 3.8Å; L91-L95 WeakPolarHBondContact O-CG 3.45Å; L91-L95 PolarHBondContact O-N 2.99Å; D93-L95 VanDerWaalsContact C-N 3.27Å; D93-L95 PolarHBondContact O-N 3.12Å; L95-G97 VanDerWaalsContact C-N 3.32Å; L95-G97 PolarHBondContact O-N 3.07Å; L95-L103 HydrophobicContact CD2-CD1 3.56Å; L95-H106 HydrophobicContact CD2-CB 3.91Å; L95-L132 HydrophobicContact CD1-CD1 3.55Å; L95-L136 HydrophobicContact CD1-CD2 4.08Å; L95-L136 HydrophobicContact CD1-CG 4.5Å
96	K	90.4	Very high	93.9	Very high	93 Å²	93	60.9 Å²	60.9	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-73.1	-24.4	-179.8	-58.7	171.4	-165.1	160.6	0	112.9	D93 I94	D93-K96 WeakPolarHBondContact O-CB 3.43Å; D93-K96 PolarHBondContact O-N 3.13Å; D93-K96 IonicContact OD1-NZ 3.71Å; D93-K96 PolarHBondContact OD1-NZ 3.18Å; I94-K96 PolarHBondContact O-N 3.38Å; I94-K96 VanDerWaalsContact O-N 3.1Å
97	G	89.3	Confident	94.1	Very high	74 Å²	74	58.6 Å²	58.6	76%	0.763	31%	0.31	S	S	*	.	H	α-helix	trans	-130.9	-9.6	-170.6	0	0	0	0	0	116.5	I94 L95	I94-G97 PolarHBondContact O-N 3.23Å; I94-G97 VanDerWaalsContact O-N 3.1Å; L95-G97 VanDerWaalsContact C-N 3.32Å; L95-G97 PolarHBondContact O-N 3.07Å
98	C	92.5	Very high	94.3	Very high	22 Å²	22	61.2 Å²	61.2	15%	0.149	31%	0.31	C	S	.	.			trans	-65.8	156.1	-178.3	64.9	0	0	0	0	113.8	I94 E102	I94-C98 HydrophobicContact CG2-CB 3.96Å; I94-C98 WeakPolarHBondContact O-CB 3.44Å; I94-C98 PolarHBondContact O-N 3.05Å; I94-C98 PolarHBondContact O-SG 3.47Å; C98-E102 HydrophobicContact CB-CB 3.84Å; C98-E102 WeakPolarHBondContact CB-OE2 3.3Å
99	N	94.5	Very high	94.3	Very high	80 Å²	80	64 Å²	64	43%	0.428	33%	0.329	S	S	.	.			trans	-76.5	171.1	176.4	66.8	47.9	0	0	0	111.8	W101 E102 L103	N99-W101 VanDerWaalsContact C-N 3.27Å; N99-W101 PolarHBondContact O-N 3.23Å; N99-W101 WeakPolarHBondContact OD1-CB 3.35Å; N99-W101 PolarHBondContact OD1-N 2.56Å; N99-W101 VanDerWaalsContact OD1-N 3.1Å; N99-E102 VanDerWaalsContact CG-CD 3.42Å; N99-E102 VanDerWaalsContact CG-OE2 3.25Å; N99-E102 PolarHBondContact N-OE2 3.06Å; N99-E102 PolarHBondContact ND2-OE1 3.33Å; N99-E102 PolarHBondContact ND2-OE2 3.38Å; N99-E102 VanDerWaalsContact ND2-OE2 3.14Å; N99-E102 PolarHBondContact O-N 2.9Å; N99-E102 WeakPolarHBondContact OD1-CB 3.4Å; N99-E102 WeakPolarHBondContact OD1-CG 3.4Å; N99-E102 PolarHBondContact OD1-N 2.96Å; N99-L103 WeakPolarHBondContact O-CB 3.01Å; N99-L103 PolarHBondContact O-N 3.2Å
100	N	92.7	Very high	94.4	Very high	116 Å²	116	63.4 Å²	63.4	62%	0.62	33%	0.326	S	S	*	.	H	α-helix	trans	-60.2	-34.1	-176.4	-74.4	-23.7	0	0	0	113.9	G104 K143	N100-G104 PolarHBondContact O-N 3.22Å; N100-G104 VanDerWaalsContact O-N 3.09Å; N100-K143 PolarHBondContact OD1-NZ 2.98Å
101	W	94.4	Very high	94.6	Very high	200 Å²	200	58.7 Å²	58.7	76%	0.758	31%	0.305	S	S	*	.	H	α-helix	trans	-71.1	-51	-179.5	172.3	-87.7	0	0	0	111	N99 L103 G104 N105	N99-W101 VanDerWaalsContact C-N 3.27Å; N99-W101 PolarHBondContact O-N 3.23Å; N99-W101 WeakPolarHBondContact OD1-CB 3.35Å; N99-W101 PolarHBondContact OD1-N 2.56Å; N99-W101 VanDerWaalsContact OD1-N 3.1Å; W101-L103 VanDerWaalsContact C-N 3.32Å; W101-L103 PolarHBondContact O-N 3.34Å; W101-G104 PolarHBondContact O-N 2.85Å; W101-N105 PolarHBondContact NE1-ND2 3.49Å; W101-N105 PolarHBondContact O-N 3.4Å; W101-N105 VanDerWaalsContact O-N 3.12Å
102	E	95.5	Very high	94.7	Very high	80 Å²	80	64 Å²	64	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-57.5	-47.1	174.3	-73.3	160.4	-175.5	0	0	110.9	C98 N99 G104 N105 H106	C98-E102 HydrophobicContact CB-CB 3.84Å; C98-E102 WeakPolarHBondContact CB-OE2 3.3Å; N99-E102 VanDerWaalsContact CG-CD 3.42Å; N99-E102 VanDerWaalsContact CG-OE2 3.25Å; N99-E102 PolarHBondContact N-OE2 3.06Å; N99-E102 PolarHBondContact ND2-OE1 3.33Å; N99-E102 PolarHBondContact ND2-OE2 3.38Å; N99-E102 VanDerWaalsContact ND2-OE2 3.14Å; N99-E102 PolarHBondContact O-N 2.9Å; N99-E102 WeakPolarHBondContact OD1-CB 3.4Å; N99-E102 WeakPolarHBondContact OD1-CG 3.4Å; N99-E102 PolarHBondContact OD1-N 2.96Å; E102-G104 VanDerWaalsContact C-N 3.28Å; E102-G104 PolarHBondContact O-N 3.3Å; E102-N105 WeakPolarHBondContact O-CA 3.19Å; E102-N105 WeakPolarHBondContact O-CB 3.47Å; E102-N105 PolarHBondContact O-N 3.44Å; E102-H106 PolarHBondContact O-CD2 3.49Å; E102-H106 PolarHBondContact O-N 2.89Å
103	L	95.3	Very high	94.7	Very high	12 Å²	12	67.5 Å²	67.5	6%	0.063	34%	0.342	C	S	.	.	H	α-helix	trans	-54.1	-46.5	176.8	178.5	61.4	0	0	0	111.3	L95 N99 W101 N105 H106 L107 L139	L95-L103 HydrophobicContact CD2-CD1 3.56Å; N99-L103 WeakPolarHBondContact O-CB 3.01Å; N99-L103 PolarHBondContact O-N 3.2Å; W101-L103 VanDerWaalsContact C-N 3.32Å; W101-L103 PolarHBondContact O-N 3.34Å; L103-N105 VanDerWaalsContact C-N 3.3Å; L103-N105 PolarHBondContact O-N 2.96Å; L103-H106 PolarHBondContact O-N 3.1Å; L103-L107 HydrophobicContact CD1-CD1 3.87Å; L103-L107 HydrophobicContact CD1-CG 3.94Å; L103-L107 HydrophobicContact CG-CD1 3.9Å; L103-L107 HydrophobicContact CG-CG 4.35Å; L103-L107 WeakPolarHBondContact O-CB 3.47Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.39Å; L103-L107 PolarHBondContact O-N 3.07Å; L103-L139 HydrophobicContact CD1-CD2 3.7Å; L103-L139 HydrophobicContact CD2-CD1 3.77Å; L103-L139 HydrophobicContact CD2-CD2 4.06Å; L103-L139 HydrophobicContact CG-CD2 4.4Å
104	G	95.5	Very high	94.9	Very high	13 Å²	13	63 Å²	63	13%	0.134	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-37	176.8	0	0	0	0	0	113.2	N100 W101 E102 R108 Y150	N100-G104 PolarHBondContact O-N 3.22Å; N100-G104 VanDerWaalsContact O-N 3.09Å; W101-G104 PolarHBondContact O-N 2.85Å; E102-G104 VanDerWaalsContact C-N 3.28Å; E102-G104 PolarHBondContact O-N 3.3Å; G104-R108 WeakPolarHBondContact O-CB 3.33Å; G104-R108 PolarHBondContact O-N 3.17Å; G104-Y150 WeakPolarHBondContact CA-OH 3.22Å; G104-Y150 PolarHBondContact O-OH 2.93Å
105	N	96.8	Very high	95	Very high	56 Å²	56	65.3 Å²	65.3	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-70.4	-46.9	176.5	-67.7	-25.5	0	0	0	111.9	W101 E102 L103 L107 R108 T109	W101-N105 PolarHBondContact NE1-ND2 3.49Å; W101-N105 PolarHBondContact O-N 3.4Å; W101-N105 VanDerWaalsContact O-N 3.12Å; E102-N105 WeakPolarHBondContact O-CA 3.19Å; E102-N105 WeakPolarHBondContact O-CB 3.47Å; E102-N105 PolarHBondContact O-N 3.44Å; L103-N105 VanDerWaalsContact C-N 3.3Å; L103-N105 PolarHBondContact O-N 2.96Å; N105-L107 PolarHBondContact O-N 3.42Å; N105-R108 PolarHBondContact O-N 2.81Å; N105-R108 PolarHBondContact OD1-NH1 3.44Å; N105-T109 PolarHBondContact O-N 3.23Å; N105-T109 PolarHBondContact O-OG1 3.36Å
106	H	96.8	Very high	94.9	Very high	52 Å²	52	68.4 Å²	68.4	24%	0.241	37%	0.366	C	S	.	.	H	α-helix	trans	-62	-43.7	177.6	-67.2	-59.6	0	0	0	111.7	L95 E102 L103 R108 T109 L110	L95-H106 HydrophobicContact CD2-CB 3.91Å; E102-H106 PolarHBondContact O-CD2 3.49Å; E102-H106 PolarHBondContact O-N 2.89Å; L103-H106 PolarHBondContact O-N 3.1Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.39Å; H106-T109 PolarHBondContact O-N 2.89Å; H106-L110 VanDerWaalsContact O-CB 3.25Å; H106-L110 WeakPolarHBondContact O-CB 3.44Å; H106-L110 PolarHBondContact O-N 3.07Å
107	L	97	Very high	95	Very high	3 Å²	3	69.1 Å²	69.1	2%	0.016	37%	0.365	C	S	.	.	H	α-helix	trans	-64.9	-35.7	176.3	-70.6	177.8	0	0	0	112.3	L103 N105 L110 N111 L136 L139 L147 Y150	L103-L107 HydrophobicContact CD1-CD1 3.87Å; L103-L107 HydrophobicContact CD1-CG 3.94Å; L103-L107 HydrophobicContact CG-CD1 3.9Å; L103-L107 HydrophobicContact CG-CG 4.35Å; L103-L107 WeakPolarHBondContact O-CB 3.47Å; L103-L107 VanDerWaalsContact O-CG 3.25Å; L103-L107 WeakPolarHBondContact O-CG 3.39Å; L103-L107 PolarHBondContact O-N 3.07Å; N105-L107 PolarHBondContact O-N 3.42Å; L107-L110 HydrophobicContact CD2-CD2 4.44Å; L107-N111 WeakPolarHBondContact O-CB 3.25Å; L107-N111 PolarHBondContact O-N 3.27Å; L107-L136 HydrophobicContact CD2-CD2 3.76Å; L107-L139 HydrophobicContact CD1-CD2 4.29Å; L107-L147 HydrophobicContact CD1-CD2 4.14Å; L107-L147 HydrophobicContact CD2-CD2 3.86Å; L107-Y150 HydrophobicContact CB-CD1 3.9Å; L107-Y150 HydrophobicContact CB-CD2 3.98Å; L107-Y150 HydrophobicContact CB-CE1 3.62Å; L107-Y150 HydrophobicContact CB-CE2 3.7Å; L107-Y150 HydrophobicContact CB-CG 4.07Å; L107-Y150 HydrophobicContact CD1-CD2 3.94Å; L107-Y150 HydrophobicContact CD1-CE2 3.55Å; L107-Y150 HydrophobicContact CG-CE2 4.27Å
108	R	97.3	Very high	95	Very high	124 Å²	124	70.5 Å²	70.5	47%	0.468	36%	0.355	S	S	.	.	H	α-helix	trans	-64.2	-47.9	174.7	-171.1	-176.6	-59	112.2	3.2	111.5	G104 N105 H106 N111 Q112 Y150	G104-R108 WeakPolarHBondContact O-CB 3.33Å; G104-R108 PolarHBondContact O-N 3.17Å; N105-R108 PolarHBondContact O-N 2.81Å; N105-R108 PolarHBondContact OD1-NH1 3.44Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.39Å; R108-N111 PolarHBondContact O-N 3.08Å; R108-Q112 WeakPolarHBondContact O-CG 3.45Å; R108-Q112 PolarHBondContact O-N 3.44Å; R108-Q112 VanDerWaalsContact O-N 3.07Å; R108-Y150 HydrophobicContact CB-CE1 4.27Å
109	T	96.2	Very high	94.9	Very high	80 Å²	80	69.7 Å²	69.7	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-45.3	177.5	-59.1	0	0	0	0	111.1	N105 H106 N111 Q112 R113	N105-T109 PolarHBondContact O-N 3.23Å; N105-T109 PolarHBondContact O-OG1 3.36Å; H106-T109 PolarHBondContact O-N 2.89Å; T109-N111 PolarHBondContact O-N 3.45Å; T109-Q112 PolarHBondContact O-N 2.97Å; T109-R113 PolarHBondContact O-N 3.37Å
110	L	96.8	Very high	94.9	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-44.7	176.6	176.4	60.7	0	0	0	111.8	W88 H106 L107 Q112 R113 L114 L120 L132 L136 V153	W88-L110 HydrophobicContact CE3-CD1 4.35Å; W88-L110 HydrophobicContact CH2-CD1 4.43Å; W88-L110 HydrophobicContact CZ3-CD1 3.76Å; H106-L110 VanDerWaalsContact O-CB 3.25Å; H106-L110 WeakPolarHBondContact O-CB 3.44Å; H106-L110 PolarHBondContact O-N 3.07Å; L107-L110 HydrophobicContact CD2-CD2 4.44Å; L110-Q112 VanDerWaalsContact C-N 3.26Å; L110-Q112 PolarHBondContact O-N 3.47Å; L110-R113 PolarHBondContact O-N 3.46Å; L110-R113 VanDerWaalsContact O-N 3.11Å; L110-L114 HydrophobicContact CD1-CD1 3.74Å; L110-L114 HydrophobicContact CD1-CG 4.02Å; L110-L114 HydrophobicContact CG-CD1 3.84Å; L110-L114 WeakPolarHBondContact O-CG 3.48Å; L110-L114 PolarHBondContact O-N 3.33Å; L110-L120 HydrophobicContact CD1-CD2 3.75Å; L110-L132 HydrophobicContact CD1-CD2 3.41Å; L110-L132 VanDerWaalsContact CD1-CD2 3.41Å; L110-L132 HydrophobicContact CD2-CD1 4.31Å; L110-L132 HydrophobicContact CD2-CD2 3.7Å; L110-L132 HydrophobicContact CD2-CG 4.32Å; L110-L132 HydrophobicContact CG-CD2 4.17Å; L110-L136 HydrophobicContact CD2-CD1 4.16Å; L110-L136 HydrophobicContact CD2-CD2 4.32Å; L110-V153 HydrophobicContact CD2-CG1 4.01Å; L110-V153 HydrophobicContact CD2-CG2 4.08Å; L110-V153 HydrophobicContact CG-CG2 4.02Å
111	N	97.2	Very high	94.8	Very high	33 Å²	33	60.8 Å²	60.8	18%	0.176	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-34.8	178.5	-170.5	68.4	0	0	0	112.3	L107 R108 T109 Y150 A151 N152 V153	L107-N111 WeakPolarHBondContact O-CB 3.25Å; L107-N111 PolarHBondContact O-N 3.27Å; R108-N111 PolarHBondContact O-N 3.08Å; T109-N111 PolarHBondContact O-N 3.45Å; N111-Y150 HydrophobicContact CB-CD1 3.98Å; N111-Y150 WeakPolarHBondContact OD1-CA 3.34Å; N111-Y150 PolarHBondContact OD1-O 2.8Å; N111-A151 PolarHBondContact OD1-N 3.02Å; N111-N152 WeakPolarHBondContact O-CB 3.33Å; N111-N152 PolarHBondContact O-ND2 3.14Å; N111-N152 WeakPolarHBondContact OD1-CA 3.4Å; N111-N152 VanDerWaalsContact OD1-CB 3.28Å; N111-N152 WeakPolarHBondContact OD1-CB 3.45Å; N111-N152 PolarHBondContact OD1-N 2.88Å; N111-V153 HydrophobicContact CB-CG2 3.75Å; N111-V153 PolarHBondContact OD1-N 2.98Å
112	Q	96.7	Very high	94.5	Very high	131 Å²	131	54.7 Å²	54.7	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-69.8	-42.9	172.8	-70.4	173.8	4.4	0	0	111.6	R108 T109 L110 L114 N115	R108-Q112 WeakPolarHBondContact O-CG 3.45Å; R108-Q112 PolarHBondContact O-N 3.44Å; R108-Q112 VanDerWaalsContact O-N 3.07Å; T109-Q112 PolarHBondContact O-N 2.97Å; L110-Q112 VanDerWaalsContact C-N 3.26Å; L110-Q112 PolarHBondContact O-N 3.47Å; Q112-L114 VanDerWaalsContact C-N 3.3Å; Q112-L114 PolarHBondContact O-N 3.21Å; Q112-N115 WeakPolarHBondContact O-CB 3.32Å; Q112-N115 PolarHBondContact O-N 2.88Å; Q112-N115 VanDerWaalsContact O-N 3.16Å
113	R	95	Very high	94.1	Very high	76 Å²	76	56.3 Å²	56.3	29%	0.287	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-42.1	177.8	-175.1	72.9	176.1	166.3	-1	112	E84 W88 T109 L110 N115 R117	E84-R113 IonicContact OE1-CZ 3.25Å; E84-R113 VanDerWaalsContact OE1-CZ 3.25Å; E84-R113 IonicContact OE1-NE 3.33Å; E84-R113 PolarHBondContact OE1-NE 3.22Å; E84-R113 IonicContact OE1-NH2 2.61Å; E84-R113 PolarHBondContact OE1-NH2 2.89Å; E84-R113 IonicContact OE2-NH2 3.12Å; E84-R113 PolarHBondContact OE2-NH2 2.85Å; E84-R113 VanDerWaalsContact OE2-NH2 3.12Å; W88-R113 HydrophobicContact CH2-CB 3.73Å; W88-R113 HydrophobicContact CH2-CG 3.57Å; W88-R113 HydrophobicContact CZ2-CB 4.11Å; W88-R113 HydrophobicContact CZ2-CG 3.41Å; W88-R113 VanDerWaalsContact CZ2-CG 3.41Å; T109-R113 PolarHBondContact O-N 3.37Å; L110-R113 PolarHBondContact O-N 3.46Å; L110-R113 VanDerWaalsContact O-N 3.11Å; R113-N115 PolarHBondContact O-N 3.39Å; R113-R117 VanDerWaalsContact NE-NH1 3.17Å; R113-R117 VanDerWaalsContact O-CD 3.25Å; R113-R117 WeakPolarHBondContact O-CD 3.29Å
114	L	96	Very high	93.6	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.026	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.1	-178.5	-69	169.6	0	0	0	113.6	L110 Q112 G116 R117 L120 N152 V153 F156	L110-L114 HydrophobicContact CD1-CD1 3.74Å; L110-L114 HydrophobicContact CD1-CG 4.02Å; L110-L114 HydrophobicContact CG-CD1 3.84Å; L110-L114 WeakPolarHBondContact O-CG 3.48Å; L110-L114 PolarHBondContact O-N 3.33Å; Q112-L114 VanDerWaalsContact C-N 3.3Å; Q112-L114 PolarHBondContact O-N 3.21Å; L114-G116 PolarHBondContact O-N 3.17Å; L114-G116 VanDerWaalsContact O-N 3.07Å; L114-R117 PolarHBondContact O-N 3Å; L114-R117 VanDerWaalsContact O-N 3.13Å; L114-L120 HydrophobicContact CD2-CD2 3.81Å; L114-L120 HydrophobicContact CD2-CG 4.45Å; L114-L120 HydrophobicContact CG-CD2 4.31Å; L114-N152 HydrophobicContact CB-CB 3.9Å; L114-V153 HydrophobicContact CD1-CB 4.49Å; L114-V153 HydrophobicContact CD1-CG2 4.17Å; L114-F156 HydrophobicContact CD1-CB 3.6Å; L114-F156 HydrophobicContact CD1-CD1 4.2Å; L114-F156 HydrophobicContact CD1-CD2 4.31Å; L114-F156 HydrophobicContact CD1-CG 3.78Å; L114-F156 HydrophobicContact CD2-CB 4.15Å; L114-F156 HydrophobicContact CD2-CD2 3.66Å; L114-F156 HydrophobicContact CD2-CE2 4.3Å; L114-F156 HydrophobicContact CD2-CG 4Å; L114-F156 HydrophobicContact CG-CB 4.42Å
115	N	95.7	Very high	93.4	Very high	113 Å²	113	63.6 Å²	63.6	60%	0.604	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	112.6	179.3	-171.3	21.3	0	0	0	111	Q112 R113 R117	Q112-N115 WeakPolarHBondContact O-CB 3.32Å; Q112-N115 PolarHBondContact O-N 2.88Å; Q112-N115 VanDerWaalsContact O-N 3.16Å; R113-N115 PolarHBondContact O-N 3.39Å; N115-R117 VanDerWaalsContact C-N 3.28Å; N115-R117 PolarHBondContact O-N 2.76Å
116	G	92.1	Very high	93.1	Very high	74 Å²	74	61.3 Å²	61.3	76%	0.763	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	12.6	-177.5	0	0	0	0	0	114.8	L114	L114-G116 PolarHBondContact O-N 3.17Å; L114-G116 VanDerWaalsContact O-N 3.07Å
117	R	92.3	Very high	92.9	Very high	107 Å²	107	59.7 Å²	59.7	40%	0.404	33%	0.333	S	S	.	.			trans	-120	150.7	-177.9	-55.9	-169.1	-174.7	-165.8	-1.9	112.1	R113 L114 N115	R113-R117 VanDerWaalsContact NE-NH1 3.17Å; R113-R117 VanDerWaalsContact O-CD 3.25Å; R113-R117 WeakPolarHBondContact O-CD 3.29Å; L114-R117 PolarHBondContact O-N 3Å; L114-R117 VanDerWaalsContact O-N 3.13Å; N115-R117 VanDerWaalsContact C-N 3.28Å; N115-R117 PolarHBondContact O-N 2.76Å
118	N	88.9	Confident	92.7	Very high	103 Å²	103	59.5 Å²	59.5	55%	0.551	33%	0.332	S	S	*	.	S	Bend	trans	-109.8	-11	174.2	-64.3	-32.6	0	0	0	112.9	N159	N118-N159 PolarHBondContact OD1-ND2 2.6Å
119	A	90.8	Very high	92.6	Very high	6 Å²	6	53.7 Å²	53.7	5%	0.05	31%	0.31	C	S	.	.			trans	-136.9	150.1	176.1	0	0	0	0	0	109.3	K124 D129	A119-K124 WeakPolarHBondContact CB-O 3.45Å; A119-D129 WeakPolarHBondContact CA-OD1 3.27Å
120	L	93.3	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	-69.4	-45.5	177.3	-70.2	167.6	0	0	0	111.2	W88 L110 L114 A128 D129 L132	W88-L120 HydrophobicContact CB-CD1 4.26Å; W88-L120 HydrophobicContact CD2-CB 4.43Å; W88-L120 HydrophobicContact CD2-CD1 4.22Å; W88-L120 HydrophobicContact CD2-CD2 4.01Å; W88-L120 HydrophobicContact CD2-CG 4.46Å; W88-L120 HydrophobicContact CE3-CD1 4.47Å; W88-L120 HydrophobicContact CE3-CD2 4.04Å; W88-L120 HydrophobicContact CG-CB 4.3Å; W88-L120 HydrophobicContact CG-CD1 4.08Å; W88-L120 HydrophobicContact CH2-CD2 4.42Å; W88-L120 HydrophobicContact CZ2-CD2 4.39Å; W88-L120 HydrophobicContact CZ3-CD2 4.23Å; L110-L120 HydrophobicContact CD1-CD2 3.75Å; L114-L120 HydrophobicContact CD2-CD2 3.81Å; L114-L120 HydrophobicContact CD2-CG 4.45Å; L114-L120 HydrophobicContact CG-CD2 4.31Å; L120-A128 HydrophobicContact CD1-CB 3.99Å; L120-D129 VanDerWaalsContact CG-OD1 3.32Å; L120-D129 WeakPolarHBondContact CG-OD1 3.42Å; L120-D129 PolarHBondContact N-OD1 3.49Å; L120-L132 HydrophobicContact CD1-CB 4.11Å; L120-L132 HydrophobicContact CD1-CD2 3.57Å; L120-L132 HydrophobicContact CD1-CG 4.5Å; L120-L132 HydrophobicContact CD2-CD2 4.05Å; L120-L132 HydrophobicContact CG-CD2 4.36Å
121	V	91.9	Very high	92.2	Very high	9 Å²	9	52.9 Å²	52.9	6%	0.055	30%	0.304	C	S	.	.	S	Bend	trans	-124.5	126.3	-175.4	-170.1	0	0	0	0	109.3	A81 E84 V85 A128	A81-V121 HydrophobicContact CB-CG1 3.73Å; E84-V121 HydrophobicContact CB-CG1 4.22Å; E84-V121 HydrophobicContact CB-CG2 4.04Å; E84-V121 HydrophobicContact CG-CG2 3.91Å; V85-V121 HydrophobicContact CG2-CB 4.02Å; V85-V121 HydrophobicContact CG2-CG1 4.1Å; V85-V121 HydrophobicContact CG2-CG2 3.78Å; V121-A128 HydrophobicContact CG2-CB 4.46Å
122	G	87.6	Confident	92.1	Very high	71 Å²	71	51.3 Å²	51.3	73%	0.732	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-147	-179.9	0	0	0	0	0	114
123	S	86.3	Confident	92	Very high	114 Å²	114	45.5 Å²	45.5	80%	0.797	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-7.1	-173.1	61.3	0	0	0	0	114.7
124	K	86.2	Confident	91.9	Very high	145 Å²	145	44.3 Å²	44.3	63%	0.63	27%	0.274	S	S	*	.	S	Bend	trans	-130.1	158.9	-176.6	-63.8	-176.6	-175.8	172.5	0	109.6	A119 S126	A119-K124 WeakPolarHBondContact CB-O 3.45Å; K124-S126 PolarHBondContact O-N 2.85Å
125	L	90.6	Very high	91.7	Very high	33 Å²	33	44.3 Å²	44.3	17%	0.173	27%	0.274	C	S	.	.			trans	-62.9	130.3	174.5	-63.7	177.3	0	0	0	109.9	D129 Y130 D163	L125-D129 HydrophobicContact CB-CB 4.33Å; L125-D129 HydrophobicContact CD2-CB 3.71Å; L125-Y130 HydrophobicContact CB-CE2 4.19Å; L125-D163 HydrophobicContact CD1-CB 3.69Å
126	S	91.1	Very high	91.7	Very high	9 Å²	9	38.9 Å²	38.9	6%	0.063	25%	0.246	C	C	.	.			trans	-117.5	173.4	-179.2	67.8	0	0	0	0	110.2	L74 K124 A128 D129 Y130	L74-S126 WeakPolarHBondContact O-CA 3.23Å; K124-S126 PolarHBondContact O-N 2.85Å; S126-A128 PolarHBondContact O-N 3.43Å; S126-A128 PolarHBondContact OG-N 3.21Å; S126-D129 PolarHBondContact N-OD2 3.21Å; S126-D129 WeakPolarHBondContact O-CB 3.49Å; S126-D129 PolarHBondContact O-N 2.95Å; S126-D129 PolarHBondContact OG-OD2 3.35Å; S126-Y130 WeakPolarHBondContact O-CD2 3.46Å; S126-Y130 WeakPolarHBondContact O-CE2 3.15Å; S126-Y130 PolarHBondContact O-N 3.09Å
127	L	91.9	Very high	91.6	Very high	17 Å²	17	38.3 Å²	38.3	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-47.3	-36.4	173.2	-179.7	58.9	0	0	0	113.4	A62 R63 I66 L74 V85 L89 D129 Y130 A131	A62-L127 HydrophobicContact CB-CD1 3.83Å; R63-L127 HydrophobicContact CG-CD2 3.77Å; I66-L127 HydrophobicContact CD1-CB 4.13Å; I66-L127 HydrophobicContact CD1-CD1 4.01Å; I66-L127 HydrophobicContact CD1-CD2 4.09Å; I66-L127 HydrophobicContact CD1-CG 4.29Å; L74-L127 PolarHBondContact O-N 3.35Å; V85-L127 HydrophobicContact CG1-CB 4.39Å; L89-L127 HydrophobicContact CD1-CD2 4.06Å; L89-L127 HydrophobicContact CD1-CG 4.33Å; L89-L127 HydrophobicContact CD2-CG 4.1Å; L127-D129 PolarHBondContact O-N 3.09Å; L127-Y130 PolarHBondContact O-N 3.3Å; L127-A131 WeakPolarHBondContact O-CB 3.33Å; L127-A131 PolarHBondContact O-N 2.89Å; L127-A131 VanDerWaalsContact O-N 3.07Å
128	A	93.7	Very high	91.6	Very high	0 Å²	0	35 Å²	35	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-43.6	176.5	0	0	0	0	0	112.5	V85 W88 L120 V121 S126 A131 L132	V85-A128 HydrophobicContact CB-CB 4.45Å; V85-A128 HydrophobicContact CG1-CB 4.2Å; V85-A128 HydrophobicContact CG2-CB 4.31Å; W88-A128 HydrophobicContact CB-CB 3.62Å; W88-A128 HydrophobicContact CG-CB 4.23Å; L120-A128 HydrophobicContact CD1-CB 3.99Å; V121-A128 HydrophobicContact CG2-CB 4.46Å; S126-A128 PolarHBondContact O-N 3.43Å; S126-A128 PolarHBondContact OG-N 3.21Å; A128-A131 PolarHBondContact O-N 3.41Å; A128-L132 VanDerWaalsContact O-CB 3.23Å; A128-L132 WeakPolarHBondContact O-CB 3.44Å; A128-L132 PolarHBondContact O-N 3.25Å
129	D	94.2	Very high	91.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-43	-177.9	-58.2	-85.2	0	0	0	111.1	A119 L120 L125 S126 L127 W133 F156	A119-D129 WeakPolarHBondContact CA-OD1 3.27Å; L120-D129 VanDerWaalsContact CG-OD1 3.32Å; L120-D129 WeakPolarHBondContact CG-OD1 3.42Å; L120-D129 PolarHBondContact N-OD1 3.49Å; L125-D129 HydrophobicContact CB-CB 4.33Å; L125-D129 HydrophobicContact CD2-CB 3.71Å; S126-D129 PolarHBondContact N-OD2 3.21Å; S126-D129 WeakPolarHBondContact O-CB 3.49Å; S126-D129 PolarHBondContact O-N 2.95Å; S126-D129 PolarHBondContact OG-OD2 3.35Å; L127-D129 PolarHBondContact O-N 3.09Å; D129-W133 WeakPolarHBondContact O-CB 3.5Å; D129-W133 PolarHBondContact O-N 3.21Å; D129-F156 HydrophobicContact CB-CE2 4.11Å; D129-F156 HydrophobicContact CB-CZ 4.08Å; D129-F156 WeakPolarHBondContact OD1-CE2 3.41Å
130	Y	92.4	Very high	91.7	Very high	37 Å²	37	32.4 Å²	32.4	15%	0.145	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-45.3	177.8	-60.3	-78.5	0	0	0	112.2	L74 L125 S126 L127 L132 W133 A134 L165 L166	L74-Y130 HydrophobicContact CD1-CE2 4.4Å; L74-Y130 HydrophobicContact CD2-CE2 3.78Å; L125-Y130 HydrophobicContact CB-CE2 4.19Å; S126-Y130 WeakPolarHBondContact O-CD2 3.46Å; S126-Y130 WeakPolarHBondContact O-CE2 3.15Å; S126-Y130 PolarHBondContact O-N 3.09Å; L127-Y130 PolarHBondContact O-N 3.3Å; Y130-L132 VanDerWaalsContact C-N 3.34Å; Y130-L132 PolarHBondContact O-N 3.04Å; Y130-W133 PolarHBondContact O-N 3.19Å; Y130-A134 WeakPolarHBondContact O-CB 3.35Å; Y130-A134 PolarHBondContact O-N 2.97Å; Y130-L165 HydrophobicContact CE1-CB 4.37Å; Y130-L166 HydrophobicContact CD1-CD1 3.89Å; Y130-L166 HydrophobicContact CD1-CD2 3.73Å; Y130-L166 HydrophobicContact CD1-CG 3.61Å; Y130-L166 HydrophobicContact CE1-CD1 4.09Å; Y130-L166 HydrophobicContact CE1-CD2 4.34Å; Y130-L166 HydrophobicContact CE1-CG 3.75Å
131	A	92.6	Very high	91.6	Very high	26 Å²	26	37.3 Å²	37.3	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-64.9	-40.4	179.7	0	0	0	0	0	111.9	L89 A92 L127 A128 S135	L89-A131 HydrophobicContact CD2-CB 3.33Å; A92-A131 HydrophobicContact CB-CB 4.26Å; L127-A131 WeakPolarHBondContact O-CB 3.33Å; L127-A131 PolarHBondContact O-N 2.89Å; L127-A131 VanDerWaalsContact O-N 3.07Å; A128-A131 PolarHBondContact O-N 3.41Å; A131-S135 PolarHBondContact O-N 3.47Å; A131-S135 VanDerWaalsContact O-N 3.1Å; A131-S135 PolarHBondContact O-OG 3.1Å
132	L	95.1	Very high	91.5	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-44.5	177.6	-170.3	67.5	0	0	0	111.5	L91 A92 L95 L110 L120 A128 Y130 A134 S135 L136 F156	L91-L132 HydrophobicContact CD2-CD1 3.52Å; A92-L132 HydrophobicContact CB-CD1 4.2Å; L95-L132 HydrophobicContact CD1-CD1 3.55Å; L110-L132 HydrophobicContact CD1-CD2 3.41Å; L110-L132 VanDerWaalsContact CD1-CD2 3.41Å; L110-L132 HydrophobicContact CD2-CD1 4.31Å; L110-L132 HydrophobicContact CD2-CD2 3.7Å; L110-L132 HydrophobicContact CD2-CG 4.32Å; L110-L132 HydrophobicContact CG-CD2 4.17Å; L120-L132 HydrophobicContact CD1-CB 4.11Å; L120-L132 HydrophobicContact CD1-CD2 3.57Å; L120-L132 HydrophobicContact CD1-CG 4.5Å; L120-L132 HydrophobicContact CD2-CD2 4.05Å; L120-L132 HydrophobicContact CG-CD2 4.36Å; A128-L132 VanDerWaalsContact O-CB 3.23Å; A128-L132 WeakPolarHBondContact O-CB 3.44Å; A128-L132 PolarHBondContact O-N 3.25Å; Y130-L132 VanDerWaalsContact C-N 3.34Å; Y130-L132 PolarHBondContact O-N 3.04Å; L132-A134 VanDerWaalsContact C-N 3.31Å; L132-A134 PolarHBondContact O-N 2.84Å; L132-S135 PolarHBondContact O-N 3.37Å; L132-S135 VanDerWaalsContact O-N 3.17Å; L132-L136 HydrophobicContact CD2-CD1 4.4Å; L132-L136 HydrophobicContact CG-CD1 3.96Å; L132-L136 HydrophobicContact CG-CG 4.32Å; L132-L136 WeakPolarHBondContact O-CB 3.18Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.25Å; L132-L136 PolarHBondContact O-N 3.29Å; L132-F156 HydrophobicContact CD2-CE1 4.3Å
133	W	94.4	Very high	91.5	Very high	10 Å²	10	44.6 Å²	44.6	4%	0.038	24%	0.244	C	C	.	.	H	α-helix	trans	-55.3	-46.8	174.3	176.6	85.6	0	0	0	111.4	D129 Y130 S135 L136 Q137 F156 C157 C160 L161 L166	D129-W133 WeakPolarHBondContact O-CB 3.5Å; D129-W133 PolarHBondContact O-N 3.21Å; Y130-W133 PolarHBondContact O-N 3.19Å; W133-S135 VanDerWaalsContact C-N 3.31Å; W133-S135 PolarHBondContact O-N 2.86Å; W133-L136 PolarHBondContact O-N 3.08Å; W133-Q137 HydrophobicContact CH2-CG 4.43Å; W133-Q137 HydrophobicContact CZ2-CG 4.37Å; W133-Q137 WeakPolarHBondContact O-CB 3.44Å; W133-Q137 PolarHBondContact O-N 3.14Å; W133-F156 HydrophobicContact CB-CE1 4.36Å; W133-C157 PolarHBondContact NE1-O 2.99Å; W133-C160 HydrophobicContact CB-CB 4.37Å; W133-C160 HydrophobicContact CG-CB 3.88Å; W133-L161 HydrophobicContact CZ2-CD2 3.7Å; W133-L166 HydrophobicContact CD2-CD1 4.07Å; W133-L166 HydrophobicContact CD2-CD2 4.03Å; W133-L166 HydrophobicContact CE3-CD1 4.39Å; W133-L166 HydrophobicContact CE3-CD2 3.51Å; W133-L166 HydrophobicContact CG-CD1 4.13Å; W133-L166 HydrophobicContact CH2-CD2 4.34Å; W133-L166 HydrophobicContact CZ3-CD2 3.69Å
134	A	92	Very high	91.5	Very high	50 Å²	50	47 Å²	47	41%	0.413	24%	0.243	S	C	.	.	H	α-helix	trans	-60.5	-41.9	178.2	0	0	0	0	0	112	Y130 L132 Q137 S138	Y130-A134 WeakPolarHBondContact O-CB 3.35Å; Y130-A134 PolarHBondContact O-N 2.97Å; L132-A134 VanDerWaalsContact C-N 3.31Å; L132-A134 PolarHBondContact O-N 2.84Å; A134-Q137 PolarHBondContact O-N 3.11Å; A134-S138 PolarHBondContact O-N 3Å
135	S	93.5	Very high	91.7	Very high	5 Å²	5	44.7 Å²	44.7	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-42.1	179	-57	0	0	0	0	111.6	A92 A131 L132 W133 S138 L139	A92-S135 WeakPolarHBondContact O-CB 3.3Å; A92-S135 PolarHBondContact O-OG 3.39Å; A92-S135 VanDerWaalsContact O-OG 3.08Å; A131-S135 PolarHBondContact O-N 3.47Å; A131-S135 VanDerWaalsContact O-N 3.1Å; A131-S135 PolarHBondContact O-OG 3.1Å; L132-S135 PolarHBondContact O-N 3.37Å; L132-S135 VanDerWaalsContact O-N 3.17Å; W133-S135 VanDerWaalsContact C-N 3.31Å; W133-S135 PolarHBondContact O-N 2.86Å; S135-S138 PolarHBondContact O-N 3.44Å; S135-S138 PolarHBondContact O-OG 3.49Å; S135-L139 PolarHBondContact O-N 2.96Å
136	L	94.5	Very high	91.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-40.1	174.6	-69.2	170.1	0	0	0	112.1	L95 L107 L110 L132 W133 S138 L139 T140 L147 V153 F156	L95-L136 HydrophobicContact CD1-CD2 4.08Å; L95-L136 HydrophobicContact CD1-CG 4.5Å; L107-L136 HydrophobicContact CD2-CD2 3.76Å; L110-L136 HydrophobicContact CD2-CD1 4.16Å; L110-L136 HydrophobicContact CD2-CD2 4.32Å; L132-L136 HydrophobicContact CD2-CD1 4.4Å; L132-L136 HydrophobicContact CG-CD1 3.96Å; L132-L136 HydrophobicContact CG-CG 4.32Å; L132-L136 WeakPolarHBondContact O-CB 3.18Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.25Å; L132-L136 PolarHBondContact O-N 3.29Å; W133-L136 PolarHBondContact O-N 3.08Å; L136-S138 VanDerWaalsContact C-N 3.32Å; L136-S138 PolarHBondContact O-N 3.25Å; L136-L139 WeakPolarHBondContact O-CB 3.39Å; L136-L139 PolarHBondContact O-N 3.37Å; L136-L139 VanDerWaalsContact O-N 3.08Å; L136-T140 WeakPolarHBondContact O-CG2 3.47Å; L136-T140 PolarHBondContact O-N 3.34Å; L136-T140 PolarHBondContact O-OG1 3.38Å; L136-L147 HydrophobicContact CB-CD1 4.47Å; L136-L147 HydrophobicContact CD2-CD2 3.95Å; L136-V153 HydrophobicContact CD1-CG1 3.7Å; L136-V153 HydrophobicContact CD2-CG1 4Å; L136-F156 HydrophobicContact CD1-CD1 4.08Å; L136-F156 HydrophobicContact CD1-CE1 4.02Å
137	Q	91.4	Very high	91.8	Very high	62 Å²	62	44.4 Å²	44.4	29%	0.29	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-45.4	175.6	-170.7	58.4	48.5	0	0	110	W133 A134 L139 T140 T141	W133-Q137 HydrophobicContact CH2-CG 4.43Å; W133-Q137 HydrophobicContact CZ2-CG 4.37Å; W133-Q137 WeakPolarHBondContact O-CB 3.44Å; W133-Q137 PolarHBondContact O-N 3.14Å; A134-Q137 PolarHBondContact O-N 3.11Å; Q137-L139 PolarHBondContact O-N 3.38Å; Q137-T140 WeakPolarHBondContact CA-OG1 3.38Å; Q137-T140 PolarHBondContact NE2-OG1 3.41Å; Q137-T140 PolarHBondContact O-N 3.06Å; Q137-T140 PolarHBondContact O-OG1 2.91Å; Q137-T141 WeakPolarHBondContact O-CG2 3.42Å; Q137-T141 PolarHBondContact O-N 3.31Å; Q137-T141 VanDerWaalsContact O-N 3.07Å; Q137-T141 PolarHBondContact O-OG1 2.97Å
138	S	90.7	Very high	91.8	Very high	37 Å²	37	50.8 Å²	50.8	26%	0.259	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-28.6	175.1	85.7	0	0	0	0	113.7	A134 S135 L136 T141 K142	A134-S138 PolarHBondContact O-N 3Å; S135-S138 PolarHBondContact O-N 3.44Å; S135-S138 PolarHBondContact O-OG 3.49Å; L136-S138 VanDerWaalsContact C-N 3.32Å; L136-S138 PolarHBondContact O-N 3.25Å; S138-T141 PolarHBondContact O-OG1 3.39Å; S138-K142 WeakPolarHBondContact O-CD 3.34Å; S138-K142 VanDerWaalsContact O-CG 3.3Å; S138-K142 WeakPolarHBondContact O-CG 3.46Å
139	L	92	Very high	91.9	Very high	11 Å²	11	55.7 Å²	55.7	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-75.4	-45.4	175.7	176.9	65.1	0	0	0	111.1	L103 L107 S135 L136 Q137 T141 K142 K143 A146 L147	L103-L139 HydrophobicContact CD1-CD2 3.7Å; L103-L139 HydrophobicContact CD2-CD1 3.77Å; L103-L139 HydrophobicContact CD2-CD2 4.06Å; L103-L139 HydrophobicContact CG-CD2 4.4Å; L107-L139 HydrophobicContact CD1-CD2 4.29Å; S135-L139 PolarHBondContact O-N 2.96Å; L136-L139 WeakPolarHBondContact O-CB 3.39Å; L136-L139 PolarHBondContact O-N 3.37Å; L136-L139 VanDerWaalsContact O-N 3.08Å; Q137-L139 PolarHBondContact O-N 3.38Å; L139-T141 VanDerWaalsContact C-N 3.27Å; L139-T141 PolarHBondContact O-N 2.69Å; L139-K142 PolarHBondContact O-N 3.13Å; L139-K142 VanDerWaalsContact O-N 3.13Å; L139-K143 HydrophobicContact CD1-CD 4.25Å; L139-K143 PolarHBondContact O-N 2.88Å; L139-A146 HydrophobicContact CD2-CB 4.26Å; L139-A146 HydrophobicContact CG-CB 4.07Å; L139-L147 HydrophobicContact CD2-CD2 4.28Å
140	T	91.1	Very high	92	Very high	43 Å²	43	57.4 Å²	57.4	26%	0.264	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-29.9	179.4	57.7	0	0	0	0	113	L136 Q137 K143 L147	L136-T140 WeakPolarHBondContact O-CG2 3.47Å; L136-T140 PolarHBondContact O-N 3.34Å; L136-T140 PolarHBondContact O-OG1 3.38Å; Q137-T140 WeakPolarHBondContact CA-OG1 3.38Å; Q137-T140 PolarHBondContact NE2-OG1 3.41Å; Q137-T140 PolarHBondContact O-N 3.06Å; Q137-T140 PolarHBondContact O-OG1 2.91Å; T140-K143 CarbonylContact O-C 3.57Å; T140-L147 HydrophobicContact CG2-CD1 3.39Å; T140-L147 HydrophobicContact CG2-CG 3.68Å
141	T	89.5	Confident	92.2	Very high	104 Å²	104	58.8 Å²	58.8	64%	0.638	33%	0.326	S	S	*	.	H	α-helix	trans	-72.2	-31	173.7	55.2	0	0	0	0	112.8	Q137 S138 L139	Q137-T141 WeakPolarHBondContact O-CG2 3.42Å; Q137-T141 PolarHBondContact O-N 3.31Å; Q137-T141 VanDerWaalsContact O-N 3.07Å; Q137-T141 PolarHBondContact O-OG1 2.97Å; S138-T141 PolarHBondContact O-OG1 3.39Å; L139-T141 VanDerWaalsContact C-N 3.27Å; L139-T141 PolarHBondContact O-N 2.69Å
142	K	90	Very high	92.4	Very high	148 Å²	148	59.5 Å²	59.5	64%	0.643	33%	0.326	S	S	*	.	H	α-helix	trans	-83.2	-35.9	177.5	-68.8	172	-174.4	174.1	0	113	S138 L139	S138-K142 WeakPolarHBondContact O-CD 3.34Å; S138-K142 VanDerWaalsContact O-CG 3.3Å; S138-K142 WeakPolarHBondContact O-CG 3.46Å; L139-K142 PolarHBondContact O-N 3.13Å; L139-K142 VanDerWaalsContact O-N 3.13Å
143	K	88.6	Confident	92.5	Very high	84 Å²	84	59.5 Å²	59.5	37%	0.365	33%	0.326	S	S	.	.	S	Bend	trans	-132.8	99.5	-174.9	-69.7	179	-172.8	164.7	0	109.2	N100 L139 T140 N145 A146	N100-K143 PolarHBondContact OD1-NZ 2.98Å; L139-K143 HydrophobicContact CD1-CD 4.25Å; L139-K143 PolarHBondContact O-N 2.88Å; T140-K143 CarbonylContact O-C 3.57Å; K143-N145 PolarHBondContact O-N 2.93Å; K143-A146 HydrophobicContact CB-CB 3.89Å; K143-A146 WeakPolarHBondContact O-CB 3.44Å; K143-A146 PolarHBondContact O-N 3.44Å
144	E	87.1	Confident	92.5	Very high	166 Å²	166	64.1 Å²	64.1	78%	0.776	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	136.7	173.8	-158	-171.5	153.6	0	0	109.6	A146	E144-A146 PolarHBondContact O-N 3.09Å
145	N	88.9	Confident	92.6	Very high	96 Å²	96	66.4 Å²	66.4	51%	0.513	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	13.1	-179.6	-53.7	-67.2	0	0	0	116.3	K143 L147 K148	K143-N145 PolarHBondContact O-N 2.93Å; N145-L147 PolarHBondContact O-N 3.32Å; N145-K148 HydrophobicContact CB-CB 4.11Å; N145-K148 HydrophobicContact CB-CD 4.18Å; N145-K148 VanDerWaalsContact O-CB 3.3Å; N145-K148 WeakPolarHBondContact O-CB 3.47Å; N145-K148 PolarHBondContact O-N 3.24Å
146	A	89.9	Confident	92.7	Very high	24 Å²	24	66.4 Å²	66.4	20%	0.198	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.5	177.4	0	0	0	0	0	113.9	L139 K143 E144	L139-A146 HydrophobicContact CD2-CB 4.26Å; L139-A146 HydrophobicContact CG-CB 4.07Å; K143-A146 HydrophobicContact CB-CB 3.89Å; K143-A146 WeakPolarHBondContact O-CB 3.44Å; K143-A146 PolarHBondContact O-N 3.44Å; E144-A146 PolarHBondContact O-N 3.09Å
147	L	93.4	Very high	92.6	Very high	11 Å²	11	67.2 Å²	67.2	6%	0.058	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-4.4	-178	-54.8	-175	0	0	0	114	L107 L136 L139 T140 N145 S149 Y150 V153	L107-L147 HydrophobicContact CD1-CD2 4.14Å; L107-L147 HydrophobicContact CD2-CD2 3.86Å; L136-L147 HydrophobicContact CB-CD1 4.47Å; L136-L147 HydrophobicContact CD2-CD2 3.95Å; L139-L147 HydrophobicContact CD2-CD2 4.28Å; T140-L147 HydrophobicContact CG2-CD1 3.39Å; T140-L147 HydrophobicContact CG2-CG 3.68Å; N145-L147 PolarHBondContact O-N 3.32Å; L147-S149 PolarHBondContact O-N 2.86Å; L147-S149 VanDerWaalsContact O-N 3.12Å; L147-Y150 CarbonylContact O-C 3.58Å; L147-Y150 WeakPolarHBondContact O-CA 3.47Å; L147-Y150 PolarHBondContact O-N 3.13Å; L147-V153 HydrophobicContact CD1-CG1 4.23Å; L147-V153 HydrophobicContact CD2-CG1 4.1Å
148	K	93.2	Very high	92.5	Very high	151 Å²	151	72.6 Å²	72.6	66%	0.657	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.1	-171	-171.4	172.8	-177.1	173	0	113.7	N145 Y150	N145-K148 HydrophobicContact CB-CB 4.11Å; N145-K148 HydrophobicContact CB-CD 4.18Å; N145-K148 VanDerWaalsContact O-CB 3.3Å; N145-K148 WeakPolarHBondContact O-CB 3.47Å; N145-K148 PolarHBondContact O-N 3.24Å; K148-Y150 VanDerWaalsContact C-N 3.29Å
149	S	94.8	Very high	92.5	Very high	104 Å²	104	73.1 Å²	73.1	73%	0.727	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.2	176.5	-55.7	0	0	0	0	113.7	L147	L147-S149 PolarHBondContact O-N 2.86Å; L147-S149 VanDerWaalsContact O-N 3.12Å
150	Y	96.7	Very high	92.3	Very high	37 Å²	37	72.7 Å²	72.7	15%	0.145	37%	0.368	C	S	.	.			trans	-127.2	73.4	-171.1	-53.1	-80.3	0	0	0	110.6	G104 L107 R108 N111 L147 K148 N152 V153 E154	G104-Y150 WeakPolarHBondContact CA-OH 3.22Å; G104-Y150 PolarHBondContact O-OH 2.93Å; L107-Y150 HydrophobicContact CB-CD1 3.9Å; L107-Y150 HydrophobicContact CB-CD2 3.98Å; L107-Y150 HydrophobicContact CB-CE1 3.62Å; L107-Y150 HydrophobicContact CB-CE2 3.7Å; L107-Y150 HydrophobicContact CB-CG 4.07Å; L107-Y150 HydrophobicContact CD1-CD2 3.94Å; L107-Y150 HydrophobicContact CD1-CE2 3.55Å; L107-Y150 HydrophobicContact CG-CE2 4.27Å; R108-Y150 HydrophobicContact CB-CE1 4.27Å; N111-Y150 HydrophobicContact CB-CD1 3.98Å; N111-Y150 WeakPolarHBondContact OD1-CA 3.34Å; N111-Y150 PolarHBondContact OD1-O 2.8Å; L147-Y150 CarbonylContact O-C 3.58Å; L147-Y150 WeakPolarHBondContact O-CA 3.47Å; L147-Y150 PolarHBondContact O-N 3.13Å; K148-Y150 VanDerWaalsContact C-N 3.29Å; Y150-N152 VanDerWaalsContact C-N 3.29Å; Y150-N152 PolarHBondContact O-N 3.4Å; Y150-V153 WeakPolarHBondContact O-CB 3.36Å; Y150-V153 PolarHBondContact O-N 2.99Å; Y150-E154 PolarHBondContact O-N 3.37Å
151	A	96.2	Very high	92.1	Very high	66 Å²	66	73.9 Å²	73.9	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-55.3	-36.3	-171.6	0	0	0	0	0	114.9	N111 K155	N111-A151 PolarHBondContact OD1-N 3.02Å; A151-K155 WeakPolarHBondContact O-CB 3.49Å; A151-K155 PolarHBondContact O-N 3.31Å
152	N	97.1	Very high	91.9	Very high	40 Å²	40	73.2 Å²	73.2	21%	0.214	37%	0.372	C	S	.	.	H	α-helix	trans	-73.6	-33.1	179	-59.2	-34.6	0	0	0	111.4	N111 L114 Y150 F156	N111-N152 WeakPolarHBondContact O-CB 3.33Å; N111-N152 PolarHBondContact O-ND2 3.14Å; N111-N152 WeakPolarHBondContact OD1-CA 3.4Å; N111-N152 VanDerWaalsContact OD1-CB 3.28Å; N111-N152 WeakPolarHBondContact OD1-CB 3.45Å; N111-N152 PolarHBondContact OD1-N 2.88Å; L114-N152 HydrophobicContact CB-CB 3.9Å; Y150-N152 VanDerWaalsContact C-N 3.29Å; Y150-N152 PolarHBondContact O-N 3.4Å; N152-F156 VanDerWaalsContact O-CB 3.31Å; N152-F156 WeakPolarHBondContact O-CB 3.3Å; N152-F156 PolarHBondContact O-N 2.9Å
153	V	96.7	Very high	91.8	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-68.8	-43.5	175	-172.6	0	0	0	0	110.3	L110 N111 L114 L136 L147 Y150 K155 F156 C157	L110-V153 HydrophobicContact CD2-CG1 4.01Å; L110-V153 HydrophobicContact CD2-CG2 4.08Å; L110-V153 HydrophobicContact CG-CG2 4.02Å; N111-V153 HydrophobicContact CB-CG2 3.75Å; N111-V153 PolarHBondContact OD1-N 2.98Å; L114-V153 HydrophobicContact CD1-CB 4.49Å; L114-V153 HydrophobicContact CD1-CG2 4.17Å; L136-V153 HydrophobicContact CD1-CG1 3.7Å; L136-V153 HydrophobicContact CD2-CG1 4Å; L147-V153 HydrophobicContact CD1-CG1 4.23Å; L147-V153 HydrophobicContact CD2-CG1 4.1Å; Y150-V153 WeakPolarHBondContact O-CB 3.36Å; Y150-V153 PolarHBondContact O-N 2.99Å; V153-K155 VanDerWaalsContact C-N 3.35Å; V153-K155 PolarHBondContact O-N 2.66Å; V153-F156 WeakPolarHBondContact O-CB 3.49Å; V153-F156 PolarHBondContact O-N 3.14Å; V153-C157 PolarHBondContact O-N 2.67Å; V153-C157 PolarHBondContact O-SG 2.91Å; V153-C157 VanDerWaalsContact O-SG 3.37Å
154	E	94.8	Very high	91.6	Very high	107 Å²	107	69.1 Å²	69.1	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-44.4	175.4	-171.5	178.6	179.4	0	0	111.5	Y150 F156 C157 R158	Y150-E154 PolarHBondContact O-N 3.37Å; E154-F156 VanDerWaalsContact C-N 3.35Å; E154-F156 PolarHBondContact O-N 3.1Å; E154-C157 PolarHBondContact O-N 3.1Å; E154-R158 PolarHBondContact O-N 3.04Å; E154-R158 VanDerWaalsContact O-N 3.1Å
155	K	94.4	Very high	91.3	Very high	98 Å²	98	65.5 Å²	65.5	43%	0.426	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-45.9	173.1	-177.5	-174.5	174.2	-169.9	0	111.5	A151 V153 R158 N159	A151-K155 WeakPolarHBondContact O-CB 3.49Å; A151-K155 PolarHBondContact O-N 3.31Å; V153-K155 VanDerWaalsContact C-N 3.35Å; V153-K155 PolarHBondContact O-N 2.66Å; K155-R158 PolarHBondContact O-N 2.84Å; K155-N159 WeakPolarHBondContact O-CB 3.33Å; K155-N159 VanDerWaalsContact O-CG 3.32Å; K155-N159 PolarHBondContact O-N 3.43Å; K155-N159 PolarHBondContact O-OD1 2.93Å
156	F	94.7	Very high	91	Very high	5 Å²	5	61.3 Å²	61.3	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-57.7	-50.6	176.6	165.8	-97	0	0	0	111.5	L114 D129 L132 W133 L136 N152 V153 E154 R158 N159 C160	L114-F156 HydrophobicContact CD1-CB 3.6Å; L114-F156 HydrophobicContact CD1-CD1 4.2Å; L114-F156 HydrophobicContact CD1-CD2 4.31Å; L114-F156 HydrophobicContact CD1-CG 3.78Å; L114-F156 HydrophobicContact CD2-CB 4.15Å; L114-F156 HydrophobicContact CD2-CD2 3.66Å; L114-F156 HydrophobicContact CD2-CE2 4.3Å; L114-F156 HydrophobicContact CD2-CG 4Å; L114-F156 HydrophobicContact CG-CB 4.42Å; D129-F156 HydrophobicContact CB-CE2 4.11Å; D129-F156 HydrophobicContact CB-CZ 4.08Å; D129-F156 WeakPolarHBondContact OD1-CE2 3.41Å; L132-F156 HydrophobicContact CD2-CE1 4.3Å; W133-F156 HydrophobicContact CB-CE1 4.36Å; L136-F156 HydrophobicContact CD1-CD1 4.08Å; L136-F156 HydrophobicContact CD1-CE1 4.02Å; N152-F156 VanDerWaalsContact O-CB 3.31Å; N152-F156 WeakPolarHBondContact O-CB 3.3Å; N152-F156 PolarHBondContact O-N 2.9Å; V153-F156 WeakPolarHBondContact O-CB 3.49Å; V153-F156 PolarHBondContact O-N 3.14Å; E154-F156 VanDerWaalsContact C-N 3.35Å; E154-F156 PolarHBondContact O-N 3.1Å; F156-R158 PolarHBondContact O-N 2.86Å; F156-N159 WeakPolarHBondContact O-CB 3.44Å; F156-N159 PolarHBondContact O-N 3.03Å; F156-C160 VanDerWaalsContact CE2-SG 3.51Å; F156-C160 WeakPolarHBondContact CZ-SG 3.47Å; F156-C160 PolarHBondContact O-N 2.96Å; F156-C160 PolarHBondContact O-SG 3.25Å; F156-C160 VanDerWaalsContact O-SG 3.33Å
157	C	92.7	Very high	90.8	Very high	17 Å²	17	64.2 Å²	64.2	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-56.3	-39.3	178.4	-69.5	0	0	0	0	112.3	W133 V153 E154 L161	W133-C157 PolarHBondContact NE1-O 2.99Å; V153-C157 PolarHBondContact O-N 2.67Å; V153-C157 PolarHBondContact O-SG 2.91Å; V153-C157 VanDerWaalsContact O-SG 3.37Å; E154-C157 PolarHBondContact O-N 3.1Å; C157-L161 PolarHBondContact O-N 3.28Å
158	R	90.5	Very high	90.5	Very high	176 Å²	176	70 Å²	70	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-73.4	-36.3	178.1	-157.5	173.8	66	106.2	5.3	112.7	E154 K155 F156 L161	E154-R158 PolarHBondContact O-N 3.04Å; E154-R158 VanDerWaalsContact O-N 3.1Å; K155-R158 PolarHBondContact O-N 2.84Å; F156-R158 PolarHBondContact O-N 2.86Å; R158-L161 PolarHBondContact O-N 2.73Å
159	N	90.3	Very high	90	Very high	48 Å²	48	66.1 Å²	66.1	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-40.8	174.5	-78.3	15.3	0	0	0	111.4	N118 K155 F156 L161 S162	N118-N159 PolarHBondContact OD1-ND2 2.6Å; K155-N159 WeakPolarHBondContact O-CB 3.33Å; K155-N159 VanDerWaalsContact O-CG 3.32Å; K155-N159 PolarHBondContact O-N 3.43Å; K155-N159 PolarHBondContact O-OD1 2.93Å; F156-N159 WeakPolarHBondContact O-CB 3.44Å; F156-N159 PolarHBondContact O-N 3.03Å; N159-L161 PolarHBondContact O-N 3.28Å; N159-S162 WeakPolarHBondContact O-CA 3.35Å; N159-S162 VanDerWaalsContact O-CB 3.25Å; N159-S162 WeakPolarHBondContact O-CB 3.15Å; N159-S162 PolarHBondContact O-N 2.75Å
160	C	88.3	Confident	89.2	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.007	33%	0.333	C	S	.	.	H	α-helix	trans	-56.8	-37.4	174	-73.6	0	0	0	0	112.1	W133 F156 S162 D163 L166	W133-C160 HydrophobicContact CB-CB 4.37Å; W133-C160 HydrophobicContact CG-CB 3.88Å; F156-C160 VanDerWaalsContact CE2-SG 3.51Å; F156-C160 WeakPolarHBondContact CZ-SG 3.47Å; F156-C160 PolarHBondContact O-N 2.96Å; F156-C160 PolarHBondContact O-SG 3.25Å; F156-C160 VanDerWaalsContact O-SG 3.33Å; C160-S162 PolarHBondContact O-N 3.41Å; C160-D163 VanDerWaalsContact O-CB 3.22Å; C160-D163 WeakPolarHBondContact O-CB 3.45Å; C160-D163 PolarHBondContact O-N 2.66Å; C160-L166 HydrophobicContact CB-CD1 3.54Å; C160-L166 WeakPolarHBondContact O-CB 3.47Å; C160-L166 VanDerWaalsContact O-CD1 3.29Å; C160-L166 WeakPolarHBondContact O-CD1 3.4Å
161	L	85.3	Confident	88.6	Confident	68 Å²	68	68.6 Å²	68.6	36%	0.356	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.9	174.6	-68.8	174.2	0	0	0	114.1	W133 C157 R158 N159 D163 Q167	W133-L161 HydrophobicContact CZ2-CD2 3.7Å; C157-L161 PolarHBondContact O-N 3.28Å; R158-L161 PolarHBondContact O-N 2.73Å; N159-L161 PolarHBondContact O-N 3.28Å; L161-D163 VanDerWaalsContact C-N 3.26Å; L161-Q167 WeakPolarHBondContact O-CG 3.43Å; L161-Q167 PolarHBondContact O-NE2 3.14Å
162	S	86.5	Confident	88	Confident	90 Å²	90	71.5 Å²	71.5	63%	0.629	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-11.1	172.2	-53.1	0	0	0	0	112.1	N159 C160	N159-S162 WeakPolarHBondContact O-CA 3.35Å; N159-S162 VanDerWaalsContact O-CB 3.25Å; N159-S162 WeakPolarHBondContact O-CB 3.15Å; N159-S162 PolarHBondContact O-N 2.75Å; C160-S162 PolarHBondContact O-N 3.41Å
163	D	87.2	Confident	86.9	Confident	39 Å²	39	74.2 Å²	74.2	21%	0.209	37%	0.369	C	S	.	.	S	Bend	trans	-77.1	135	176.2	-176.2	-93.9	0	0	0	111.6	L125 C160 L161 L165 L166 Q167	L125-D163 HydrophobicContact CD1-CB 3.69Å; C160-D163 VanDerWaalsContact O-CB 3.22Å; C160-D163 WeakPolarHBondContact O-CB 3.45Å; C160-D163 PolarHBondContact O-N 2.66Å; L161-D163 VanDerWaalsContact C-N 3.26Å; D163-L165 VanDerWaalsContact C-N 3.35Å; D163-L165 PolarHBondContact O-N 2.78Å; D163-L165 WeakPolarHBondContact OD1-CA 3.33Å; D163-L165 VanDerWaalsContact OD1-CB 3.24Å; D163-L165 WeakPolarHBondContact OD1-CB 3.32Å; D163-L165 PolarHBondContact OD1-N 2.68Å; D163-L166 HydrophobicContact CB-CB 4.35Å; D163-L166 PolarHBondContact O-N 2.81Å; D163-L166 PolarHBondContact OD1-N 3.29Å; D163-Q167 WeakPolarHBondContact O-CG 3.04Å; D163-Q167 PolarHBondContact O-N 3.36Å
164	V	84.1	Confident	86	Confident	108 Å²	108	78.4 Å²	78.4	66%	0.655	40%	0.398	S	S	*	.	H	α-helix	trans	-66.6	-36.9	-174.8	177.8	0	0	0	0	111.6	Q167 K168	V164-Q167 PolarHBondContact O-N 2.75Å; V164-K168 WeakPolarHBondContact O-CB 3.35Å; V164-K168 PolarHBondContact O-N 3.44Å
165	L	81.7	Confident	84.9	Confident	90 Å²	90	78 Å²	78	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-43	179.2	-60.2	177.3	0	0	0	109.9	L74 Y130 D163 K168 V169	L74-L165 HydrophobicContact CD1-CD1 4.27Å; L74-L165 HydrophobicContact CD2-CD1 4.34Å; Y130-L165 HydrophobicContact CE1-CB 4.37Å; D163-L165 VanDerWaalsContact C-N 3.35Å; D163-L165 PolarHBondContact O-N 2.78Å; D163-L165 WeakPolarHBondContact OD1-CA 3.33Å; D163-L165 VanDerWaalsContact OD1-CB 3.24Å; D163-L165 WeakPolarHBondContact OD1-CB 3.32Å; D163-L165 PolarHBondContact OD1-N 2.68Å; L165-K168 PolarHBondContact O-N 3.21Å; L165-V169 VanDerWaalsContact O-CG2 3.3Å; L165-V169 WeakPolarHBondContact O-CG2 3.31Å; L165-V169 PolarHBondContact O-N 2.77Å
166	L	83.6	Confident	83.4	Confident	7 Å²	7	80.8 Å²	80.8	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-68.6	-37.2	177.3	-79.4	177.1	0	0	0	113.5	Y130 W133 C160 D163 K168 V169 Q170	Y130-L166 HydrophobicContact CD1-CD1 3.89Å; Y130-L166 HydrophobicContact CD1-CD2 3.73Å; Y130-L166 HydrophobicContact CD1-CG 3.61Å; Y130-L166 HydrophobicContact CE1-CD1 4.09Å; Y130-L166 HydrophobicContact CE1-CD2 4.34Å; Y130-L166 HydrophobicContact CE1-CG 3.75Å; W133-L166 HydrophobicContact CD2-CD1 4.07Å; W133-L166 HydrophobicContact CD2-CD2 4.03Å; W133-L166 HydrophobicContact CE3-CD1 4.39Å; W133-L166 HydrophobicContact CE3-CD2 3.51Å; W133-L166 HydrophobicContact CG-CD1 4.13Å; W133-L166 HydrophobicContact CH2-CD2 4.34Å; W133-L166 HydrophobicContact CZ3-CD2 3.69Å; C160-L166 HydrophobicContact CB-CD1 3.54Å; C160-L166 WeakPolarHBondContact O-CB 3.47Å; C160-L166 VanDerWaalsContact O-CD1 3.29Å; C160-L166 WeakPolarHBondContact O-CD1 3.4Å; D163-L166 HydrophobicContact CB-CB 4.35Å; D163-L166 PolarHBondContact O-N 2.81Å; D163-L166 PolarHBondContact OD1-N 3.29Å; L166-K168 VanDerWaalsContact C-N 3.33Å; L166-K168 PolarHBondContact O-N 3.43Å; L166-V169 PolarHBondContact O-N 3.31Å; L166-Q170 WeakPolarHBondContact O-CB 3.45Å; L166-Q170 PolarHBondContact O-N 2.85Å
167	Q	85.5	Confident	81.4	Confident	86 Å²	86	85.6 Å²	85.6	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-59.2	-47.2	172.4	-74.3	176.4	24.9	0	0	111.2	L161 D163 V164 V169 Q170 E171	L161-Q167 WeakPolarHBondContact O-CG 3.43Å; L161-Q167 PolarHBondContact O-NE2 3.14Å; D163-Q167 WeakPolarHBondContact O-CG 3.04Å; D163-Q167 PolarHBondContact O-N 3.36Å; V164-Q167 PolarHBondContact O-N 2.75Å; Q167-V169 VanDerWaalsContact C-N 3.33Å; Q167-V169 PolarHBondContact O-N 2.53Å; Q167-Q170 WeakPolarHBondContact O-CB 3.45Å; Q167-Q170 PolarHBondContact O-N 2.74Å; Q167-Q170 VanDerWaalsContact O-N 3.15Å; Q167-E171 WeakPolarHBondContact O-CG 3.47Å; Q167-E171 PolarHBondContact O-N 3.49Å
168	K	85.3	Confident	79.5	Confident	132 Å²	132	93.2 Å²	93.2	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-61.4	-41.8	177.4	-171.6	176.5	-178.1	-178.5	0	111.8	V164 L165 L166 E171 Q172	V164-K168 WeakPolarHBondContact O-CB 3.35Å; V164-K168 PolarHBondContact O-N 3.44Å; L165-K168 PolarHBondContact O-N 3.21Å; L166-K168 VanDerWaalsContact C-N 3.33Å; L166-K168 PolarHBondContact O-N 3.43Å; K168-E171 PolarHBondContact O-N 2.98Å; K168-Q172 WeakPolarHBondContact O-CB 3.17Å; K168-Q172 WeakPolarHBondContact O-CG 3.27Å; K168-Q172 PolarHBondContact O-N 2.83Å
169	V	82.8	Confident	77.6	Confident	69 Å²	69	92.4 Å²	92.4	42%	0.418	48%	0.484	S	S	.	.	H	α-helix	trans	-61.7	-45.8	174.4	170.4	0	0	0	0	110.5	L165 L166 Q167 E171 Q172 L173	L165-V169 VanDerWaalsContact O-CG2 3.3Å; L165-V169 WeakPolarHBondContact O-CG2 3.31Å; L165-V169 PolarHBondContact O-N 2.77Å; L166-V169 PolarHBondContact O-N 3.31Å; Q167-V169 VanDerWaalsContact C-N 3.33Å; Q167-V169 PolarHBondContact O-N 2.53Å; V169-E171 VanDerWaalsContact C-N 3.34Å; V169-E171 PolarHBondContact O-N 3.01Å; V169-Q172 PolarHBondContact O-N 3.21Å; V169-L173 HydrophobicContact CG1-CD1 3.79Å; V169-L173 HydrophobicContact CG1-CG 4.15Å; V169-L173 WeakPolarHBondContact O-CB 3.44Å; V169-L173 VanDerWaalsContact O-CG 3.25Å; V169-L173 WeakPolarHBondContact O-CG 3.46Å; V169-L173 PolarHBondContact O-N 2.66Å
170	Q	79.5	Confident	75.3	Confident	74 Å²	74	99 Å²	99	35%	0.346	51%	0.51	S	S	.	.	H	α-helix	trans	-61.5	-40.9	179.4	-174.9	65.1	9.3	0	0	112.3	L166 Q167 L173 S174	L166-Q170 WeakPolarHBondContact O-CB 3.45Å; L166-Q170 PolarHBondContact O-N 2.85Å; Q167-Q170 WeakPolarHBondContact O-CB 3.45Å; Q167-Q170 PolarHBondContact O-N 2.74Å; Q167-Q170 VanDerWaalsContact O-N 3.15Å; Q170-L173 PolarHBondContact O-N 3.41Å; Q170-S174 WeakPolarHBondContact O-CB 3.21Å; Q170-S174 PolarHBondContact O-N 3.22Å; Q170-S174 PolarHBondContact O-OG 2.94Å
171	E	84.3	Confident	73.3	Confident	119 Å²	119	107.2 Å²	107.2	56%	0.556	55%	0.548	S	S	*	.	H	α-helix	trans	-62.3	-47.6	173.5	-72.2	172.9	-176	0	0	111.5	Q167 K168 V169 L173 S174 C175	Q167-E171 WeakPolarHBondContact O-CG 3.47Å; Q167-E171 PolarHBondContact O-N 3.49Å; K168-E171 PolarHBondContact O-N 2.98Å; V169-E171 VanDerWaalsContact C-N 3.34Å; V169-E171 PolarHBondContact O-N 3.01Å; E171-L173 VanDerWaalsContact C-N 3.34Å; E171-L173 PolarHBondContact O-N 3.05Å; E171-S174 PolarHBondContact O-N 3.44Å; E171-C175 PolarHBondContact O-N 2.9Å; E171-C175 PolarHBondContact O-SG 2.96Å; E171-C175 VanDerWaalsContact O-SG 3.35Å
172	Q	81.8	Confident	71.3	Confident	128 Å²	128	108.4 Å²	108.4	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-62.5	-39.9	178.4	-70.4	-70	-43.9	0	0	112.2	K168 V169 S174 C175 R176	K168-Q172 WeakPolarHBondContact O-CB 3.17Å; K168-Q172 WeakPolarHBondContact O-CG 3.27Å; K168-Q172 PolarHBondContact O-N 2.83Å; V169-Q172 PolarHBondContact O-N 3.21Å; Q172-S174 VanDerWaalsContact C-N 3.33Å; Q172-C175 PolarHBondContact O-N 2.84Å; Q172-R176 PolarHBondContact O-N 2.6Å; Q172-R176 VanDerWaalsContact O-N 3.09Å
173	L	75.7	Confident	69.1	Low	96 Å²	96	112.9 Å²	112.9	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-66.5	-35.5	175.9	-69.9	176.4	0	0	0	111.9	V169 Q170 E171 R176	V169-L173 HydrophobicContact CG1-CD1 3.79Å; V169-L173 HydrophobicContact CG1-CG 4.15Å; V169-L173 WeakPolarHBondContact O-CB 3.44Å; V169-L173 VanDerWaalsContact O-CG 3.25Å; V169-L173 WeakPolarHBondContact O-CG 3.46Å; V169-L173 PolarHBondContact O-N 2.66Å; Q170-L173 PolarHBondContact O-N 3.41Å; E171-L173 VanDerWaalsContact C-N 3.34Å; E171-L173 PolarHBondContact O-N 3.05Å; L173-R176 WeakPolarHBondContact O-CB 3.48Å; L173-R176 PolarHBondContact O-N 2.61Å
174	S	77.9	Confident	67.1	Low	89 Å²	89	119.6 Å²	119.6	62%	0.622	61%	0.606	S	S	*	*	H	α-helix	trans	-71.8	-31.4	176.4	-56.7	0	0	0	0	112.4	Q170 E171 Q172 R176	Q170-S174 WeakPolarHBondContact O-CB 3.21Å; Q170-S174 PolarHBondContact O-N 3.22Å; Q170-S174 PolarHBondContact O-OG 2.94Å; E171-S174 PolarHBondContact O-N 3.44Å; Q172-S174 VanDerWaalsContact C-N 3.33Å; S174-R176 VanDerWaalsContact C-N 3.34Å
175	C	70.4	Confident	65	Low	99 Å²	99	123.4 Å²	123.4	67%	0.669	61%	0.614	S	S	*	*	H	α-helix	trans	-81.4	-11.2	175.4	-70.3	0	0	0	0	113.7	E171 Q172 P177	E171-C175 PolarHBondContact O-N 2.9Å; E171-C175 PolarHBondContact O-SG 2.96Å; E171-C175 VanDerWaalsContact O-SG 3.35Å; Q172-C175 PolarHBondContact O-N 2.84Å; C175-P177 WeakPolarHBondContact O-CD 3.48Å
176	R	63.6	Low	63.1	Low	155 Å²	155	125 Å²	125	59%	0.585	63%	0.627	S	S	*	*	S	Bend	trans	-59.7	119.7	-179.8	-167	170.9	-177.7	175.3	-0.7	107	Q172 L173 S174 Q178	Q172-R176 PolarHBondContact O-N 2.6Å; Q172-R176 VanDerWaalsContact O-N 3.09Å; L173-R176 WeakPolarHBondContact O-CB 3.48Å; L173-R176 PolarHBondContact O-N 2.61Å; S174-R176 VanDerWaalsContact C-N 3.34Å; R176-Q178 PolarHBondContact O-N 2.88Å
177	P	52	Low	61.3	Low	106 Å²	106	130.5 Å²	130.5	69%	0.688	66%	0.661	S	S	*	*			trans	-55.2	119.3	172.6	22.2	-30.1	0	0	0	104.6	C175 Q179	C175-P177 WeakPolarHBondContact O-CD 3.48Å; P177-Q179 VanDerWaalsContact C-N 3.3Å; P177-Q179 PolarHBondContact O-N 2.67Å
178	Q	54.3	Low	59.3	Low	177 Å²	177	133.8 Å²	133.8	83%	0.827	67%	0.674	S	S	*	*			trans	-47.2	111.9	169.3	-72.2	-170.5	-33.6	0	0	103.3	R176 K180	R176-Q178 PolarHBondContact O-N 2.88Å; Q178-K180 PolarHBondContact O-N 2.72Å
179	Q	49.4	Very low	57.4	Low	160 Å²	160	134.8 Å²	134.8	75%	0.748	69%	0.686	S	S	*	*			trans	-60.2	87.8	164	-83	177.1	-57.3	0	0	101.3	P177 E181	P177-Q179 VanDerWaalsContact C-N 3.3Å; P177-Q179 PolarHBondContact O-N 2.67Å; Q179-E181 PolarHBondContact O-N 3.36Å
180	K	42.6	Very low	55.6	Low	185 Å²	185	137.9 Å²	137.9	80%	0.804	70%	0.696	S	S	*	*			trans	-46.1	107.1	156.5	-82.2	-178.7	176.9	175.8	0	99.8	Q178 A182	Q178-K180 PolarHBondContact O-N 2.72Å; K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 WeakPolarHBondContact O-CA 3.37Å; K180-A182 PolarHBondContact O-N 2.98Å
181	E	45	Very low	54.1	Low	174 Å²	174	136.3 Å²	136.3	81%	0.813	70%	0.7	S	S	*	*			trans	-26.5	110.1	169.2	-67	171.1	158.3	0	0	103.7	Q179 K183	Q179-E181 PolarHBondContact O-N 3.36Å; E181-K183 WeakPolarHBondContact O-CA 3.44Å; E181-K183 PolarHBondContact O-N 3.08Å
182	A	44.5	Very low	52.6	Low	94 Å²	94	139.6 Å²	139.6	78%	0.777	71%	0.712	S	S	*	*			trans	-56.1	97.1	-177.2	0	0	0	0	0	101.8	K180 Q184	K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 WeakPolarHBondContact O-CA 3.37Å; K180-A182 PolarHBondContact O-N 2.98Å; A182-Q184 VanDerWaalsContact C-N 3.29Å; A182-Q184 PolarHBondContact O-N 2.97Å
183	K	40.2	Very low	51.5	Low	184 Å²	184	144 Å²	144	80%	0.8	73%	0.725	S	S	*	*			trans	-46.6	112.8	-176.3	-93.9	-177.2	173.1	-175.7	0	99.6	E181 K185	E181-K183 WeakPolarHBondContact O-CA 3.44Å; E181-K183 PolarHBondContact O-N 3.08Å; K183-K185 WeakPolarHBondContact O-CA 3.35Å; K183-K185 PolarHBondContact O-N 2.66Å
184	Q	44.5	Very low	50.7	Low	179 Å²	179	145.7 Å²	145.7	84%	0.836	73%	0.733	S	S	*	*			trans	-40.7	105.6	-179.1	-84.8	171.9	-30.6	0	0	102.2	A182 T186	A182-Q184 VanDerWaalsContact C-N 3.29Å; A182-Q184 PolarHBondContact O-N 2.97Å; Q184-T186 PolarHBondContact O-N 2.87Å
185	K	41.7	Very low	49.6	Very low	189 Å²	189	150.3 Å²	150.3	82%	0.822	75%	0.745	S	S	*	*			trans	-69	94.4	174.9	-82.8	-177.6	178.2	178.9	0	96.4	K183 V187	K183-K185 WeakPolarHBondContact O-CA 3.35Å; K183-K185 PolarHBondContact O-N 2.66Å; K185-V187 PolarHBondContact O-N 2.69Å
186	T	40.8	Very low	49.2	Very low	122 Å²	122	151.6 Å²	151.6	75%	0.748	74%	0.744	S	S	*	*			trans	-46.4	91.8	149.2	47.3	0	0	0	0	100.7	Q184 K188	Q184-T186 PolarHBondContact O-N 2.87Å; T186-K188 PolarHBondContact O-N 2.97Å
187	V	45.2	Very low	48.9	Very low	124 Å²	124	150.6 Å²	150.6	75%	0.752	76%	0.758	S	S	*	*			trans	-59.4	94.7	163.7	178.8	0	0	0	0	99	K185 D189	K185-V187 PolarHBondContact O-N 2.69Å; V187-D189 PolarHBondContact O-N 2.85Å
188	K	44.1	Very low	49.3	Very low	154 Å²	154	149.2 Å²	149.2	67%	0.67	76%	0.763	S	S	*	*			trans	-59.7	107.2	172.7	-152.6	179.7	175.1	-150.9	0	100.1	T186 E190	T186-K188 PolarHBondContact O-N 2.97Å; K188-E190 HydrophobicContact CB-CG 4.31Å; K188-E190 HydrophobicContact CD-CG 4.25Å; K188-E190 WeakPolarHBondContact CD-OE1 3.08Å; K188-E190 WeakPolarHBondContact CE-OE1 3.22Å; K188-E190 HydrophobicContact CG-CG 4.05Å; K188-E190 IonicContact NZ-OE1 2.56Å; K188-E190 PolarHBondContact NZ-OE1 3.47Å; K188-E190 PolarHBondContact O-N 3.04Å
189	D	45.8	Very low	49.6	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	75%	0.751	S	S	*	*			trans	-70.8	57.2	-176	-160.1	15.9	0	0	0	107.5	V187 G191	V187-D189 PolarHBondContact O-N 2.85Å; D189-G191 PolarHBondContact O-N 3.18Å
190	E	43.6	Very low	49.9	Very low	134 Å²	134	142.7 Å²	142.7	63%	0.626	75%	0.747	S	S	*	*			trans	-79.5	71.5	167.8	-62.6	-166.9	-178.4	0	0	104.5	K188 K192	K188-E190 HydrophobicContact CB-CG 4.31Å; K188-E190 HydrophobicContact CD-CG 4.25Å; K188-E190 WeakPolarHBondContact CD-OE1 3.08Å; K188-E190 WeakPolarHBondContact CE-OE1 3.22Å; K188-E190 HydrophobicContact CG-CG 4.05Å; K188-E190 IonicContact NZ-OE1 2.56Å; K188-E190 PolarHBondContact NZ-OE1 3.47Å; K188-E190 PolarHBondContact O-N 3.04Å; E190-K192 PolarHBondContact O-N 2.96Å
191	G	48.5	Very low	50.5	Low	41 Å²	41	141.9 Å²	141.9	42%	0.423	75%	0.752	S	S	.	*			trans	-46.5	113.5	160.3	0	0	0	0	0	106.4	D189 Y193	D189-G191 PolarHBondContact O-N 3.18Å; G191-Y193 WeakPolarHBondContact O-CD2 3.13Å; G191-Y193 PolarHBondContact O-N 2.77Å
192	K	53.3	Low	51	Low	188 Å²	188	137.7 Å²	137.7	82%	0.817	76%	0.755	S	S	*	*			trans	-61.1	93	175.8	-174.1	-178.3	-177.2	-175.6	0	106.6	E190 I194	E190-K192 PolarHBondContact O-N 2.96Å; K192-I194 VanDerWaalsContact C-N 3.33Å; K192-I194 PolarHBondContact O-N 3.27Å
193	Y	57.8	Low	51.4	Low	221 Å²	221	140.5 Å²	140.5	87%	0.867	75%	0.752	S	S	*	*			trans	-62.3	101	173.3	-75.5	-89	0	0	0	106.8	G191 E195	G191-Y193 WeakPolarHBondContact O-CD2 3.13Å; G191-Y193 PolarHBondContact O-N 2.77Å; Y193-E195 PolarHBondContact O-N 2.88Å
194	I	59.4	Low	52.2	Low	131 Å²	131	137.9 Å²	137.9	67%	0.672	75%	0.751	S	S	*	*			trans	-73.7	110.2	166.3	-61.7	169.5	0	0	0	104.2	K192 L196	K192-I194 VanDerWaalsContact C-N 3.33Å; K192-I194 PolarHBondContact O-N 3.27Å; I194-L196 PolarHBondContact O-N 2.94Å
195	E	55.1	Low	52.7	Low	186 Å²	186	134.5 Å²	134.5	87%	0.869	74%	0.742	S	S	*	*			trans	-58.9	105.7	168.2	-88.6	-176.2	157.6	0	0	107.9	Y193 P197	Y193-E195 PolarHBondContact O-N 2.88Å; E195-P197 WeakPolarHBondContact O-CD 3.39Å
196	L	62.4	Low	53.6	Low	126 Å²	126	129.8 Å²	129.8	66%	0.66	73%	0.729	S	S	*	*			trans	-69.1	120.1	174.8	-71.7	155.9	0	0	0	107.5	I194 G198 A199	I194-L196 PolarHBondContact O-N 2.94Å; L196-G198 PolarHBondContact O-N 3.05Å; L196-A199 HydrophobicContact CB-CB 4.14Å; L196-A199 WeakPolarHBondContact O-CB 3.46Å; L196-A199 PolarHBondContact O-N 3.06Å
197	P	57.9	Low	54.5	Low	134 Å²	134	134.8 Å²	134.8	87%	0.87	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	116.2	177.6	22.6	-30.6	0	0	0	109.5	E195	E195-P197 WeakPolarHBondContact O-CD 3.39Å
198	G	59.1	Low	55.1	Low	77 Å²	77	137.2 Å²	137.2	79%	0.794	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.1	3	-177.1	0	0	0	0	0	115.9	L196 I200	L196-G198 PolarHBondContact O-N 3.05Å; G198-I200 PolarHBondContact O-N 3.15Å
199	A	60.2	Low	55.9	Low	70 Å²	70	134.6 Å²	134.6	58%	0.579	73%	0.734	S	S	*	*			trans	-72	111.3	172.9	0	0	0	0	0	111.1	L196	L196-A199 HydrophobicContact CB-CB 4.14Å; L196-A199 WeakPolarHBondContact O-CB 3.46Å; L196-A199 PolarHBondContact O-N 3.06Å
200	I	56.1	Low	56.5	Low	130 Å²	130	133.4 Å²	133.4	67%	0.667	73%	0.734	S	S	*	*			trans	-85.5	125.1	170.5	-61.4	173.5	0	0	0	107.8	G198 G202 Q203	G198-I200 PolarHBondContact O-N 3.15Å; I200-G202 PolarHBondContact O-N 3.11Å; I200-G202 VanDerWaalsContact O-N 3.16Å; I200-Q203 PolarHBondContact O-N 3.27Å
201	N	55.4	Low	56.7	Low	168 Å²	168	135.5 Å²	135.5	90%	0.898	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	120.6	179.6	-77	-18.3	0	0	0	111.1
202	G	56.4	Low	56.8	Low	85 Å²	85	138.5 Å²	138.5	88%	0.876	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.1	0.7	174.6	0	0	0	0	0	116.2	I200	I200-G202 PolarHBondContact O-N 3.11Å; I200-G202 VanDerWaalsContact O-N 3.16Å
203	Q	52.2	Low	57	Low	153 Å²	153	135.3 Å²	135.3	72%	0.715	77%	0.766	S	S	*	*			trans	-113.9	90.4	176.7	-146.4	169.8	26.9	0	0	112	I200 V205	I200-Q203 PolarHBondContact O-N 3.27Å; Q203-V205 PolarHBondContact O-N 3.23Å
204	V	56.5	Low	56.2	Low	129 Å²	129	127.2 Å²	127.2	78%	0.782	75%	0.75	S	S	*	*			trans	-76.8	101.2	170.3	178.8	0	0	0	0	107.9	V206	V204-V206 HydrophobicContact CG1-CG2 3.82Å; V204-V206 PolarHBondContact O-N 3.16Å; V204-V206 VanDerWaalsContact O-N 3.15Å
205	V	54.6	Low	55.4	Low	108 Å²	108	130.1 Å²	130.1	66%	0.655	76%	0.758	S	S	*	*			trans	-79	98.2	172.7	-178.1	0	0	0	0	108.3	Q203 R207	Q203-V205 PolarHBondContact O-N 3.23Å; V205-R207 HydrophobicContact CG1-CG 4.1Å; V205-R207 PolarHBondContact O-N 3.31Å
206	V	61.5	Low	54.9	Low	90 Å²	90	125.1 Å²	125.1	55%	0.545	76%	0.756	S	S	.	*			trans	-79.7	102.6	173.6	-169.9	0	0	0	0	108.4	V204 F208	V204-V206 HydrophobicContact CG1-CG2 3.82Å; V204-V206 PolarHBondContact O-N 3.16Å; V204-V206 VanDerWaalsContact O-N 3.15Å; V206-F208 HydrophobicContact CB-CD2 4.38Å; V206-F208 HydrophobicContact CG1-CB 4.49Å; V206-F208 HydrophobicContact CG1-CD2 3.01Å; V206-F208 HydrophobicContact CG1-CE2 3.2Å; V206-F208 HydrophobicContact CG1-CG 3.94Å; V206-F208 HydrophobicContact CG1-CZ 4.28Å; V206-F208 PolarHBondContact O-N 3.26Å; V206-F208 VanDerWaalsContact O-N 3.11Å
207	R	59.4	Low	54.1	Low	228 Å²	228	124.7 Å²	124.7	86%	0.86	76%	0.759	S	S	*	*			trans	-83.9	53.9	174.4	-70.8	-164.8	162.4	179.4	-3.1	111.5	V205 P209	V205-R207 HydrophobicContact CG1-CG 4.1Å; V205-R207 PolarHBondContact O-N 3.31Å; R207-P209 VanDerWaalsContact O-CD 3.28Å; R207-P209 WeakPolarHBondContact O-CD 3.28Å
208	F	58	Low	53.6	Low	175 Å²	175	124.4 Å²	124.4	77%	0.768	76%	0.76	S	S	*	*			trans	-66.4	120.5	167.1	-81.1	-61.6	0	0	0	107.7	V206	V206-F208 HydrophobicContact CB-CD2 4.38Å; V206-F208 HydrophobicContact CG1-CB 4.49Å; V206-F208 HydrophobicContact CG1-CD2 3.01Å; V206-F208 HydrophobicContact CG1-CE2 3.2Å; V206-F208 HydrophobicContact CG1-CG 3.94Å; V206-F208 HydrophobicContact CG1-CZ 4.28Å; V206-F208 PolarHBondContact O-N 3.26Å; V206-F208 VanDerWaalsContact O-N 3.11Å
209	P	60.5	Low	53	Low	99 Å²	99	124.9 Å²	124.9	64%	0.643	75%	0.751	S	S	*	*			trans	-57.7	138.3	174	23.6	-30.7	0	0	0	108.3	R207 E211	R207-P209 VanDerWaalsContact O-CD 3.28Å; R207-P209 WeakPolarHBondContact O-CD 3.28Å; P209-E211 PolarHBondContact O-N 3.4Å
210	P	58.1	Low	52.2	Low	128 Å²	128	127.9 Å²	127.9	83%	0.831	76%	0.762	S	S	*	*			trans	-59.6	113.8	-177.7	24.2	-32	0	0	0	108.4	A212	P210-A212 PolarHBondContact O-N 2.99Å
211	E	49.2	Very low	51.4	Low	179 Å²	179	126.1 Å²	126.1	84%	0.836	77%	0.767	S	S	*	*			trans	-57.3	135.9	168.9	-65.9	-157.6	154.1	0	0	107.9	P209 S213	P209-E211 PolarHBondContact O-N 3.4Å; E211-S213 VanDerWaalsContact C-N 3.27Å; E211-S213 PolarHBondContact O-N 2.77Å
212	A	49.8	Very low	51.3	Low	104 Å²	104	123.7 Å²	123.7	86%	0.86	76%	0.76	S	S	*	*			trans	-60.3	95.6	175.3	0	0	0	0	0	108	P210 G214	P210-A212 PolarHBondContact O-N 2.99Å; A212-G214 PolarHBondContact O-N 2.75Å
213	S	56.6	Low	51	Low	120 Å²	120	131.2 Å²	131.2	84%	0.839	78%	0.781	S	S	*	*			trans	-71	59.4	164.8	47.2	0	0	0	0	108.5	E211	E211-S213 VanDerWaalsContact C-N 3.27Å; E211-S213 PolarHBondContact O-N 2.77Å
214	G	41.8	Very low	50.9	Low	51 Å²	51	130.2 Å²	130.2	53%	0.526	78%	0.784	S	S	.	*			trans	-63.1	140	157.8	0	0	0	0	0	107.6	A212	A212-G214 PolarHBondContact O-N 2.75Å
215	F	43.5	Very low	50.7	Low	193 Å²	193	130.2 Å²	130.2	85%	0.846	78%	0.784	S	S	*	*			trans	84.2	53.4	175.8	-50.7	-79.2	0	0	0	115.8	V217	F215-V217 HydrophobicContact CB-CG1 4.48Å; F215-V217 PolarHBondContact O-N 2.89Å
216	G	43.6	Very low	50.4	Low	80 Å²	80	131.4 Å²	131.4	83%	0.825	79%	0.791	S	S	*	*			trans	-61.6	83	138.3	0	0	0	0	0	109.1	S218	G216-S218 PolarHBondContact O-N 3.16Å; G216-S218 VanDerWaalsContact O-N 3.16Å
217	V	46.8	Very low	49.8	Very low	118 Å²	118	133.9 Å²	133.9	72%	0.715	81%	0.806	S	S	*	*			trans	-57	112.5	169.8	-78.7	0	0	0	0	108.6	F215 S219	F215-V217 HydrophobicContact CB-CG1 4.48Å; F215-V217 PolarHBondContact O-N 2.89Å; V217-S219 PolarHBondContact O-N 3.1Å; V217-S219 VanDerWaalsContact O-N 3.1Å
218	S	46.7	Very low	49.2	Very low	128 Å²	128	128 Å²	128	90%	0.895	80%	0.802	S	S	*	*			trans	-68.2	104.7	170.9	66.6	0	0	0	0	108.2	G216	G216-S218 PolarHBondContact O-N 3.16Å; G216-S218 VanDerWaalsContact O-N 3.16Å
219	S	46.1	Very low	48.6	Very low	87 Å²	87	124.9 Å²	124.9	61%	0.608	81%	0.805	S	S	*	*			trans	-143.1	108	168.5	-168.6	0	0	0	0	109.8	V217	V217-S219 PolarHBondContact O-N 3.1Å; V217-S219 VanDerWaalsContact O-N 3.1Å
220	T	43.8	Very low	47.8	Very low	132 Å²	132	126.7 Å²	126.7	81%	0.81	82%	0.816	S	S	*	*			trans	65.1	134.3	137.5	61.5	0	0	0	0	117
221	A	39.5	Very low	47	Very low	93 Å²	93	126.6 Å²	126.6	77%	0.769	82%	0.815	S	S	*	*			cis	-172.4	175.7	40.8	0	0	0	0	0	109.9
222	P	53.6	Low	46.8	Very low	117 Å²	117	122.3 Å²	122.3	76%	0.76	81%	0.813	S	S	*	*			trans	-93.3	158.7	-164.9	38.2	-32.4	0	0	0	113.9
223	D	49.7	Very low	46.5	Very low	244 Å²	244	123.9 Å²	123.9	100%	1.305	81%	0.809	S	S	*	*			trans	-138.7	0	144.7	-95.7	-34.8	0	0	0	108.4

Retrieved 223 of 223 residues in 204.5 ms (Link to these results)

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