A0A096N4F6_PAPAN Loading...

Stromal interaction molecule 1

AlphaFold DB (A0A2K5X2B5), UniProt , Accession A0A096N4F6, Species PAPAN (Papio anubis, Olive baboon), Gene STIM1, Length 715 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	48.6	Very low	62.1	Low	212 Å²	212	127.4 Å²	127.4	100%	1.044	66%	0.656	S	S	*	*				0	45.3	0	-67.1	155.8	176.4	0	0	110.4
2	D	58.4	Low	61.3	Low	114 Å²	114	127.5 Å²	127.5	61%	0.61	66%	0.658	S	S	*	*	H	α-helix	trans	-96.9	-6.7	-147.8	-53.8	-97.2	0	0	0	114.8	R6	D2-R6 WeakPolarHBondContact O-CG 3.31Å; D2-R6 PolarHBondContact O-N 2.88Å
3	V	59.5	Low	60.4	Low	107 Å²	107	132.5 Å²	132.5	65%	0.648	66%	0.663	S	S	*	*	H	α-helix	trans	-75.3	-40.9	-176.4	-176.8	0	0	0	0	111.3	R6 L7	V3-R6 PolarHBondContact O-N 3.46Å; V3-L7 HydrophobicContact CG1-CD1 4.07Å; V3-L7 PolarHBondContact O-N 3.32Å
4	C	57.1	Low	59.5	Low	100 Å²	100	126.1 Å²	126.1	68%	0.676	65%	0.648	S	S	*	*	H	α-helix	trans	-67	-43.1	-178.3	-65.3	0	0	0	0	112.3	R6 L7 A8	C4-R6 VanDerWaalsContact C-N 3.33Å; C4-R6 PolarHBondContact O-N 3.36Å; C4-L7 PolarHBondContact O-N 2.94Å; C4-A8 WeakPolarHBondContact O-CB 3.13Å; C4-A8 PolarHBondContact O-N 3.21Å
5	V	67.3	Low	58.4	Low	92 Å²	92	126.5 Å²	126.5	56%	0.558	65%	0.651	S	S	*	*	H	α-helix	trans	-64	-38.8	179.1	-176.7	0	0	0	0	111.3	A8 L9	V5-A8 PolarHBondContact O-N 2.74Å; V5-L9 HydrophobicContact CG1-CD1 4.41Å; V5-L9 PolarHBondContact O-N 3.19Å; V5-L9 VanDerWaalsContact O-N 3.14Å
6	R	66.3	Low	57.4	Low	187 Å²	187	127.4 Å²	127.4	71%	0.706	66%	0.656	S	S	*	*	H	α-helix	trans	-69.9	-38.3	177.2	-70.7	177.7	-179.2	-150.3	-1.7	112.5	D2 V3 C4 W10	D2-R6 WeakPolarHBondContact O-CG 3.31Å; D2-R6 PolarHBondContact O-N 2.88Å; V3-R6 PolarHBondContact O-N 3.46Å; C4-R6 VanDerWaalsContact C-N 3.33Å; C4-R6 PolarHBondContact O-N 3.36Å; R6-W10 WeakPolarHBondContact O-CB 3.13Å; R6-W10 PolarHBondContact O-N 3.42Å; R6-W10 VanDerWaalsContact O-N 3.1Å
7	L	68.5	Low	56.4	Low	102 Å²	102	129 Å²	129	53%	0.534	67%	0.665	S	S	.	*	H	α-helix	trans	-65.5	-42	173.1	-81.4	165.4	0	0	0	112.2	V3 C4 L9 W10 L11	V3-L7 HydrophobicContact CG1-CD1 4.07Å; V3-L7 PolarHBondContact O-N 3.32Å; C4-L7 PolarHBondContact O-N 2.94Å; L7-L9 PolarHBondContact O-N 3.07Å; L7-W10 PolarHBondContact O-N 3.26Å; L7-L11 WeakPolarHBondContact O-CB 3.38Å; L7-L11 WeakPolarHBondContact O-CG 3.43Å; L7-L11 PolarHBondContact O-N 2.81Å
8	A	67.3	Low	55.3	Low	60 Å²	60	131.4 Å²	131.4	50%	0.496	67%	0.673	S	S	.	*	H	α-helix	trans	-59.5	-47.1	176.9	0	0	0	0	0	112	C4 V5 W10 L11 L12	C4-A8 WeakPolarHBondContact O-CB 3.13Å; C4-A8 PolarHBondContact O-N 3.21Å; V5-A8 PolarHBondContact O-N 2.74Å; A8-W10 PolarHBondContact O-N 2.88Å; A8-L11 PolarHBondContact O-N 3.32Å; A8-L12 WeakPolarHBondContact O-CB 3.41Å; A8-L12 PolarHBondContact O-N 3.48Å
9	L	64	Low	54.2	Low	113 Å²	113	134.6 Å²	134.6	59%	0.592	68%	0.684	S	S	*	*	H	α-helix	trans	-63.2	-38.4	176.2	-84.9	161.4	0	0	0	113.1	V5 L7 L12 W13	V5-L9 HydrophobicContact CG1-CD1 4.41Å; V5-L9 PolarHBondContact O-N 3.19Å; V5-L9 VanDerWaalsContact O-N 3.14Å; L7-L9 PolarHBondContact O-N 3.07Å; L9-L12 PolarHBondContact O-N 3.13Å; L9-W13 PolarHBondContact O-N 3.23Å
10	W	65.3	Low	53.2	Low	201 Å²	201	131.4 Å²	131.4	76%	0.761	69%	0.687	S	S	*	*	H	α-helix	trans	-70.4	-37.7	179.3	-135.9	77.4	0	0	0	112.5	R6 L7 A8 G14	R6-W10 WeakPolarHBondContact O-CB 3.13Å; R6-W10 PolarHBondContact O-N 3.42Å; R6-W10 VanDerWaalsContact O-N 3.1Å; L7-W10 PolarHBondContact O-N 3.26Å; A8-W10 PolarHBondContact O-N 2.88Å; W10-G14 PolarHBondContact O-N 3.43Å
11	L	60.9	Low	52.2	Low	113 Å²	113	134.5 Å²	134.5	59%	0.592	70%	0.698	S	S	*	*	H	α-helix	trans	-68.4	-38.5	174.4	-70.4	169.1	0	0	0	111.9	L7 A8 W13 G14 L15	L7-L11 WeakPolarHBondContact O-CB 3.38Å; L7-L11 WeakPolarHBondContact O-CG 3.43Å; L7-L11 PolarHBondContact O-N 2.81Å; A8-L11 PolarHBondContact O-N 3.32Å; L11-W13 PolarHBondContact O-N 3.26Å; L11-G14 PolarHBondContact O-N 3.27Å; L11-L15 VanDerWaalsContact O-CD1 3.28Å; L11-L15 WeakPolarHBondContact O-CD1 3.36Å; L11-L15 PolarHBondContact O-N 3.42Å; L11-L15 VanDerWaalsContact O-N 3.12Å
12	L	52.4	Low	51.1	Low	129 Å²	129	129.7 Å²	129.7	68%	0.675	69%	0.685	S	S	*	*	H	α-helix	trans	-63.2	-41.7	177.9	-156	78.4	0	0	0	112.1	A8 L9	A8-L12 WeakPolarHBondContact O-CB 3.41Å; A8-L12 PolarHBondContact O-N 3.48Å; L9-L12 PolarHBondContact O-N 3.13Å
13	W	49.3	Very low	49.6	Very low	192 Å²	192	132 Å²	132	73%	0.727	70%	0.697	S	S	*	*	H	α-helix	trans	-70.6	-32	172.8	-108	-3.5	0	0	0	113	L9 L11 L16	L9-W13 PolarHBondContact O-N 3.23Å; L11-W13 PolarHBondContact O-N 3.26Å; W13-L16 PolarHBondContact O-N 2.95Å
14	G	48.5	Very low	48.1	Very low	44 Å²	44	131.5 Å²	131.5	45%	0.454	70%	0.697	S	S	.	*	H	α-helix	trans	-63.2	-38.6	176.6	0	0	0	0	0	113.7	W10 L11	W10-G14 PolarHBondContact O-N 3.43Å; L11-G14 PolarHBondContact O-N 3.27Å
15	L	43.1	Very low	46.5	Very low	132 Å²	132	134.8 Å²	134.8	69%	0.691	70%	0.703	S	S	*	*	H	α-helix	trans	-70.3	-37	176	-89.4	79.4	0	0	0	112.5	L11 L17 H18	L11-L15 VanDerWaalsContact O-CD1 3.28Å; L11-L15 WeakPolarHBondContact O-CD1 3.36Å; L11-L15 PolarHBondContact O-N 3.42Å; L11-L15 VanDerWaalsContact O-N 3.12Å; L15-L17 PolarHBondContact O-N 3.49Å; L15-H18 PolarHBondContact O-N 2.89Å
16	L	41.4	Very low	44.5	Very low	140 Å²	140	136.7 Å²	136.7	73%	0.733	71%	0.708	S	S	*	*	H	α-helix	trans	-68.3	-17.9	-174.8	-128.5	75.6	0	0	0	114.4	W13	W13-L16 PolarHBondContact O-N 2.95Å
17	L	40.5	Very low	42.5	Very low	155 Å²	155	135.5 Å²	135.5	81%	0.812	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-0.8	-175.4	-80	165	0	0	0	114.6	L15	L15-L17 PolarHBondContact O-N 3.49Å
18	H	36.4	Very low	40.6	Very low	173 Å²	173	135.3 Å²	135.3	80%	0.801	72%	0.718	S	S	*	*	S	Bend	trans	-110.2	8.9	-173.8	-150.7	-65.1	0	0	0	114.5	L15	L15-H18 PolarHBondContact O-N 2.89Å
19	Q	35.1	Very low	38.6	Very low	191 Å²	191	141.3 Å²	141.3	89%	0.893	74%	0.736	S	S	*	*	S	Bend	trans	-124.3	70	-177.2	-165	159.2	-3.9	0	0	111.1
20	G	33.7	Very low	37	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	74%	0.744	S	S	*	*			trans	-164.5	41.3	-171.3	0	0	0	0	0	115.8
21	Q	33.3	Very low	35.1	Very low	196 Å²	196	140 Å²	140	92%	0.916	75%	0.751	S	S	*	*			trans	-160.3	150.3	168.1	-116.2	166.5	52	0	0	111.7
22	S	25.1	Very low	33.6	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	76%	0.757	S	S	*	*			trans	73.2	137.7	-170.7	-145.5	0	0	0	0	113.4
23	L	26.4	Very low	32.3	Very low	164 Å²	164	137.4 Å²	137.4	86%	0.859	76%	0.759	S	S	*	*			cis	-140.9	-179.2	1.9	-162.6	63.5	0	0	0	110.3
24	S	27.7	Very low	31.2	Very low	95 Å²	95	134.4 Å²	134.4	66%	0.664	76%	0.762	S	S	*	*			trans	-108.4	165.5	-164.5	56.3	0	0	0	0	116.7
25	H	23.4	Very low	30.7	Very low	169 Å²	169	137.5 Å²	137.5	78%	0.782	78%	0.777	S	S	*	*				112.1	143.2	128.3	-151.8	-141.2	0	0	0	118.9
26	I	25.7	Very low	30.1	Very low	132 Å²	132	136.6 Å²	136.6	68%	0.677	78%	0.781	S	S	*	*			trans	75.9	144.1	165.3	-47.4	-167.6	0	0	0	115.4
27	H	23.5	Very low	29.8	Very low	162 Å²	162	133.7 Å²	133.7	75%	0.75	79%	0.785	S	S	*	*			cis	-126.1	168.8	0	-145	-82.1	0	0	0	111.5
28	S	30.3	Very low	29.5	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	78%	0.775	S	S	*	*			trans	-117.7	132.4	159.1	172.2	0	0	0	0	109.2
29	E	23.6	Very low	29.4	Very low	186 Å²	186	128.3 Å²	128.3	87%	0.869	77%	0.774	S	S	*	*			trans	-127.3	159.7	161.2	-81.2	-155	84.8	0	0	111.1
30	K	32	Very low	30.1	Very low	177 Å²	177	122.7 Å²	122.7	77%	0.77	76%	0.755	S	S	*	*			trans	-142.4	100.6	-162.6	176	-166.8	172.3	-174.6	0	109.6	T32	K30-T32 HydrophobicContact CD-CG2 4.39Å; K30-T32 HydrophobicContact CG-CG2 4.2Å
31	A	23.9	Very low	30.9	Very low	109 Å²	109	126.5 Å²	126.5	90%	0.901	75%	0.754	S	S	*	*			trans	-83	142.5	164.3	0	0	0	0	0	110.1
32	T	29.6	Very low	31.6	Very low	118 Å²	118	125 Å²	125	72%	0.724	75%	0.747	S	S	*	*			trans	-126.7	132.8	-177.6	51.5	0	0	0	0	112.4	K30	K30-T32 HydrophobicContact CD-CG2 4.39Å; K30-T32 HydrophobicContact CG-CG2 4.2Å
33	G	25.1	Very low	33.4	Very low	70 Å²	70	123.1 Å²	123.1	72%	0.722	73%	0.734	S	S	*	*			trans	131.4	154.3	168.8	0	0	0	0	0	112.4
34	T	27	Very low	35.4	Very low	128 Å²	128	117.4 Å²	117.4	79%	0.785	71%	0.706	S	S	*	*			cis	-151.7	150.7	-12.4	-72.4	0	0	0	0	107.8	S36	T34-S36 PolarHBondContact O-N 3.05Å
35	S	38.3	Very low	37.2	Very low	109 Å²	109	114.5 Å²	114.5	76%	0.762	69%	0.688	S	S	*	*			trans	-60.7	129.6	179.2	52.8	0	0	0	0	113.2
36	S	29.2	Very low	39.4	Very low	113 Å²	113	108.8 Å²	108.8	79%	0.79	67%	0.669	S	S	*	*			trans	-153.8	48.2	167.9	-73.7	0	0	0	0	112.2	T34 A38	T34-S36 PolarHBondContact O-N 3.05Å; S36-A38 PolarHBondContact O-N 3.36Å
37	G	36.6	Very low	41.8	Very low	79 Å²	79	104.6 Å²	104.6	81%	0.814	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	104.6	172.6	0	0	0	0	0	111.4
38	A	34.4	Very low	44.4	Very low	73 Å²	73	97 Å²	97	60%	0.603	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.4	-40.5	166	0	0	0	0	0	112.1	S36	S36-A38 PolarHBondContact O-N 3.36Å
39	N	33.9	Very low	46.8	Very low	143 Å²	143	94.6 Å²	94.6	77%	0.765	59%	0.594	S	S	*	*	S	Bend	trans	-97.4	-2.2	-164.8	-68.3	10.3	0	0	0	115.2
40	S	49.7	Very low	49.4	Very low	72 Å²	72	95.9 Å²	95.9	50%	0.503	59%	0.591	S	S	.	*	S	Bend	trans	-81.7	-39.9	-176.2	45.4	0	0	0	0	113.5	E42 S43 T44	S40-E42 PolarHBondContact O-N 3.43Å; S40-S43 WeakPolarHBondContact O-CB 3.33Å; S40-S43 PolarHBondContact O-N 2.65Å; S40-S43 VanDerWaalsContact O-N 3.13Å; S40-T44 PolarHBondContact O-N 3.1Å; S40-T44 VanDerWaalsContact O-N 3.14Å
41	E	50	Low	51.6	Low	151 Å²	151	89.5 Å²	89.5	71%	0.706	57%	0.565	S	S	*	*	H	α-helix	trans	-67.8	-34.3	-170.8	-64.7	170.5	-166.6	0	0	113	S43 T44 A45	E41-S43 VanDerWaalsContact C-N 3.3Å; E41-S43 PolarHBondContact O-N 3.33Å; E41-T44 PolarHBondContact O-OG1 2.92Å; E41-A45 PolarHBondContact O-N 3.26Å
42	E	49	Very low	54.1	Low	165 Å²	165	84.9 Å²	84.9	77%	0.771	53%	0.525	S	S	*	.	H	α-helix	trans	-70.8	-28.5	175.3	-167.2	167.8	-159.3	0	0	111.9	S40 A46	S40-E42 PolarHBondContact O-N 3.43Å; E42-A46 VanDerWaalsContact O-CB 3.31Å; E42-A46 WeakPolarHBondContact O-CB 3.25Å; E42-A46 PolarHBondContact O-N 3.05Å
43	S	61.8	Low	56.2	Low	71 Å²	71	87.1 Å²	87.1	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-71.1	-46.9	174	-166.7	0	0	0	0	111.6	S40 E41 A45 A46 E47	S40-S43 WeakPolarHBondContact O-CB 3.33Å; S40-S43 PolarHBondContact O-N 2.65Å; S40-S43 VanDerWaalsContact O-N 3.13Å; E41-S43 VanDerWaalsContact C-N 3.3Å; E41-S43 PolarHBondContact O-N 3.33Å; S43-A45 VanDerWaalsContact C-N 3.34Å; S43-A45 PolarHBondContact O-N 3.06Å; S43-A46 PolarHBondContact O-N 3.15Å; S43-E47 WeakPolarHBondContact O-CB 3.5Å; S43-E47 PolarHBondContact O-N 3.39Å
44	T	68.3	Low	58.5	Low	44 Å²	44	88.9 Å²	88.9	27%	0.27	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-39.3	-177.7	61.7	0	0	0	0	111.8	S40 E41 F48	S40-T44 PolarHBondContact O-N 3.1Å; S40-T44 VanDerWaalsContact O-N 3.14Å; E41-T44 PolarHBondContact O-OG1 2.92Å; T44-F48 WeakPolarHBondContact O-CB 3.01Å; T44-F48 PolarHBondContact O-N 3.29Å
45	A	65.2	Low	60.8	Low	35 Å²	35	85.5 Å²	85.5	29%	0.289	50%	0.501	S	S	.	.	H	α-helix	trans	-67.8	-40.6	176	0	0	0	0	0	112.6	E41 S43 C49	E41-A45 PolarHBondContact O-N 3.26Å; S43-A45 VanDerWaalsContact C-N 3.34Å; S43-A45 PolarHBondContact O-N 3.06Å; A45-C49 PolarHBondContact O-N 2.91Å
46	A	70.9	Confident	62.6	Low	48 Å²	48	80.6 Å²	80.6	40%	0.397	47%	0.466	S	S	.	.	H	α-helix	trans	-68.6	-35.5	177.4	0	0	0	0	0	112.7	E42 S43 R50	E42-A46 VanDerWaalsContact O-CB 3.31Å; E42-A46 WeakPolarHBondContact O-CB 3.25Å; E42-A46 PolarHBondContact O-N 3.05Å; S43-A46 PolarHBondContact O-N 3.15Å; A46-R50 WeakPolarHBondContact O-CG 3.19Å; A46-R50 PolarHBondContact O-N 2.95Å
47	E	76.1	Confident	64.7	Low	45 Å²	45	82.7 Å²	82.7	21%	0.21	46%	0.463	C	S	.	.	H	α-helix	trans	-66.1	-49.8	173.7	-172.1	171.2	-157.2	0	0	110.7	S43 C49 R50 I51 R69	S43-E47 WeakPolarHBondContact O-CB 3.5Å; S43-E47 PolarHBondContact O-N 3.39Å; E47-C49 VanDerWaalsContact C-N 3.3Å; E47-C49 PolarHBondContact O-N 2.93Å; E47-R50 WeakPolarHBondContact O-CB 3.36Å; E47-R50 PolarHBondContact O-N 3.16Å; E47-I51 HydrophobicContact CG-CD1 4.1Å; E47-I51 WeakPolarHBondContact O-CG1 3.45Å; E47-I51 PolarHBondContact O-N 3.17Å; E47-I51 VanDerWaalsContact O-N 3.17Å; E47-R69 IonicContact OE1-CZ 2.81Å; E47-R69 IonicContact OE1-NH1 3.57Å; E47-R69 IonicContact OE1-NH2 3.42Å; E47-R69 PolarHBondContact OE1-NH2 3.28Å; E47-R69 IonicContact OE2-CZ 3.26Å; E47-R69 IonicContact OE2-NH1 3.37Å; E47-R69 PolarHBondContact OE2-NH1 2.81Å; E47-R69 IonicContact OE2-NH2 3.85Å; E47-R69 PolarHBondContact OE2-NH2 3.37Å
48	F	78.5	Confident	66.9	Low	2 Å²	2	81 Å²	81	1%	0.009	44%	0.438	C	S	.	.	H	α-helix	trans	-57.6	-40.2	174.9	-173.1	-135.4	0	0	0	112.7	T44 R50 I51 D52 C56 E61 K62 F65 W121	T44-F48 WeakPolarHBondContact O-CB 3.01Å; T44-F48 PolarHBondContact O-N 3.29Å; F48-R50 PolarHBondContact O-N 3.4Å; F48-I51 PolarHBondContact O-N 2.97Å; F48-D52 HydrophobicContact CD2-CB 4.19Å; F48-D52 HydrophobicContact CE2-CB 3.74Å; F48-D52 HydrophobicContact CZ-CB 4.31Å; F48-D52 PolarHBondContact O-N 2.73Å; F48-C56 HydrophobicContact CD1-CB 3.65Å; F48-C56 HydrophobicContact CE1-CB 4.02Å; F48-C56 HydrophobicContact CG-CB 4.25Å; F48-E61 HydrophobicContact CE1-CB 4.12Å; F48-E61 HydrophobicContact CZ-CB 3.97Å; F48-K62 HydrophobicContact CD1-CB 4.47Å; F48-K62 HydrophobicContact CD1-CG 3.78Å; F48-K62 HydrophobicContact CE1-CB 4.48Å; F48-K62 HydrophobicContact CE1-CG 3.95Å; F48-F65 HydrophobicContact CB-CD1 3.69Å; F48-F65 HydrophobicContact CB-CE1 3.84Å; F48-F65 HydrophobicContact CB-CG 4.39Å; F48-F65 HydrophobicContact CD2-CB 3.63Å; F48-F65 AromaticContact CD2-CD1 3.48Å; F48-F65 HydrophobicContact CD2-CD1 3.48Å; F48-F65 VanDerWaalsContact CD2-CD1 3.48Å; F48-F65 AromaticContact CD2-CD2 3.66Å; F48-F65 HydrophobicContact CD2-CD2 3.66Å; F48-F65 HydrophobicContact CD2-CE1 4.03Å; F48-F65 HydrophobicContact CD2-CE2 4.19Å; F48-F65 AromaticContact CD2-CG 3.27Å; F48-F65 HydrophobicContact CD2-CG 3.27Å; F48-F65 HydrophobicContact CD2-CZ 4.37Å; F48-F65 HydrophobicContact CE1-CB 4.44Å; F48-F65 HydrophobicContact CE2-CB 3.5Å; F48-F65 HydrophobicContact CE2-CD1 4.27Å; F48-F65 AromaticContact CE2-CD2 3.92Å; F48-F65 HydrophobicContact CE2-CD2 3.92Å; F48-F65 AromaticContact CE2-CG 3.62Å; F48-F65 HydrophobicContact CE2-CG 3.62Å; F48-F65 HydrophobicContact CG-CB 4.19Å; F48-F65 AromaticContact CG-CD1 3.7Å; F48-F65 HydrophobicContact CG-CD1 3.7Å; F48-F65 HydrophobicContact CG-CE1 4.27Å; F48-F65 AromaticContact CG-CG 3.93Å; F48-F65 HydrophobicContact CG-CG 3.93Å; F48-F65 HydrophobicContact CZ-CB 3.95Å; F48-F65 HydrophobicContact CZ-CG 4.49Å; F48-W121 AromaticContact CE2-CE2 3.68Å; F48-W121 HydrophobicContact CE2-CH2 4.46Å; F48-W121 AromaticContact CE2-CZ2 3.59Å; F48-W121 HydrophobicContact CE2-CZ2 3.59Å; F48-W121 AromaticContact CE2-NE1 3.62Å; F48-W121 AromaticContact CZ-CZ2 3.84Å; F48-W121 HydrophobicContact CZ-CZ2 3.84Å
49	C	79.8	Confident	69.1	Low	48 Å²	48	83 Å²	83	32%	0.324	44%	0.436	S	S	.	.	H	α-helix	trans	-68	-13.6	174.4	-76.2	0	0	0	0	115.5	A45 E47 C56	A45-C49 PolarHBondContact O-N 2.91Å; E47-C49 VanDerWaalsContact C-N 3.3Å; E47-C49 PolarHBondContact O-N 2.93Å; C49-C56 WeakPolarHBondContact CA-SG 3.46Å; C49-C56 HydrophobicContact CB-CB 3.82Å; C49-C56 WeakPolarHBondContact CB-SG 3.45Å; C49-C56 WeakPolarHBondContact SG-CB 3.44Å; C49-C56 CovalentContact SG-SG 2.04Å; C49-C56 PolarHBondContact SG-SG 3.14Å
50	R	78.6	Confident	71.4	Confident	214 Å²	214	80.3 Å²	80.3	81%	0.808	42%	0.421	S	S	*	.	H	α-helix	trans	-83.7	-42.7	169.3	-65.8	167.8	-174.5	-176	2.2	111.1	A46 E47 F48	A46-R50 WeakPolarHBondContact O-CG 3.19Å; A46-R50 PolarHBondContact O-N 2.95Å; E47-R50 WeakPolarHBondContact O-CB 3.36Å; E47-R50 PolarHBondContact O-N 3.16Å; F48-R50 PolarHBondContact O-N 3.4Å
51	I	78.7	Confident	73.2	Confident	43 Å²	43	77.3 Å²	77.3	22%	0.221	40%	0.399	C	S	.	.	H	α-helix	trans	-74.7	-40	-175.1	-57	164.6	0	0	0	110.8	E47 F48 F65 E118	E47-I51 HydrophobicContact CG-CD1 4.1Å; E47-I51 WeakPolarHBondContact O-CG1 3.45Å; E47-I51 PolarHBondContact O-N 3.17Å; E47-I51 VanDerWaalsContact O-N 3.17Å; F48-I51 PolarHBondContact O-N 2.97Å; I51-F65 HydrophobicContact CD1-CE1 4.42Å; I51-F65 HydrophobicContact CD1-CE2 3.92Å; I51-F65 HydrophobicContact CD1-CZ 3.48Å; I51-F65 VanDerWaalsContact CD1-CZ 3.48Å; I51-E118 HydrophobicContact CB-CG 4.4Å; I51-E118 HydrophobicContact CD1-CG 3.73Å; I51-E118 HydrophobicContact CG1-CG 3.64Å; I51-E118 HydrophobicContact CG2-CB 4.29Å; I51-E118 HydrophobicContact CG2-CG 3.89Å
52	D	75.8	Confident	75	Confident	11 Å²	11	72.9 Å²	72.9	6%	0.059	38%	0.377	C	S	.	.			trans	-142.8	64.6	-172.6	-160.8	2.6	0	0	0	112.9	F48 P54 L55 C56 W121 K125	F48-D52 HydrophobicContact CD2-CB 4.19Å; F48-D52 HydrophobicContact CE2-CB 3.74Å; F48-D52 HydrophobicContact CZ-CB 4.31Å; F48-D52 PolarHBondContact O-N 2.73Å; D52-P54 VanDerWaalsContact C-N 3.34Å; D52-P54 WeakPolarHBondContact OD1-CD 3.44Å; D52-P54 WeakPolarHBondContact OD1-CG 3.42Å; D52-L55 PolarHBondContact O-N 2.86Å; D52-L55 VanDerWaalsContact O-N 3.13Å; D52-C56 PolarHBondContact O-N 2.64Å; D52-W121 PolarHBondContact OD2-NE1 2.77Å; D52-K125 IonicContact OD1-NZ 3.2Å; D52-K125 IonicContact OD2-NZ 3.13Å; D52-K125 PolarHBondContact OD2-NZ 2.94Å
53	K	73.5	Confident	76.8	Confident	165 Å²	165	69 Å²	69	72%	0.717	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-37.2	-179.8	-165.9	170.8	-175.3	174.1	0	116.5
54	P	73.4	Confident	78.1	Confident	108 Å²	108	65.6 Å²	65.6	70%	0.701	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-30.5	178.3	29	-35.2	0	0	0	114.2	D52	D52-P54 VanDerWaalsContact C-N 3.34Å; D52-P54 WeakPolarHBondContact OD1-CD 3.44Å; D52-P54 WeakPolarHBondContact OD1-CG 3.42Å
55	L	75.5	Confident	79.2	Confident	57 Å²	57	63.8 Å²	63.8	30%	0.298	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-13.7	-174.9	-69	176.6	0	0	0	114	D52 H57 S58 E61 K125	D52-L55 PolarHBondContact O-N 2.86Å; D52-L55 VanDerWaalsContact O-N 3.13Å; L55-H57 PolarHBondContact O-N 3.24Å; L55-S58 PolarHBondContact O-N 3.29Å; L55-E61 HydrophobicContact CB-CB 4.4Å; L55-E61 HydrophobicContact CB-CG 4.27Å; L55-E61 HydrophobicContact CD2-CG 4.43Å; L55-K125 HydrophobicContact CD1-CD 4.33Å
56	C	75.7	Confident	80.4	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.034	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-0.7	-177.6	86.5	0	0	0	0	116.5	F48 C49 D52 K62	F48-C56 HydrophobicContact CD1-CB 3.65Å; F48-C56 HydrophobicContact CE1-CB 4.02Å; F48-C56 HydrophobicContact CG-CB 4.25Å; C49-C56 WeakPolarHBondContact CA-SG 3.46Å; C49-C56 HydrophobicContact CB-CB 3.82Å; C49-C56 WeakPolarHBondContact CB-SG 3.45Å; C49-C56 WeakPolarHBondContact SG-CB 3.44Å; C49-C56 CovalentContact SG-SG 2.04Å; C49-C56 PolarHBondContact SG-SG 3.14Å; D52-C56 PolarHBondContact O-N 2.64Å; C56-K62 WeakPolarHBondContact O-CE 3.32Å
57	H	72.6	Confident	81.4	Confident	158 Å²	158	64.7 Å²	64.7	73%	0.731	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.4	170.1	-62	-39.6	0	0	0	114.1	L55	L55-H57 PolarHBondContact O-N 3.24Å
58	S	83.1	Confident	82.2	Confident	42 Å²	42	62.5 Å²	62.5	29%	0.294	31%	0.308	S	S	.	.			trans	-94.7	124.6	173.6	177.9	0	0	0	0	110.9	L55 D60 E61 K62	L55-S58 PolarHBondContact O-N 3.29Å; S58-D60 VanDerWaalsContact C-N 3.34Å; S58-E61 PolarHBondContact O-N 2.86Å; S58-E61 PolarHBondContact OG-N 2.88Å; S58-K62 WeakPolarHBondContact O-CG 3.44Å; S58-K62 PolarHBondContact O-N 3.46Å; S58-K62 VanDerWaalsContact O-N 3.08Å
59	E	81.3	Confident	82.8	Confident	117 Å²	117	66.1 Å²	66.1	55%	0.547	32%	0.321	S	S	.	.	H	α-helix	trans	-67.5	-33.6	176.5	-55.6	-51.6	129.4	0	0	112.3	E61 K62 L63	E59-E61 VanDerWaalsContact C-N 3.34Å; E59-E61 PolarHBondContact O-N 2.96Å; E59-K62 PolarHBondContact O-N 3.03Å; E59-K62 IonicContact OE1-NZ 3.06Å; E59-K62 PolarHBondContact OE1-NZ 2.67Å; E59-K62 WeakPolarHBondContact OE2-CD 3.48Å; E59-K62 IonicContact OE2-NZ 2.64Å; E59-K62 PolarHBondContact OE2-NZ 3.41Å; E59-L63 VanDerWaalsContact O-CG 3.3Å; E59-L63 WeakPolarHBondContact O-CG 3.39Å; E59-L63 PolarHBondContact O-N 3.2Å; E59-L63 VanDerWaalsContact O-N 3.09Å
60	D	82.6	Confident	83.3	Confident	85 Å²	85	66.9 Å²	66.9	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-39.9	174.7	-83.9	-68.7	0	0	0	112	S58 L63 S64 R166	S58-D60 VanDerWaalsContact C-N 3.34Å; D60-L63 PolarHBondContact O-N 3.02Å; D60-S64 PolarHBondContact O-N 2.95Å; D60-S64 PolarHBondContact O-OG 3.45Å; D60-R166 IonicContact OD1-CZ 3.58Å; D60-R166 IonicContact OD1-NH1 3.51Å; D60-R166 PolarHBondContact OD1-NH1 3.16Å; D60-R166 IonicContact OD1-NH2 3.35Å; D60-R166 PolarHBondContact OD1-NH2 3.49Å
61	E	86.6	Confident	84	Confident	9 Å²	9	56.7 Å²	56.7	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-73	-36.6	178.3	-65.2	-54	136.5	0	0	112.3	F48 L55 S58 E59 L63 S64 F65 H162	F48-E61 HydrophobicContact CE1-CB 4.12Å; F48-E61 HydrophobicContact CZ-CB 3.97Å; L55-E61 HydrophobicContact CB-CB 4.4Å; L55-E61 HydrophobicContact CB-CG 4.27Å; L55-E61 HydrophobicContact CD2-CG 4.43Å; S58-E61 PolarHBondContact O-N 2.86Å; S58-E61 PolarHBondContact OG-N 2.88Å; E59-E61 VanDerWaalsContact C-N 3.34Å; E59-E61 PolarHBondContact O-N 2.96Å; E61-L63 VanDerWaalsContact C-N 3.32Å; E61-L63 PolarHBondContact O-N 3.39Å; E61-S64 PolarHBondContact O-N 2.92Å; E61-F65 WeakPolarHBondContact O-CB 3.41Å; E61-F65 PolarHBondContact O-N 3.38Å; E61-H162 IonicContact OE1-CD2 2.72Å; E61-H162 PolarHBondContact OE1-CD2 3.42Å; E61-H162 IonicContact OE1-CG 3.52Å
62	K	87.2	Confident	84.7	Confident	58 Å²	58	54.8 Å²	54.8	25%	0.252	27%	0.274	S	S	.	.	H	α-helix	trans	-57.2	-46.9	170.5	-71.5	172.8	-169.2	171.9	0	111.3	F48 C56 S58 E59 S64 F65 E66	F48-K62 HydrophobicContact CD1-CB 4.47Å; F48-K62 HydrophobicContact CD1-CG 3.78Å; F48-K62 HydrophobicContact CE1-CB 4.48Å; F48-K62 HydrophobicContact CE1-CG 3.95Å; C56-K62 WeakPolarHBondContact O-CE 3.32Å; S58-K62 WeakPolarHBondContact O-CG 3.44Å; S58-K62 PolarHBondContact O-N 3.46Å; S58-K62 VanDerWaalsContact O-N 3.08Å; E59-K62 PolarHBondContact O-N 3.03Å; E59-K62 IonicContact OE1-NZ 3.06Å; E59-K62 PolarHBondContact OE1-NZ 2.67Å; E59-K62 WeakPolarHBondContact OE2-CD 3.48Å; E59-K62 IonicContact OE2-NZ 2.64Å; E59-K62 PolarHBondContact OE2-NZ 3.41Å; K62-S64 VanDerWaalsContact C-N 3.3Å; K62-S64 PolarHBondContact O-N 2.97Å; K62-F65 PolarHBondContact O-N 2.9Å; K62-E66 WeakPolarHBondContact O-CB 3.36Å; K62-E66 PolarHBondContact O-N 3.16Å
63	L	87.3	Confident	85.4	Confident	84 Å²	84	61.4 Å²	61.4	44%	0.44	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-32.4	178.6	-69.5	168.2	0	0	0	112.1	E59 D60 E61 A67	E59-L63 VanDerWaalsContact O-CG 3.3Å; E59-L63 WeakPolarHBondContact O-CG 3.39Å; E59-L63 PolarHBondContact O-N 3.2Å; E59-L63 VanDerWaalsContact O-N 3.09Å; D60-L63 PolarHBondContact O-N 3.02Å; E61-L63 VanDerWaalsContact C-N 3.32Å; E61-L63 PolarHBondContact O-N 3.39Å; L63-A67 WeakPolarHBondContact O-CB 3.06Å; L63-A67 PolarHBondContact O-N 3.31Å
64	S	89.7	Confident	86.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-76.2	-36.2	174.6	-75.4	0	0	0	0	112.9	D60 E61 K62 A67 V68 H162 R166	D60-S64 PolarHBondContact O-N 2.95Å; D60-S64 PolarHBondContact O-OG 3.45Å; E61-S64 PolarHBondContact O-N 2.92Å; K62-S64 VanDerWaalsContact C-N 3.3Å; K62-S64 PolarHBondContact O-N 2.97Å; S64-A67 PolarHBondContact O-N 3.3Å; S64-V68 WeakPolarHBondContact O-CG2 3.03Å; S64-V68 PolarHBondContact O-N 3.23Å; S64-H162 PolarHBondContact OG-O 3.38Å; S64-R166 WeakPolarHBondContact OG-CD 3.27Å; S64-R166 WeakPolarHBondContact OG-CG 3.46Å; S64-R166 PolarHBondContact OG-NE 2.96Å
65	F	90.7	Very high	87	Confident	5 Å²	5	51.9 Å²	51.9	2%	0.022	25%	0.253	C	S	.	.	H	α-helix	trans	-67.2	-43.3	171.5	175.8	-105.6	0	0	0	111.9	F48 I51 E61 K62 A67 V68 R69 V117 W121	F48-F65 HydrophobicContact CB-CD1 3.69Å; F48-F65 HydrophobicContact CB-CE1 3.84Å; F48-F65 HydrophobicContact CB-CG 4.39Å; F48-F65 HydrophobicContact CD2-CB 3.63Å; F48-F65 AromaticContact CD2-CD1 3.48Å; F48-F65 HydrophobicContact CD2-CD1 3.48Å; F48-F65 VanDerWaalsContact CD2-CD1 3.48Å; F48-F65 AromaticContact CD2-CD2 3.66Å; F48-F65 HydrophobicContact CD2-CD2 3.66Å; F48-F65 HydrophobicContact CD2-CE1 4.03Å; F48-F65 HydrophobicContact CD2-CE2 4.19Å; F48-F65 AromaticContact CD2-CG 3.27Å; F48-F65 HydrophobicContact CD2-CG 3.27Å; F48-F65 HydrophobicContact CD2-CZ 4.37Å; F48-F65 HydrophobicContact CE1-CB 4.44Å; F48-F65 HydrophobicContact CE2-CB 3.5Å; F48-F65 HydrophobicContact CE2-CD1 4.27Å; F48-F65 AromaticContact CE2-CD2 3.92Å; F48-F65 HydrophobicContact CE2-CD2 3.92Å; F48-F65 AromaticContact CE2-CG 3.62Å; F48-F65 HydrophobicContact CE2-CG 3.62Å; F48-F65 HydrophobicContact CG-CB 4.19Å; F48-F65 AromaticContact CG-CD1 3.7Å; F48-F65 HydrophobicContact CG-CD1 3.7Å; F48-F65 HydrophobicContact CG-CE1 4.27Å; F48-F65 AromaticContact CG-CG 3.93Å; F48-F65 HydrophobicContact CG-CG 3.93Å; F48-F65 HydrophobicContact CZ-CB 3.95Å; F48-F65 HydrophobicContact CZ-CG 4.49Å; I51-F65 HydrophobicContact CD1-CE1 4.42Å; I51-F65 HydrophobicContact CD1-CE2 3.92Å; I51-F65 HydrophobicContact CD1-CZ 3.48Å; I51-F65 VanDerWaalsContact CD1-CZ 3.48Å; E61-F65 WeakPolarHBondContact O-CB 3.41Å; E61-F65 PolarHBondContact O-N 3.38Å; K62-F65 PolarHBondContact O-N 2.9Å; F65-A67 VanDerWaalsContact C-N 3.25Å; F65-A67 PolarHBondContact O-N 3.07Å; F65-V68 PolarHBondContact O-N 2.04Å; F65-V68 VanDerWaalsContact O-N 3.15Å; F65-R69 PolarHBondContact O-N 3.06Å; F65-V117 HydrophobicContact CE2-CG1 3.97Å; F65-V117 HydrophobicContact CZ-CG1 3.93Å; F65-W121 HydrophobicContact CB-CD2 4.48Å; F65-W121 HydrophobicContact CB-CE3 4.27Å; F65-W121 HydrophobicContact CB-CH2 4.11Å; F65-W121 HydrophobicContact CB-CZ2 4.29Å; F65-W121 HydrophobicContact CB-CZ3 4.08Å; F65-W121 HydrophobicContact CD2-CB 4.19Å; F65-W121 AromaticContact CD2-CD2 3.63Å; F65-W121 HydrophobicContact CD2-CD2 3.63Å; F65-W121 AromaticContact CD2-CE3 3.94Å; F65-W121 HydrophobicContact CD2-CE3 3.94Å; F65-W121 AromaticContact CD2-CG 3.72Å; F65-W121 HydrophobicContact CD2-CG 3.72Å; F65-W121 HydrophobicContact CE2-CB 4.17Å; F65-W121 HydrophobicContact CE2-CD2 4.44Å; F65-W121 HydrophobicContact CE2-CG 4.06Å
66	E	90.7	Very high	87.8	Confident	94 Å²	94	50.1 Å²	50.1	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-40.1	171.7	-174.4	-175	-176.4	0	0	110.9	K62 R69 N70	K62-E66 WeakPolarHBondContact O-CB 3.36Å; K62-E66 PolarHBondContact O-N 3.16Å; E66-R69 PolarHBondContact O-N 2.64Å; E66-N70 PolarHBondContact O-N 3.34Å; E66-N70 PolarHBondContact O-ND2 2.88Å
67	A	91.8	Very high	88.4	Confident	8 Å²	8	56.1 Å²	56.1	7%	0.066	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-41.8	174	0	0	0	0	0	112.6	L63 S64 F65 R69 N70 I71 P165 R166 V169	L63-A67 WeakPolarHBondContact O-CB 3.06Å; L63-A67 PolarHBondContact O-N 3.31Å; S64-A67 PolarHBondContact O-N 3.3Å; F65-A67 VanDerWaalsContact C-N 3.25Å; F65-A67 PolarHBondContact O-N 3.07Å; A67-R69 PolarHBondContact O-N 2.82Å; A67-N70 PolarHBondContact O-N 3.14Å; A67-I71 WeakPolarHBondContact O-CG1 3.37Å; A67-I71 PolarHBondContact O-N 3.25Å; A67-P165 HydrophobicContact CB-CB 3.82Å; A67-R166 HydrophobicContact CB-CG 4.02Å; A67-V169 HydrophobicContact CB-CG2 3.93Å; A67-V169 WeakPolarHBondContact O-CG2 2.99Å
68	V	92.2	Very high	89.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-39.4	173.9	170.9	0	0	0	0	111.8	S64 F65 N70 I71 H72 L120 W121 W124 P165	S64-V68 WeakPolarHBondContact O-CG2 3.03Å; S64-V68 PolarHBondContact O-N 3.23Å; F65-V68 PolarHBondContact O-N 2.04Å; F65-V68 VanDerWaalsContact O-N 3.15Å; V68-N70 VanDerWaalsContact C-N 3.33Å; V68-N70 PolarHBondContact O-N 2.93Å; V68-I71 WeakPolarHBondContact O-CB 3.25Å; V68-I71 PolarHBondContact O-N 3.21Å; V68-I71 VanDerWaalsContact O-N 3.13Å; V68-H72 PolarHBondContact O-N 3.04Å; V68-L120 HydrophobicContact CG1-CB 4.26Å; V68-L120 HydrophobicContact CG1-CD2 3.79Å; V68-L120 HydrophobicContact CG1-CG 3.8Å; V68-W121 HydrophobicContact CB-CE3 4.04Å; V68-W121 HydrophobicContact CG1-CB 4.44Å; V68-W121 HydrophobicContact CG1-CE3 4.31Å; V68-W121 HydrophobicContact CG2-CE3 3.84Å; V68-W121 HydrophobicContact CG2-CZ3 4.04Å; V68-W124 HydrophobicContact CG2-CG 4.28Å; V68-P165 HydrophobicContact CG2-CB 3.67Å; V68-P165 HydrophobicContact CG2-CG 3.67Å
69	R	91.2	Very high	89.6	Confident	77 Å²	77	55.6 Å²	55.6	29%	0.291	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-40	172.2	-169.7	-170.4	-162.4	139.9	20.2	112.3	E47 F65 E66 A67 I71 H72 K73 V117	E47-R69 IonicContact OE1-CZ 2.81Å; E47-R69 IonicContact OE1-NH1 3.57Å; E47-R69 IonicContact OE1-NH2 3.42Å; E47-R69 PolarHBondContact OE1-NH2 3.28Å; E47-R69 IonicContact OE2-CZ 3.26Å; E47-R69 IonicContact OE2-NH1 3.37Å; E47-R69 PolarHBondContact OE2-NH1 2.81Å; E47-R69 IonicContact OE2-NH2 3.85Å; E47-R69 PolarHBondContact OE2-NH2 3.37Å; F65-R69 PolarHBondContact O-N 3.06Å; E66-R69 PolarHBondContact O-N 2.64Å; A67-R69 PolarHBondContact O-N 2.82Å; R69-I71 VanDerWaalsContact C-N 3.27Å; R69-I71 PolarHBondContact O-N 3.06Å; R69-H72 PolarHBondContact O-N 3.2Å; R69-K73 WeakPolarHBondContact O-CB 3.43Å; R69-K73 PolarHBondContact O-N 2.66Å; R69-V117 HydrophobicContact CB-CG1 4.15Å; R69-V117 HydrophobicContact CG-CG1 4.11Å; R69-V117 HydrophobicContact CG-CG2 4.37Å
70	N	91.3	Very high	89.9	Confident	64 Å²	64	54.2 Å²	54.2	34%	0.342	28%	0.281	S	S	.	.	H	α-helix	trans	-69.2	-24.5	175.2	-77.1	-64.2	0	0	0	112.6	E66 A67 V68 L74 V169	E66-N70 PolarHBondContact O-N 3.34Å; E66-N70 PolarHBondContact O-ND2 2.88Å; A67-N70 PolarHBondContact O-N 3.14Å; V68-N70 VanDerWaalsContact C-N 3.33Å; V68-N70 PolarHBondContact O-N 2.93Å; N70-L74 WeakPolarHBondContact O-CD1 3.36Å; N70-L74 VanDerWaalsContact O-CG 3.28Å; N70-L74 WeakPolarHBondContact O-CG 3.48Å; N70-L74 PolarHBondContact O-N 3.49Å; N70-V169 HydrophobicContact CB-CG1 4.17Å; N70-V169 HydrophobicContact CB-CG2 3.98Å
71	I	92.4	Very high	90.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-74.8	-47.2	170.9	-66.8	164.2	0	0	0	110.5	A67 V68 R69 K73 L74 M75 L120 P165 A168 V169 L195 V198 L199	A67-I71 WeakPolarHBondContact O-CG1 3.37Å; A67-I71 PolarHBondContact O-N 3.25Å; V68-I71 WeakPolarHBondContact O-CB 3.25Å; V68-I71 PolarHBondContact O-N 3.21Å; V68-I71 VanDerWaalsContact O-N 3.13Å; R69-I71 VanDerWaalsContact C-N 3.27Å; R69-I71 PolarHBondContact O-N 3.06Å; I71-K73 VanDerWaalsContact C-N 3.29Å; I71-K73 PolarHBondContact O-N 3.24Å; I71-L74 WeakPolarHBondContact O-CB 3.38Å; I71-L74 PolarHBondContact O-N 2.95Å; I71-M75 HydrophobicContact CG2-SD 4.41Å; I71-L120 HydrophobicContact CG2-CD2 4.39Å; I71-P165 HydrophobicContact CD1-CB 4.28Å; I71-A168 HydrophobicContact CD1-CB 3.74Å; I71-A168 HydrophobicContact CG1-CB 4.4Å; I71-V169 HydrophobicContact CD1-CG2 4.39Å; I71-V169 HydrophobicContact CG1-CG2 3.87Å; I71-L195 HydrophobicContact CD1-CD1 4.44Å; I71-L195 HydrophobicContact CG1-CD1 4.2Å; I71-L195 HydrophobicContact CG2-CD1 3.57Å; I71-V198 HydrophobicContact CD1-CG1 4.05Å; I71-L199 HydrophobicContact CG2-CD2 3.89Å
72	H	93.5	Very high	90.3	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.019	29%	0.287	C	S	.	.	H	α-helix	trans	-54.2	-46.6	173.6	175.1	-82.3	0	0	0	111.1	V68 R69 L74 M75 D76 G81 I115 V117 L120	V68-H72 PolarHBondContact O-N 3.04Å; R69-H72 PolarHBondContact O-N 3.2Å; H72-L74 PolarHBondContact O-N 3.01Å; H72-L74 VanDerWaalsContact O-N 3.16Å; H72-M75 CarbonylContact O-C 3.58Å; H72-M75 WeakPolarHBondContact O-CA 3.42Å; H72-M75 WeakPolarHBondContact O-CB 3.29Å; H72-M75 PolarHBondContact O-N 2.87Å; H72-D76 IonicContact CE1-OD2 2.69Å; H72-D76 PolarHBondContact CE1-OD2 2.9Å; H72-D76 IonicContact ND1-OD2 3.57Å; H72-D76 WeakPolarHBondContact O-CB 3.25Å; H72-D76 PolarHBondContact O-N 3.33Å; H72-G81 PolarHBondContact CE1-O 3.15Å; H72-G81 PolarHBondContact NE2-O 2.9Å; H72-G81 VanDerWaalsContact NE2-O 3.15Å; H72-I115 PolarHBondContact CD2-O 3.33Å; H72-I115 PolarHBondContact NE2-O 3.41Å; H72-V117 HydrophobicContact CB-CG2 4.29Å; H72-V117 WeakPolarHBondContact ND1-CG2 3.01Å; H72-L120 HydrophobicContact CB-CD2 3.79Å
73	K	91.9	Very high	90.6	Very high	149 Å²	149	51.2 Å²	51.2	65%	0.648	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.2	175.2	-178.5	164	-178.7	174.4	0	115.6	R69 I71 M75	R69-K73 WeakPolarHBondContact O-CB 3.43Å; R69-K73 PolarHBondContact O-N 2.66Å; I71-K73 VanDerWaalsContact C-N 3.29Å; I71-K73 PolarHBondContact O-N 3.24Å; K73-M75 VanDerWaalsContact C-N 3.33Å
74	L	88.9	Confident	90.8	Very high	69 Å²	69	49.8 Å²	49.8	36%	0.361	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-1	167.9	-73.4	165.7	0	0	0	112.1	N70 I71 H72 F91	N70-L74 WeakPolarHBondContact O-CD1 3.36Å; N70-L74 VanDerWaalsContact O-CG 3.28Å; N70-L74 WeakPolarHBondContact O-CG 3.48Å; N70-L74 PolarHBondContact O-N 3.49Å; I71-L74 WeakPolarHBondContact O-CB 3.38Å; I71-L74 PolarHBondContact O-N 2.95Å; H72-L74 PolarHBondContact O-N 3.01Å; H72-L74 VanDerWaalsContact O-N 3.16Å; L74-F91 HydrophobicContact CB-CE2 4.04Å; L74-F91 HydrophobicContact CB-CZ 4.41Å; L74-F91 WeakPolarHBondContact O-CD2 3.3Å; L74-F91 WeakPolarHBondContact O-CE2 3.08Å
75	M	91.1	Very high	90.7	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.025	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-27.6	-178.4	-56.9	175.6	64.2	0	0	112.4	I71 H72 K73 D77 V83 E87 F91 F108 L199	I71-M75 HydrophobicContact CG2-SD 4.41Å; H72-M75 CarbonylContact O-C 3.58Å; H72-M75 WeakPolarHBondContact O-CA 3.42Å; H72-M75 WeakPolarHBondContact O-CB 3.29Å; H72-M75 PolarHBondContact O-N 2.87Å; K73-M75 VanDerWaalsContact C-N 3.33Å; M75-D77 PolarHBondContact O-N 3.13Å; M75-V83 HydrophobicContact CB-CG1 3.87Å; M75-V83 HydrophobicContact CB-CG2 3.76Å; M75-V83 HydrophobicContact CE-CG1 4.33Å; M75-E87 WeakPolarHBondContact O-CB 3.45Å; M75-F91 HydrophobicContact CE-CD1 3.94Å; M75-F91 HydrophobicContact CE-CE1 4.34Å; M75-F91 HydrophobicContact CG-CB 4.48Å; M75-F91 HydrophobicContact CG-CD1 3.59Å; M75-F91 HydrophobicContact CG-CD2 4.02Å; M75-F91 HydrophobicContact CG-CE1 3.62Å; M75-F91 HydrophobicContact CG-CE2 4.07Å; M75-F91 HydrophobicContact CG-CG 3.77Å; M75-F91 HydrophobicContact CG-CZ 3.85Å; M75-F91 HydrophobicContact SD-CD1 3.97Å; M75-F91 HydrophobicContact SD-CE1 3.82Å; M75-F91 HydrophobicContact SD-CZ 4.46Å; M75-F108 HydrophobicContact CE-CD1 4.44Å; M75-F108 HydrophobicContact CE-CE1 3.69Å; M75-F108 HydrophobicContact CE-CE2 4.29Å; M75-F108 HydrophobicContact CE-CZ 3.6Å; M75-F108 HydrophobicContact SD-CZ 4.3Å; M75-L199 HydrophobicContact SD-CD1 4.12Å; M75-L199 HydrophobicContact SD-CD2 3.95Å
76	D	92.6	Very high	90.6	Very high	20 Å²	20	59.4 Å²	59.4	11%	0.107	32%	0.317	C	S	.	.			trans	-82.2	85.6	173.1	173.4	26.8	0	0	0	108.3	H72 A79 N80 G81 V83	H72-D76 IonicContact CE1-OD2 2.69Å; H72-D76 PolarHBondContact CE1-OD2 2.9Å; H72-D76 IonicContact ND1-OD2 3.57Å; H72-D76 WeakPolarHBondContact O-CB 3.25Å; H72-D76 PolarHBondContact O-N 3.33Å; D76-A79 WeakPolarHBondContact OD1-CA 3.48Å; D76-A79 PolarHBondContact OD1-N 3.25Å; D76-N80 PolarHBondContact OD1-N 3.46Å; D76-G81 PolarHBondContact OD1-N 3.42Å; D76-G81 WeakPolarHBondContact OD2-CA 3.18Å; D76-G81 PolarHBondContact OD2-N 2.84Å; D76-V83 HydrophobicContact CB-CG2 3.9Å
77	D	88.8	Confident	90.7	Very high	130 Å²	130	56.2 Å²	56.2	70%	0.695	30%	0.302	S	S	*	.	S	Bend	trans	-88.7	-31.1	-165.1	-122.6	-1.4	0	0	0	111.6	M75 A79 E87	M75-D77 PolarHBondContact O-N 3.13Å; D77-A79 VanDerWaalsContact C-N 3.31Å; D77-E87 PolarHBondContact N-OE1 3Å
78	D	90.3	Very high	90.6	Very high	116 Å²	116	55.9 Å²	55.9	62%	0.62	30%	0.299	S	S	*	.	S	Bend	trans	-81.6	-11.3	168.7	98.2	-25.9	0	0	0	113.4	N80 E87	D78-N80 WeakPolarHBondContact OD1-CB 3.39Å; D78-N80 PolarHBondContact OD1-N 2.95Å; D78-N80 PolarHBondContact OD1-ND2 3.19Å; D78-E87 PolarHBondContact N-OE1 3.07Å
79	A	89.9	Confident	90.3	Very high	74 Å²	74	57.8 Å²	57.8	61%	0.612	31%	0.309	S	S	*	.			trans	62.5	31.8	-179.2	0	0	0	0	0	114.8	D76 D77 G81	D76-A79 WeakPolarHBondContact OD1-CA 3.48Å; D76-A79 PolarHBondContact OD1-N 3.25Å; D77-A79 VanDerWaalsContact C-N 3.31Å; A79-G81 VanDerWaalsContact C-N 3.34Å
80	N	87.3	Confident	90.2	Very high	87 Å²	87	59.6 Å²	59.6	47%	0.465	32%	0.321	S	S	.	.	S	Bend	trans	-70	-28.5	174.1	79.6	78.7	0	0	0	113	D76 D78 D82	D76-N80 PolarHBondContact OD1-N 3.46Å; D78-N80 WeakPolarHBondContact OD1-CB 3.39Å; D78-N80 PolarHBondContact OD1-N 2.95Å; D78-N80 PolarHBondContact OD1-ND2 3.19Å; N80-D82 PolarHBondContact ND2-O 3.38Å; N80-D82 PolarHBondContact OD1-N 2.95Å; N80-D82 PolarHBondContact OD1-O 3.49Å
81	G	87.1	Confident	90.1	Very high	30 Å²	30	57.3 Å²	57.3	31%	0.309	31%	0.308	S	S	.	.	S	Bend	trans	113.2	-11.2	179.2	0	0	0	0	0	115.8	H72 D76 A79	H72-G81 PolarHBondContact CE1-O 3.15Å; H72-G81 PolarHBondContact NE2-O 2.9Å; H72-G81 VanDerWaalsContact NE2-O 3.15Å; D76-G81 PolarHBondContact OD1-N 3.42Å; D76-G81 WeakPolarHBondContact OD2-CA 3.18Å; D76-G81 PolarHBondContact OD2-N 2.84Å; A79-G81 VanDerWaalsContact C-N 3.34Å
82	D	90.6	Very high	89.8	Confident	58 Å²	58	57.4 Å²	57.4	31%	0.31	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124	174.2	-70.3	-48.1	0	0	0	110.1	N80 L114 S116	N80-D82 PolarHBondContact ND2-O 3.38Å; N80-D82 PolarHBondContact OD1-N 2.95Å; N80-D82 PolarHBondContact OD1-O 3.49Å; D82-L114 HydrophobicContact CB-CB 4.03Å; D82-L114 HydrophobicContact CB-CD2 4.13Å; D82-S116 VanDerWaalsContact OD1-CA 3.25Å; D82-S116 WeakPolarHBondContact OD1-CA 3.44Å; D82-S116 WeakPolarHBondContact OD1-CB 3.08Å; D82-S116 PolarHBondContact OD1-N 3.33Å
83	V	92.6	Very high	89.5	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.3	178.7	178.1	0	0	0	0	110.5	M75 D76 E87 F108 H109 L114 I115	M75-V83 HydrophobicContact CB-CG1 3.87Å; M75-V83 HydrophobicContact CB-CG2 3.76Å; M75-V83 HydrophobicContact CE-CG1 4.33Å; D76-V83 HydrophobicContact CB-CG2 3.9Å; V83-E87 WeakPolarHBondContact CA-OE2 3.46Å; V83-E87 HydrophobicContact CG1-CB 4.36Å; V83-F108 HydrophobicContact CG1-CE1 4.45Å; V83-H109 PolarHBondContact O-CE1 3.04Å; V83-L114 CarbonylContact O-C 3.57Å; V83-L114 WeakPolarHBondContact O-CA 3.28Å; V83-I115 HydrophobicContact CB-CB 4.46Å; V83-I115 PolarHBondContact N-O 3.22Å; V83-I115 PolarHBondContact O-N 2.8Å
84	D	91.3	Very high	89.2	Confident	55 Å²	55	63.2 Å²	63.2	29%	0.294	33%	0.332	S	S	.	.			trans	-95.4	179.3	-174.9	126	-44.7	0	0	0	114.3	E86 E87 S88 H109 L114	D84-E86 WeakPolarHBondContact OD1-CA 3.11Å; D84-E86 PolarHBondContact OD1-N 2.83Å; D84-E87 PolarHBondContact N-OE2 3.27Å; D84-E87 PolarHBondContact OD1-N 3.19Å; D84-S88 VanDerWaalsContact O-CB 3.29Å; D84-S88 WeakPolarHBondContact O-CB 3.28Å; D84-S88 PolarHBondContact O-N 3.45Å; D84-S88 PolarHBondContact O-OG 3.37Å; D84-H109 PolarHBondContact O-CE1 2.8Å; D84-H109 PolarHBondContact O-NE2 2.96Å; D84-L114 HydrophobicContact CB-CD2 3.89Å
85	V	89.2	Confident	88.9	Confident	54 Å²	54	64.6 Å²	64.6	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-69.7	-40.2	-178.9	156.2	0	0	0	0	113	S88 D89 H105 K113	V85-S88 PolarHBondContact O-OG 3.25Å; V85-D89 WeakPolarHBondContact O-CB 3.42Å; V85-D89 PolarHBondContact O-N 3.13Å; V85-H105 PolarHBondContact O-CE1 3.43Å; V85-K113 HydrophobicContact CG2-CB 4.46Å
86	E	88.5	Confident	88.5	Confident	152 Å²	152	65.2 Å²	65.2	71%	0.71	34%	0.343	S	S	*	.	H	α-helix	trans	-75.8	-45.3	-179.2	-56	-163.3	140.9	0	0	110.1	D84 S88 D89 E90	D84-E86 WeakPolarHBondContact OD1-CA 3.11Å; D84-E86 PolarHBondContact OD1-N 2.83Å; E86-S88 PolarHBondContact O-N 3.35Å; E86-D89 PolarHBondContact O-N 3.45Å; E86-D89 VanDerWaalsContact O-N 3.16Å; E86-E90 PolarHBondContact O-N 3.15Å
87	E	91.6	Very high	87.8	Confident	28 Å²	28	69.6 Å²	69.6	13%	0.131	37%	0.367	C	S	.	.	H	α-helix	trans	-54.9	-49.2	175.1	-66.9	-178	128.6	0	0	112.4	M75 D77 D78 V83 D84 D89 E90 F91	M75-E87 WeakPolarHBondContact O-CB 3.45Å; D77-E87 PolarHBondContact N-OE1 3Å; D78-E87 PolarHBondContact N-OE1 3.07Å; V83-E87 WeakPolarHBondContact CA-OE2 3.46Å; V83-E87 HydrophobicContact CG1-CB 4.36Å; D84-E87 PolarHBondContact N-OE2 3.27Å; D84-E87 PolarHBondContact OD1-N 3.19Å; E87-D89 VanDerWaalsContact C-N 3.29Å; E87-D89 PolarHBondContact O-N 3.1Å; E87-E90 PolarHBondContact O-N 3.41Å; E87-F91 WeakPolarHBondContact O-CB 3.47Å; E87-F91 PolarHBondContact O-N 3.2Å
88	S	89.4	Confident	87.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.5	-26.1	-179.6	66.4	0	0	0	0	114.1	D84 V85 E86 L92 H105 H109	D84-S88 VanDerWaalsContact O-CB 3.29Å; D84-S88 WeakPolarHBondContact O-CB 3.28Å; D84-S88 PolarHBondContact O-N 3.45Å; D84-S88 PolarHBondContact O-OG 3.37Å; V85-S88 PolarHBondContact O-OG 3.25Å; E86-S88 PolarHBondContact O-N 3.35Å; S88-L92 WeakPolarHBondContact O-CB 3.35Å; S88-L92 WeakPolarHBondContact O-CD1 3.33Å; S88-L92 VanDerWaalsContact O-CG 3.25Å; S88-L92 WeakPolarHBondContact O-CG 3.36Å; S88-L92 PolarHBondContact O-N 3.03Å; S88-H105 PolarHBondContact OG-CE1 3.09Å; S88-H105 PolarHBondContact OG-ND1 3.01Å; S88-H109 PolarHBondContact OG-CD2 3.29Å; S88-H109 PolarHBondContact OG-NE2 3.25Å
89	D	87.7	Confident	86.3	Confident	41 Å²	41	69.2 Å²	69.2	22%	0.219	36%	0.355	C	S	.	.	H	α-helix	trans	-80.2	-37	176	-174.4	39	0	0	0	111.3	V85 E86 E87 L92 R93 P101	V85-D89 WeakPolarHBondContact O-CB 3.42Å; V85-D89 PolarHBondContact O-N 3.13Å; E86-D89 PolarHBondContact O-N 3.45Å; E86-D89 VanDerWaalsContact O-N 3.16Å; E87-D89 VanDerWaalsContact C-N 3.29Å; E87-D89 PolarHBondContact O-N 3.1Å; D89-L92 PolarHBondContact O-N 3.06Å; D89-R93 VanDerWaalsContact CG-NH2 3.27Å; D89-R93 VanDerWaalsContact O-CD 3.25Å; D89-R93 WeakPolarHBondContact O-CD 3.31Å; D89-R93 WeakPolarHBondContact O-CG 3.47Å; D89-R93 PolarHBondContact O-N 3.07Å; D89-R93 IonicContact OD1-CZ 3.48Å; D89-R93 IonicContact OD1-NE 3.53Å; D89-R93 PolarHBondContact OD1-NE 2.84Å; D89-R93 IonicContact OD1-NH2 2.67Å; D89-R93 PolarHBondContact OD1-NH2 3.45Å; D89-R93 IonicContact OD2-CZ 3.51Å; D89-R93 IonicContact OD2-NE 2.76Å; D89-R93 PolarHBondContact OD2-NE 3.28Å; D89-R93 IonicContact OD2-NH2 2.9Å; D89-R93 PolarHBondContact OD2-NH2 3.08Å; D89-P101 WeakPolarHBondContact OD1-CG 3.26Å
90	E	87.6	Confident	85.5	Confident	114 Å²	114	70.7 Å²	70.7	53%	0.533	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-51.7	172.1	-168.4	154.9	171.3	0	0	110.7	E86 E87 L92 R93 E94	E86-E90 PolarHBondContact O-N 3.15Å; E87-E90 PolarHBondContact O-N 3.41Å; E90-L92 VanDerWaalsContact C-N 3.29Å; E90-L92 PolarHBondContact O-N 3.13Å; E90-R93 PolarHBondContact O-N 2.92Å; E90-E94 HydrophobicContact CG-CG 3.93Å; E90-E94 WeakPolarHBondContact O-CB 3.4Å; E90-E94 WeakPolarHBondContact O-CG 3.46Å; E90-E94 PolarHBondContact O-N 3.24Å
91	F	89.1	Confident	84.8	Confident	16 Å²	16	66.8 Å²	66.8	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-55.1	-40.5	175.4	-177.7	-104.2	0	0	0	113.4	L74 M75 E87 R93 D95 L96 L195 L199	L74-F91 HydrophobicContact CB-CE2 4.04Å; L74-F91 HydrophobicContact CB-CZ 4.41Å; L74-F91 WeakPolarHBondContact O-CD2 3.3Å; L74-F91 WeakPolarHBondContact O-CE2 3.08Å; M75-F91 HydrophobicContact CE-CD1 3.94Å; M75-F91 HydrophobicContact CE-CE1 4.34Å; M75-F91 HydrophobicContact CG-CB 4.48Å; M75-F91 HydrophobicContact CG-CD1 3.59Å; M75-F91 HydrophobicContact CG-CD2 4.02Å; M75-F91 HydrophobicContact CG-CE1 3.62Å; M75-F91 HydrophobicContact CG-CE2 4.07Å; M75-F91 HydrophobicContact CG-CG 3.77Å; M75-F91 HydrophobicContact CG-CZ 3.85Å; M75-F91 HydrophobicContact SD-CD1 3.97Å; M75-F91 HydrophobicContact SD-CE1 3.82Å; M75-F91 HydrophobicContact SD-CZ 4.46Å; E87-F91 WeakPolarHBondContact O-CB 3.47Å; E87-F91 PolarHBondContact O-N 3.2Å; F91-R93 VanDerWaalsContact C-N 3.29Å; F91-R93 PolarHBondContact O-N 3.15Å; F91-D95 HydrophobicContact CD2-CB 3.86Å; F91-D95 HydrophobicContact CE2-CB 3.83Å; F91-D95 PolarHBondContact O-N 2.8Å; F91-D95 VanDerWaalsContact O-N 3.15Å; F91-L96 HydrophobicContact CD1-CD1 4.11Å; F91-L96 HydrophobicContact CE1-CD1 3.74Å; F91-L96 HydrophobicContact CE1-CG 4.3Å; F91-L96 PolarHBondContact O-N 2.65Å; F91-L195 HydrophobicContact CE1-CD2 4.14Å; F91-L195 HydrophobicContact CZ-CD1 4.46Å; F91-L195 HydrophobicContact CZ-CD2 3.78Å; F91-L199 HydrophobicContact CE1-CD1 4.1Å
92	L	87.4	Confident	84.2	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-67	-29.5	178.6	-84.3	168.7	0	0	0	113.4	S88 D89 E90 L96 N97 Y98 P101 K104 H105 F200	S88-L92 WeakPolarHBondContact O-CB 3.35Å; S88-L92 WeakPolarHBondContact O-CD1 3.33Å; S88-L92 VanDerWaalsContact O-CG 3.25Å; S88-L92 WeakPolarHBondContact O-CG 3.36Å; S88-L92 PolarHBondContact O-N 3.03Å; D89-L92 PolarHBondContact O-N 3.06Å; E90-L92 VanDerWaalsContact C-N 3.29Å; E90-L92 PolarHBondContact O-N 3.13Å; L92-L96 HydrophobicContact CD2-CB 4.41Å; L92-L96 HydrophobicContact CD2-CD1 3.63Å; L92-L96 CarbonylContact O-C 3.59Å; L92-N97 PolarHBondContact O-N 2.81Å; L92-Y98 HydrophobicContact CD2-CD2 3.94Å; L92-Y98 HydrophobicContact CD2-CE2 4.35Å; L92-Y98 WeakPolarHBondContact O-CB 3.28Å; L92-Y98 PolarHBondContact O-N 2.92Å; L92-P101 HydrophobicContact CB-CB 3.87Å; L92-P101 HydrophobicContact CD1-CB 4.12Å; L92-K104 HydrophobicContact CD1-CB 4.33Å; L92-H105 HydrophobicContact CD1-CB 4.21Å; L92-F200 HydrophobicContact CD1-CZ 4.09Å; L92-F200 HydrophobicContact CD2-CE2 3.77Å; L92-F200 HydrophobicContact CD2-CZ 3.53Å; L92-F200 HydrophobicContact CG-CZ 4.32Å
93	R	86.9	Confident	83.4	Confident	129 Å²	129	71.4 Å²	71.4	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-89.6	-41.4	-178.1	-68.1	165.3	-172.2	-138.3	7.1	112.8	D89 E90 F91 N97 P101	D89-R93 VanDerWaalsContact CG-NH2 3.27Å; D89-R93 VanDerWaalsContact O-CD 3.25Å; D89-R93 WeakPolarHBondContact O-CD 3.31Å; D89-R93 WeakPolarHBondContact O-CG 3.47Å; D89-R93 PolarHBondContact O-N 3.07Å; D89-R93 IonicContact OD1-CZ 3.48Å; D89-R93 IonicContact OD1-NE 3.53Å; D89-R93 PolarHBondContact OD1-NE 2.84Å; D89-R93 IonicContact OD1-NH2 2.67Å; D89-R93 PolarHBondContact OD1-NH2 3.45Å; D89-R93 IonicContact OD2-CZ 3.51Å; D89-R93 IonicContact OD2-NE 2.76Å; D89-R93 PolarHBondContact OD2-NE 3.28Å; D89-R93 IonicContact OD2-NH2 2.9Å; D89-R93 PolarHBondContact OD2-NH2 3.08Å; E90-R93 PolarHBondContact O-N 2.92Å; F91-R93 VanDerWaalsContact C-N 3.29Å; F91-R93 PolarHBondContact O-N 3.15Å; R93-N97 VanDerWaalsContact O-CA 3.28Å; R93-N97 WeakPolarHBondContact O-CA 3.41Å; R93-P101 HydrophobicContact CG-CG 4.03Å
94	E	84.6	Confident	82.7	Confident	146 Å²	146	73.6 Å²	73.6	68%	0.682	37%	0.365	S	S	*	.	H	α-helix	trans	-84.1	-59.6	-174.2	-60.2	-94.4	132.9	0	0	110.5	E90	E90-E94 HydrophobicContact CG-CG 3.93Å; E90-E94 WeakPolarHBondContact O-CB 3.4Å; E90-E94 WeakPolarHBondContact O-CG 3.46Å; E90-E94 PolarHBondContact O-N 3.24Å
95	D	83.8	Confident	82.1	Confident	97 Å²	97	72.9 Å²	72.9	52%	0.519	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-35.9	-169.7	-119.9	20.1	0	0	0	112.8	F91 L192	F91-D95 HydrophobicContact CD2-CB 3.86Å; F91-D95 HydrophobicContact CE2-CB 3.83Å; F91-D95 PolarHBondContact O-N 2.8Å; F91-D95 VanDerWaalsContact O-N 3.15Å; D95-L192 WeakPolarHBondContact O-CD2 3.38Å
96	L	81.7	Confident	81.6	Confident	19 Å²	19	73.7 Å²	73.7	10%	0.099	37%	0.368	C	S	.	.	S	Bend	trans	-94.2	-8.2	174.1	-78.6	166.8	0	0	0	114.3	F91 L92 Y98 L192 L195 L199 F200	F91-L96 HydrophobicContact CD1-CD1 4.11Å; F91-L96 HydrophobicContact CE1-CD1 3.74Å; F91-L96 HydrophobicContact CE1-CG 4.3Å; F91-L96 PolarHBondContact O-N 2.65Å; L92-L96 HydrophobicContact CD2-CB 4.41Å; L92-L96 HydrophobicContact CD2-CD1 3.63Å; L92-L96 CarbonylContact O-C 3.59Å; L96-Y98 VanDerWaalsContact C-N 3.33Å; L96-Y98 HydrophobicContact CB-CD2 3.76Å; L96-Y98 HydrophobicContact CB-CE2 3.92Å; L96-Y98 PolarHBondContact O-N 3.21Å; L96-L192 HydrophobicContact CD2-CD2 4.15Å; L96-L195 HydrophobicContact CD1-CD2 4.26Å; L96-L195 HydrophobicContact CD1-CG 4.38Å; L96-L195 HydrophobicContact CD2-CD2 3.78Å; L96-L195 HydrophobicContact CD2-CG 4.13Å; L96-L195 HydrophobicContact CG-CD2 4.03Å; L96-L199 HydrophobicContact CD1-CD1 4.12Å; L96-F200 HydrophobicContact CD1-CE2 4.5Å
97	N	78.9	Confident	81.2	Confident	111 Å²	111	70.8 Å²	70.8	59%	0.594	36%	0.361	S	S	*	.			trans	57.3	34.2	173.5	-164	104.7	0	0	0	114.4	L92 R93	L92-N97 PolarHBondContact O-N 2.81Å; R93-N97 VanDerWaalsContact O-CA 3.28Å; R93-N97 WeakPolarHBondContact O-CA 3.41Å
98	Y	78	Confident	80.8	Confident	60 Å²	60	70.7 Å²	70.7	24%	0.235	36%	0.36	C	S	.	.			trans	-77.1	124.3	173.1	-78.2	-84.9	0	0	0	111.8	L92 L96 D100 D196	L92-Y98 HydrophobicContact CD2-CD2 3.94Å; L92-Y98 HydrophobicContact CD2-CE2 4.35Å; L92-Y98 WeakPolarHBondContact O-CB 3.28Å; L92-Y98 PolarHBondContact O-N 2.92Å; L96-Y98 VanDerWaalsContact C-N 3.33Å; L96-Y98 HydrophobicContact CB-CD2 3.76Å; L96-Y98 HydrophobicContact CB-CE2 3.92Å; L96-Y98 PolarHBondContact O-N 3.21Å; Y98-D100 VanDerWaalsContact C-N 3.35Å; Y98-D196 VanDerWaalsContact OH-CG 3.24Å; Y98-D196 PolarHBondContact OH-OD1 3.17Å; Y98-D196 VanDerWaalsContact OH-OD1 3.04Å; Y98-D196 PolarHBondContact OH-OD2 3.45Å
99	H	68.6	Low	80.5	Confident	179 Å²	179	71.1 Å²	71.1	83%	0.829	36%	0.362	S	S	*	.	S	Bend	trans	-78.5	-16.5	176.5	-72.7	18.7	0	0	0	114.1
100	D	73.6	Confident	80.2	Confident	104 Å²	104	72 Å²	72	56%	0.556	38%	0.381	S	S	*	.			trans	-145	90	172.2	-175.3	-7.7	0	0	0	107.9	Y98 T102	Y98-D100 VanDerWaalsContact C-N 3.35Å; D100-T102 VanDerWaalsContact C-N 3.29Å; D100-T102 WeakPolarHBondContact OD1-CB 3.45Å; D100-T102 VanDerWaalsContact OD1-CG2 3.31Å; D100-T102 WeakPolarHBondContact OD1-CG2 3.44Å; D100-T102 PolarHBondContact OD1-N 2.9Å; D100-T102 PolarHBondContact OD1-OG1 3.41Å
101	P	73.5	Confident	79.8	Confident	6 Å²	6	75.9 Å²	75.9	4%	0.039	40%	0.399	C	S	.	.			trans	-79.2	-8.6	-178.6	32	-35.6	0	0	0	113	D89 L92 R93 V103 K104 H105	D89-P101 WeakPolarHBondContact OD1-CG 3.26Å; L92-P101 HydrophobicContact CB-CB 3.87Å; L92-P101 HydrophobicContact CD1-CB 4.12Å; R93-P101 HydrophobicContact CG-CG 4.03Å; P101-V103 VanDerWaalsContact C-N 3.34Å; P101-V103 PolarHBondContact O-N 3.36Å; P101-V103 VanDerWaalsContact O-N 3.15Å; P101-K104 CarbonylContact O-C 3.55Å; P101-K104 WeakPolarHBondContact O-CA 3.45Å; P101-K104 WeakPolarHBondContact O-CB 3.48Å; P101-K104 PolarHBondContact O-N 2.92Å; P101-H105 WeakPolarHBondContact O-CB 3.34Å; P101-H105 PolarHBondContact O-N 3.33Å
102	T	73.4	Confident	79.5	Confident	85 Å²	85	80.5 Å²	80.5	52%	0.521	42%	0.424	S	S	.	.	H	α-helix	trans	-52.4	-46	-165.5	57.1	0	0	0	0	114	D100 S106	D100-T102 VanDerWaalsContact C-N 3.29Å; D100-T102 WeakPolarHBondContact OD1-CB 3.45Å; D100-T102 VanDerWaalsContact OD1-CG2 3.31Å; D100-T102 WeakPolarHBondContact OD1-CG2 3.44Å; D100-T102 PolarHBondContact OD1-N 2.9Å; D100-T102 PolarHBondContact OD1-OG1 3.41Å; T102-S106 WeakPolarHBondContact O-CB 3.34Å; T102-S106 PolarHBondContact O-N 3.5Å; T102-S106 PolarHBondContact O-OG 3.09Å
103	V	74.7	Confident	79.3	Confident	100 Å²	100	87.7 Å²	87.7	61%	0.606	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-42.5	177.8	-177.9	0	0	0	0	111.6	P101 S106 T107	P101-V103 VanDerWaalsContact C-N 3.34Å; P101-V103 PolarHBondContact O-N 3.36Å; P101-V103 VanDerWaalsContact O-N 3.15Å; V103-S106 PolarHBondContact O-N 3.3Å; V103-S106 PolarHBondContact O-OG 3.06Å; V103-T107 PolarHBondContact O-N 3.19Å; V103-T107 VanDerWaalsContact O-N 3.14Å; V103-T107 PolarHBondContact O-OG1 2.91Å
104	K	76.9	Confident	79.4	Confident	47 Å²	47	86.2 Å²	86.2	20%	0.204	46%	0.457	C	S	.	.	H	α-helix	trans	-66.3	-49.8	179.9	-76.4	-83.4	178.5	169	0	111	L92 P101 S106 T107 F108 D196 F200	L92-K104 HydrophobicContact CD1-CB 4.33Å; P101-K104 CarbonylContact O-C 3.55Å; P101-K104 WeakPolarHBondContact O-CA 3.45Å; P101-K104 WeakPolarHBondContact O-CB 3.48Å; P101-K104 PolarHBondContact O-N 2.92Å; K104-S106 VanDerWaalsContact C-N 3.32Å; K104-S106 PolarHBondContact O-N 3.32Å; K104-T107 WeakPolarHBondContact O-CA 3.45Å; K104-T107 VanDerWaalsContact O-CB 3.31Å; K104-T107 WeakPolarHBondContact O-CB 3.47Å; K104-T107 PolarHBondContact O-N 3.21Å; K104-F108 PolarHBondContact O-N 3Å; K104-F108 VanDerWaalsContact O-N 3.07Å; K104-D196 IonicContact NZ-OD1 3.56Å; K104-D196 PolarHBondContact NZ-OD1 3.01Å; K104-F200 HydrophobicContact CB-CD1 4.21Å; K104-F200 HydrophobicContact CB-CE1 3.78Å; K104-F200 HydrophobicContact CB-CZ 4.05Å; K104-F200 HydrophobicContact CD-CB 3.93Å; K104-F200 HydrophobicContact CD-CD1 3.47Å; K104-F200 VanDerWaalsContact CD-CD1 3.47Å; K104-F200 HydrophobicContact CD-CD2 3.53Å; K104-F200 HydrophobicContact CD-CE1 3.81Å; K104-F200 HydrophobicContact CD-CE2 3.89Å; K104-F200 HydrophobicContact CD-CG 3.33Å; K104-F200 HydrophobicContact CD-CZ 4.04Å; K104-F200 HydrophobicContact CG-CD1 4.49Å; K104-F200 HydrophobicContact CG-CE1 4.46Å; K104-F200 VanDerWaalsContact O-CE1 3.27Å; K104-F200 WeakPolarHBondContact O-CE1 3.33Å
105	H	78.7	Confident	79.7	Confident	39 Å²	39	80 Å²	80	18%	0.181	43%	0.428	C	S	.	.	H	α-helix	trans	-54.5	-45.2	173.9	178.7	84.9	0	0	0	111.9	V85 S88 L92 P101 T107 F108 H109	V85-H105 PolarHBondContact O-CE1 3.43Å; S88-H105 PolarHBondContact OG-CE1 3.09Å; S88-H105 PolarHBondContact OG-ND1 3.01Å; L92-H105 HydrophobicContact CD1-CB 4.21Å; P101-H105 WeakPolarHBondContact O-CB 3.34Å; P101-H105 PolarHBondContact O-N 3.33Å; H105-T107 PolarHBondContact O-N 3.44Å; H105-F108 PolarHBondContact O-N 3.17Å; H105-F108 VanDerWaalsContact O-N 3.1Å; H105-H109 AromaticContact CE1-CD2 3.57Å; H105-H109 AromaticContact ND1-CD2 3.94Å; H105-H109 PolarHBondContact O-N 2.64Å; H105-H109 VanDerWaalsContact O-N 3.13Å
106	S	78.8	Confident	80.1	Confident	72 Å²	72	76 Å²	76	50%	0.503	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-23.1	174.7	74.3	0	0	0	0	114.5	T102 V103 K104 G110	T102-S106 WeakPolarHBondContact O-CB 3.34Å; T102-S106 PolarHBondContact O-N 3.5Å; T102-S106 PolarHBondContact O-OG 3.09Å; V103-S106 PolarHBondContact O-N 3.3Å; V103-S106 PolarHBondContact O-OG 3.06Å; K104-S106 VanDerWaalsContact C-N 3.32Å; K104-S106 PolarHBondContact O-N 3.32Å; S106-G110 WeakPolarHBondContact O-CA 3.3Å; S106-G110 PolarHBondContact O-N 2.68Å
107	T	80.8	Confident	80.6	Confident	90 Å²	90	75.8 Å²	75.8	55%	0.552	41%	0.407	S	S	*	.	H	α-helix	trans	-81.3	-26.5	174.5	-52.8	0	0	0	0	112	V103 K104 H105	V103-T107 PolarHBondContact O-N 3.19Å; V103-T107 VanDerWaalsContact O-N 3.14Å; V103-T107 PolarHBondContact O-OG1 2.91Å; K104-T107 WeakPolarHBondContact O-CA 3.45Å; K104-T107 VanDerWaalsContact O-CB 3.31Å; K104-T107 WeakPolarHBondContact O-CB 3.47Å; K104-T107 PolarHBondContact O-N 3.21Å; H105-T107 PolarHBondContact O-N 3.44Å
108	F	82.4	Confident	81.1	Confident	26 Å²	26	73.7 Å²	73.7	11%	0.114	39%	0.394	C	S	.	.	H	α-helix	trans	-82.8	-48.5	-177.8	-169.6	-111	0	0	0	112.6	M75 V83 K104 H105 I115 L120 L199 F200	M75-F108 HydrophobicContact CE-CD1 4.44Å; M75-F108 HydrophobicContact CE-CE1 3.69Å; M75-F108 HydrophobicContact CE-CE2 4.29Å; M75-F108 HydrophobicContact CE-CZ 3.6Å; M75-F108 HydrophobicContact SD-CZ 4.3Å; V83-F108 HydrophobicContact CG1-CE1 4.45Å; K104-F108 PolarHBondContact O-N 3Å; K104-F108 VanDerWaalsContact O-N 3.07Å; H105-F108 PolarHBondContact O-N 3.17Å; H105-F108 VanDerWaalsContact O-N 3.1Å; F108-I115 HydrophobicContact CD1-CG1 4.26Å; F108-I115 HydrophobicContact CE1-CB 4.18Å; F108-I115 HydrophobicContact CE1-CG1 3.89Å; F108-I115 HydrophobicContact CE1-CG2 4.33Å; F108-I115 HydrophobicContact CZ-CB 4.41Å; F108-I115 HydrophobicContact CZ-CG1 4.44Å; F108-I115 HydrophobicContact CZ-CG2 4.07Å; F108-L120 HydrophobicContact CE2-CD1 3.62Å; F108-L120 HydrophobicContact CZ-CD1 3.98Å; F108-L199 HydrophobicContact CE2-CD2 3.78Å; F108-L199 HydrophobicContact CZ-CD2 4.44Å; F108-F200 HydrophobicContact CB-CE1 4.04Å
109	H	84.1	Confident	81.7	Confident	10 Å²	10	74.1 Å²	74.1	5%	0.046	40%	0.401	C	S	.	.	H	α-helix	trans	-88.4	-39.1	-178.5	-82.4	-75.8	0	0	0	113.2	V83 D84 S88 H105 E111 D112	V83-H109 PolarHBondContact O-CE1 3.04Å; D84-H109 PolarHBondContact O-CE1 2.8Å; D84-H109 PolarHBondContact O-NE2 2.96Å; S88-H109 PolarHBondContact OG-CD2 3.29Å; S88-H109 PolarHBondContact OG-NE2 3.25Å; H105-H109 AromaticContact CE1-CD2 3.57Å; H105-H109 AromaticContact ND1-CD2 3.94Å; H105-H109 PolarHBondContact O-N 2.64Å; H105-H109 VanDerWaalsContact O-N 3.13Å; H109-E111 PolarHBondContact O-N 2.83Å; H109-D112 PolarHBondContact O-N 3.09Å
110	G	81	Confident	82.8	Confident	60 Å²	60	66 Å²	66	62%	0.619	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	-105.6	179	0	0	0	0	0	113.3	S106	S106-G110 WeakPolarHBondContact O-CA 3.3Å; S106-G110 PolarHBondContact O-N 2.68Å
111	E	78.2	Confident	83.6	Confident	194 Å²	194	61 Å²	61	91%	0.907	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-16.6	171.5	-64.6	-168.4	169.5	0	0	112.9	H109	H109-E111 PolarHBondContact O-N 2.83Å
112	D	83.5	Confident	84.4	Confident	113 Å²	113	65.6 Å²	65.6	60%	0.604	36%	0.356	S	S	*	.			trans	-80.6	170.9	175.7	-66.2	-56.9	0	0	0	110.7	H109 I115	H109-D112 PolarHBondContact O-N 3.09Å; D112-I115 HydrophobicContact CB-CD1 4.41Å
113	K	84.1	Confident	85.2	Confident	154 Å²	154	64 Å²	64	67%	0.67	35%	0.352	S	S	*	.	S	Bend	trans	-136.3	-5	-175.7	-61.3	-173.1	177.9	-172	0	114.7	V85	V85-K113 HydrophobicContact CG2-CB 4.46Å
114	L	88.2	Confident	86	Confident	99 Å²	99	59.4 Å²	59.4	52%	0.518	32%	0.323	S	S	.	.			trans	-145.6	119	-171.1	-73.7	178.7	0	0	0	105.3	D82 V83 D84	D82-L114 HydrophobicContact CB-CB 4.03Å; D82-L114 HydrophobicContact CB-CD2 4.13Å; V83-L114 CarbonylContact O-C 3.57Å; V83-L114 WeakPolarHBondContact O-CA 3.28Å; D84-L114 HydrophobicContact CB-CD2 3.89Å
115	I	91.3	Very high	86.6	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.077	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	107.1	-175.5	-57.5	-62.6	0	0	0	109.1	H72 V83 F108 D112 L120	H72-I115 PolarHBondContact CD2-O 3.33Å; H72-I115 PolarHBondContact NE2-O 3.41Å; V83-I115 HydrophobicContact CB-CB 4.46Å; V83-I115 PolarHBondContact N-O 3.22Å; V83-I115 PolarHBondContact O-N 2.8Å; F108-I115 HydrophobicContact CD1-CG1 4.26Å; F108-I115 HydrophobicContact CE1-CB 4.18Å; F108-I115 HydrophobicContact CE1-CG1 3.89Å; F108-I115 HydrophobicContact CE1-CG2 4.33Å; F108-I115 HydrophobicContact CZ-CB 4.41Å; F108-I115 HydrophobicContact CZ-CG1 4.44Å; F108-I115 HydrophobicContact CZ-CG2 4.07Å; D112-I115 HydrophobicContact CB-CD1 4.41Å; I115-L120 HydrophobicContact CG2-CB 4.16Å
116	S	92.2	Very high	87.1	Confident	13 Å²	13	62.7 Å²	62.7	9%	0.091	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	166.3	176.1	99.1	0	0	0	0	111.9	D82 E118 D119 L120	D82-S116 VanDerWaalsContact OD1-CA 3.25Å; D82-S116 WeakPolarHBondContact OD1-CA 3.44Å; D82-S116 WeakPolarHBondContact OD1-CB 3.08Å; D82-S116 PolarHBondContact OD1-N 3.33Å; S116-E118 WeakPolarHBondContact CB-OE2 3.34Å; S116-E118 PolarHBondContact O-N 3.36Å; S116-E118 WeakPolarHBondContact OG-CB 3.38Å; S116-E118 PolarHBondContact OG-N 3.48Å; S116-E118 PolarHBondContact OG-OE2 3.29Å; S116-D119 PolarHBondContact O-N 2.86Å; S116-D119 VanDerWaalsContact O-N 3.16Å; S116-D119 PolarHBondContact OG-N 2.78Å; S116-L120 PolarHBondContact O-N 3.43Å
117	V	91.8	Very high	87.6	Confident	15 Å²	15	60.2 Å²	60.2	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-55.3	-39.2	171.8	-177.9	0	0	0	0	111.6	F65 R69 H72 W121	F65-V117 HydrophobicContact CE2-CG1 3.97Å; F65-V117 HydrophobicContact CZ-CG1 3.93Å; R69-V117 HydrophobicContact CB-CG1 4.15Å; R69-V117 HydrophobicContact CG-CG1 4.11Å; R69-V117 HydrophobicContact CG-CG2 4.37Å; H72-V117 HydrophobicContact CB-CG2 4.29Å; H72-V117 WeakPolarHBondContact ND1-CG2 3.01Å; V117-W121 WeakPolarHBondContact O-CB 3.31Å; V117-W121 PolarHBondContact O-N 2.99Å; V117-W121 VanDerWaalsContact O-N 3.07Å
118	E	89.7	Confident	88	Confident	66 Å²	66	62.7 Å²	62.7	31%	0.308	34%	0.338	S	S	.	.	H	α-helix	trans	-64.9	-44	176.5	-66.5	80.5	-176.8	0	0	112.5	I51 S116 W121 K122	I51-E118 HydrophobicContact CB-CG 4.4Å; I51-E118 HydrophobicContact CD1-CG 3.73Å; I51-E118 HydrophobicContact CG1-CG 3.64Å; I51-E118 HydrophobicContact CG2-CB 4.29Å; I51-E118 HydrophobicContact CG2-CG 3.89Å; S116-E118 WeakPolarHBondContact CB-OE2 3.34Å; S116-E118 PolarHBondContact O-N 3.36Å; S116-E118 WeakPolarHBondContact OG-CB 3.38Å; S116-E118 PolarHBondContact OG-N 3.48Å; S116-E118 PolarHBondContact OG-OE2 3.29Å; E118-W121 PolarHBondContact O-N 3.41Å; E118-K122 VanDerWaalsContact O-CE 3.27Å; E118-K122 WeakPolarHBondContact O-CE 3.3Å; E118-K122 VanDerWaalsContact O-CG 3.26Å; E118-K122 WeakPolarHBondContact O-CG 3.29Å; E118-K122 PolarHBondContact O-N 2.92Å
119	D	91	Very high	88.4	Confident	70 Å²	70	61.5 Å²	61.5	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-73.1	-36.4	-177.3	-77.7	-62.7	0	0	0	111.9	S116 W121 K122 A123	S116-D119 PolarHBondContact O-N 2.86Å; S116-D119 VanDerWaalsContact O-N 3.16Å; S116-D119 PolarHBondContact OG-N 2.78Å; D119-W121 VanDerWaalsContact C-N 3.32Å; D119-W121 PolarHBondContact O-N 3.14Å; D119-K122 PolarHBondContact O-N 3.4Å; D119-K122 WeakPolarHBondContact OD1-CD 3.45Å; D119-K122 WeakPolarHBondContact OD1-CE 3.46Å; D119-K122 IonicContact OD1-NZ 2.64Å; D119-K122 PolarHBondContact OD1-NZ 3.16Å; D119-K122 IonicContact OD2-NZ 3.61Å; D119-K122 PolarHBondContact OD2-NZ 3.1Å; D119-A123 VanDerWaalsContact O-CB 3.3Å; D119-A123 WeakPolarHBondContact O-CB 3.44Å; D119-A123 PolarHBondContact O-N 2.73Å
120	L	91.5	Very high	88.8	Confident	7 Å²	7	62 Å²	62	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-40.1	168	-170.5	63.9	0	0	0	112.1	V68 I71 H72 F108 I115 S116 W124 L199	V68-L120 HydrophobicContact CG1-CB 4.26Å; V68-L120 HydrophobicContact CG1-CD2 3.79Å; V68-L120 HydrophobicContact CG1-CG 3.8Å; I71-L120 HydrophobicContact CG2-CD2 4.39Å; H72-L120 HydrophobicContact CB-CD2 3.79Å; F108-L120 HydrophobicContact CE2-CD1 3.62Å; F108-L120 HydrophobicContact CZ-CD1 3.98Å; I115-L120 HydrophobicContact CG2-CB 4.16Å; S116-L120 PolarHBondContact O-N 3.43Å; L120-W124 VanDerWaalsContact O-CB 3.28Å; L120-W124 WeakPolarHBondContact O-CB 3.35Å; L120-W124 PolarHBondContact O-N 2.8Å; L120-L199 HydrophobicContact CD1-CD2 3.98Å
121	W	91	Very high	89.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-69.2	-36	176.5	-179.9	-118	0	0	0	113.3	F48 D52 F65 V68 V117 E118 D119 W124 K125	F48-W121 AromaticContact CE2-CE2 3.68Å; F48-W121 HydrophobicContact CE2-CH2 4.46Å; F48-W121 AromaticContact CE2-CZ2 3.59Å; F48-W121 HydrophobicContact CE2-CZ2 3.59Å; F48-W121 AromaticContact CE2-NE1 3.62Å; F48-W121 AromaticContact CZ-CZ2 3.84Å; F48-W121 HydrophobicContact CZ-CZ2 3.84Å; D52-W121 PolarHBondContact OD2-NE1 2.77Å; F65-W121 HydrophobicContact CB-CD2 4.48Å; F65-W121 HydrophobicContact CB-CE3 4.27Å; F65-W121 HydrophobicContact CB-CH2 4.11Å; F65-W121 HydrophobicContact CB-CZ2 4.29Å; F65-W121 HydrophobicContact CB-CZ3 4.08Å; F65-W121 HydrophobicContact CD2-CB 4.19Å; F65-W121 AromaticContact CD2-CD2 3.63Å; F65-W121 HydrophobicContact CD2-CD2 3.63Å; F65-W121 AromaticContact CD2-CE3 3.94Å; F65-W121 HydrophobicContact CD2-CE3 3.94Å; F65-W121 AromaticContact CD2-CG 3.72Å; F65-W121 HydrophobicContact CD2-CG 3.72Å; F65-W121 HydrophobicContact CE2-CB 4.17Å; F65-W121 HydrophobicContact CE2-CD2 4.44Å; F65-W121 HydrophobicContact CE2-CG 4.06Å; V68-W121 HydrophobicContact CB-CE3 4.04Å; V68-W121 HydrophobicContact CG1-CB 4.44Å; V68-W121 HydrophobicContact CG1-CE3 4.31Å; V68-W121 HydrophobicContact CG2-CE3 3.84Å; V68-W121 HydrophobicContact CG2-CZ3 4.04Å; V117-W121 WeakPolarHBondContact O-CB 3.31Å; V117-W121 PolarHBondContact O-N 2.99Å; V117-W121 VanDerWaalsContact O-N 3.07Å; E118-W121 PolarHBondContact O-N 3.41Å; D119-W121 VanDerWaalsContact C-N 3.32Å; D119-W121 PolarHBondContact O-N 3.14Å; W121-W124 AromaticContact CE3-CD1 3.65Å; W121-W124 AromaticContact CZ3-CD1 3.49Å; W121-W124 VanDerWaalsContact CZ3-CD1 3.49Å; W121-W124 AromaticContact CZ3-NE1 3.86Å; W121-K125 HydrophobicContact CZ2-CD 4.05Å; W121-K125 HydrophobicContact CZ2-CG 4.47Å; W121-K125 PolarHBondContact O-N 2.94Å
122	K	90.1	Very high	90.1	Very high	102 Å²	102	56.9 Å²	56.9	44%	0.443	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-49.4	172	-71.6	165.8	-130.2	157	0	110.6	E118 D119 K125 S126	E118-K122 VanDerWaalsContact O-CE 3.27Å; E118-K122 WeakPolarHBondContact O-CE 3.3Å; E118-K122 VanDerWaalsContact O-CG 3.26Å; E118-K122 WeakPolarHBondContact O-CG 3.29Å; E118-K122 PolarHBondContact O-N 2.92Å; D119-K122 PolarHBondContact O-N 3.4Å; D119-K122 WeakPolarHBondContact OD1-CD 3.45Å; D119-K122 WeakPolarHBondContact OD1-CE 3.46Å; D119-K122 IonicContact OD1-NZ 2.64Å; D119-K122 PolarHBondContact OD1-NZ 3.16Å; D119-K122 IonicContact OD2-NZ 3.61Å; D119-K122 PolarHBondContact OD2-NZ 3.1Å; K122-K125 PolarHBondContact O-N 2.89Å; K122-S126 WeakPolarHBondContact O-CB 3.21Å; K122-S126 PolarHBondContact O-N 2.68Å
123	A	89.7	Confident	90.6	Very high	53 Å²	53	55 Å²	55	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-57.4	-50.8	178.5	0	0	0	0	0	111	D119 K125 S126 S127	D119-A123 VanDerWaalsContact O-CB 3.3Å; D119-A123 WeakPolarHBondContact O-CB 3.44Å; D119-A123 PolarHBondContact O-N 2.73Å; A123-K125 PolarHBondContact O-N 3.39Å; A123-S126 PolarHBondContact O-N 3.39Å; A123-S126 VanDerWaalsContact O-N 3.09Å; A123-S126 PolarHBondContact O-OG 2.63Å; A123-S127 PolarHBondContact O-N 3.24Å; A123-S127 VanDerWaalsContact O-N 3.1Å
124	W	90.8	Very high	91.1	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-51.4	-52.9	175.1	165.8	-117.7	0	0	0	112.5	V68 L120 W121 S126 S127 V129 Y130 G161 M164 P165 V198	V68-W124 HydrophobicContact CG2-CG 4.28Å; L120-W124 VanDerWaalsContact O-CB 3.28Å; L120-W124 WeakPolarHBondContact O-CB 3.35Å; L120-W124 PolarHBondContact O-N 2.8Å; W121-W124 AromaticContact CE3-CD1 3.65Å; W121-W124 AromaticContact CZ3-CD1 3.49Å; W121-W124 VanDerWaalsContact CZ3-CD1 3.49Å; W121-W124 AromaticContact CZ3-NE1 3.86Å; W124-S126 VanDerWaalsContact C-N 3.31Å; W124-S126 PolarHBondContact O-N 3.32Å; W124-S127 VanDerWaalsContact O-CB 3.3Å; W124-S127 WeakPolarHBondContact O-CB 3.31Å; W124-S127 PolarHBondContact O-N 3.17Å; W124-S127 VanDerWaalsContact O-N 3.16Å; W124-S127 PolarHBondContact O-OG 3.09Å; W124-V129 HydrophobicContact CH2-CB 4Å; W124-V129 HydrophobicContact CH2-CG1 3.67Å; W124-V129 HydrophobicContact CZ3-CB 3.71Å; W124-V129 HydrophobicContact CZ3-CG1 3.66Å; W124-Y130 AromaticContact CE2-CD2 3.8Å; W124-Y130 AromaticContact CZ2-CD2 3.92Å; W124-Y130 HydrophobicContact CZ2-CD2 3.92Å; W124-Y130 AromaticContact NE1-CD2 3.57Å; W124-G161 VanDerWaalsContact CH2-O 3.31Å; W124-G161 WeakPolarHBondContact CH2-O 3.42Å; W124-G161 VanDerWaalsContact CZ2-O 3.22Å; W124-G161 WeakPolarHBondContact CZ2-O 3.3Å; W124-M164 HydrophobicContact CH2-CB 3.71Å; W124-M164 HydrophobicContact CH2-CG 4.3Å; W124-M164 HydrophobicContact CZ2-CB 4.32Å; W124-M164 HydrophobicContact CZ3-CB 4.36Å; W124-P165 HydrophobicContact CD2-CG 4Å; W124-P165 HydrophobicContact CG-CG 4.44Å; W124-P165 HydrophobicContact CZ2-CG 3.86Å; W124-V198 HydrophobicContact CD2-CG1 4.27Å; W124-V198 HydrophobicContact CE3-CB 4.15Å; W124-V198 HydrophobicContact CE3-CG1 3.84Å; W124-V198 HydrophobicContact CE3-CG2 4.08Å; W124-V198 HydrophobicContact CH2-CG2 4.38Å; W124-V198 HydrophobicContact CZ3-CB 4.28Å; W124-V198 HydrophobicContact CZ3-CG1 4.43Å; W124-V198 HydrophobicContact CZ3-CG2 3.84Å
125	K	90.1	Very high	91.3	Very high	54 Å²	54	48.7 Å²	48.7	24%	0.235	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-27.9	178.2	-87.5	-173.3	-64	170.5	0	114.6	D52 L55 W121 K122 A123 S127 Y130	D52-K125 IonicContact OD1-NZ 3.2Å; D52-K125 IonicContact OD2-NZ 3.13Å; D52-K125 PolarHBondContact OD2-NZ 2.94Å; L55-K125 HydrophobicContact CD1-CD 4.33Å; W121-K125 HydrophobicContact CZ2-CD 4.05Å; W121-K125 HydrophobicContact CZ2-CG 4.47Å; W121-K125 PolarHBondContact O-N 2.94Å; K122-K125 PolarHBondContact O-N 2.89Å; A123-K125 PolarHBondContact O-N 3.39Å; K125-S127 VanDerWaalsContact C-N 3.27Å; K125-Y130 HydrophobicContact CB-CD2 4.4Å; K125-Y130 HydrophobicContact CD-CE2 4.3Å; K125-Y130 HydrophobicContact CG-CD2 3.7Å; K125-Y130 HydrophobicContact CG-CE2 3.56Å; K125-Y130 HydrophobicContact CG-CG 4.28Å
126	S	88.1	Confident	91.3	Very high	101 Å²	101	52.3 Å²	52.3	71%	0.706	28%	0.281	S	S	*	.	H	α-helix	trans	-75.9	-17.4	175.6	75.8	0	0	0	0	113.1	K122 A123 W124	K122-S126 WeakPolarHBondContact O-CB 3.21Å; K122-S126 PolarHBondContact O-N 2.68Å; A123-S126 PolarHBondContact O-N 3.39Å; A123-S126 VanDerWaalsContact O-N 3.09Å; A123-S126 PolarHBondContact O-OG 2.63Å; W124-S126 VanDerWaalsContact C-N 3.31Å; W124-S126 PolarHBondContact O-N 3.32Å
127	S	89.9	Confident	91.3	Very high	20 Å²	20	51.7 Å²	51.7	14%	0.14	28%	0.277	C	S	.	.	S	Bend	trans	-68.9	149.6	-179.8	80.1	0	0	0	0	112.6	A123 W124 K125 V129 Y130	A123-S127 PolarHBondContact O-N 3.24Å; A123-S127 VanDerWaalsContact O-N 3.1Å; W124-S127 VanDerWaalsContact O-CB 3.3Å; W124-S127 WeakPolarHBondContact O-CB 3.31Å; W124-S127 PolarHBondContact O-N 3.17Å; W124-S127 VanDerWaalsContact O-N 3.16Å; W124-S127 PolarHBondContact O-OG 3.09Å; K125-S127 VanDerWaalsContact C-N 3.27Å; S127-V129 PolarHBondContact O-N 3.06Å; S127-V129 PolarHBondContact OG-N 3.04Å; S127-Y130 PolarHBondContact O-N 2.93Å; S127-Y130 PolarHBondContact OG-N 3.16Å
128	E	88.7	Confident	91.4	Very high	143 Å²	143	51 Å²	51	67%	0.668	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.7	172.1	-60.8	-176.2	172	0	0	112.1	Y130 N131 W132 P202	E128-Y130 VanDerWaalsContact C-N 3.35Å; E128-Y130 PolarHBondContact O-N 3.49Å; E128-N131 PolarHBondContact O-N 2.62Å; E128-W132 VanDerWaalsContact O-CD1 3.23Å; E128-P202 HydrophobicContact CB-CG 3.73Å; E128-P202 HydrophobicContact CG-CG 4.47Å
129	V	92.3	Very high	91.5	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-36.3	-178.6	-171.1	0	0	0	0	111.9	W124 S127 N131 W132 G161 M164 T197 P202	W124-V129 HydrophobicContact CH2-CB 4Å; W124-V129 HydrophobicContact CH2-CG1 3.67Å; W124-V129 HydrophobicContact CZ3-CB 3.71Å; W124-V129 HydrophobicContact CZ3-CG1 3.66Å; S127-V129 PolarHBondContact O-N 3.06Å; S127-V129 PolarHBondContact OG-N 3.04Å; V129-N131 PolarHBondContact O-N 3.15Å; V129-W132 HydrophobicContact CB-CD2 4.31Å; V129-W132 HydrophobicContact CB-CZ2 4.45Å; V129-W132 HydrophobicContact CG1-CD2 3.9Å; V129-W132 HydrophobicContact CG1-CE3 3.69Å; V129-W132 HydrophobicContact CG1-CH2 4.13Å; V129-W132 HydrophobicContact CG1-CZ2 4.33Å; V129-W132 HydrophobicContact CG1-CZ3 3.82Å; V129-W132 HydrophobicContact CG2-CH2 4.19Å; V129-W132 HydrophobicContact CG2-CZ2 3.88Å; V129-W132 WeakPolarHBondContact O-CB 3.39Å; V129-W132 PolarHBondContact O-N 3.49Å; V129-W132 VanDerWaalsContact O-N 3.09Å; V129-G161 WeakPolarHBondContact O-CA 3.27Å; V129-M164 HydrophobicContact CG1-CB 4.44Å; V129-M164 HydrophobicContact CG1-CE 4.24Å; V129-M164 HydrophobicContact CG1-CG 3.97Å; V129-T197 HydrophobicContact CG1-CG2 3.78Å; V129-T197 HydrophobicContact CG2-CG2 3.85Å; V129-P202 HydrophobicContact CG2-CG 3.92Å; V129-P202 VanDerWaalsContact CG2-N 3.33Å
130	Y	91.9	Very high	91.6	Very high	22 Å²	22	50 Å²	50	9%	0.086	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-40.4	177.1	-176.6	-91.5	0	0	0	111.1	W124 K125 S127 E128 W132 H162	W124-Y130 AromaticContact CE2-CD2 3.8Å; W124-Y130 AromaticContact CZ2-CD2 3.92Å; W124-Y130 HydrophobicContact CZ2-CD2 3.92Å; W124-Y130 AromaticContact NE1-CD2 3.57Å; K125-Y130 HydrophobicContact CB-CD2 4.4Å; K125-Y130 HydrophobicContact CD-CE2 4.3Å; K125-Y130 HydrophobicContact CG-CD2 3.7Å; K125-Y130 HydrophobicContact CG-CE2 3.56Å; K125-Y130 HydrophobicContact CG-CG 4.28Å; S127-Y130 PolarHBondContact O-N 2.93Å; S127-Y130 PolarHBondContact OG-N 3.16Å; E128-Y130 VanDerWaalsContact C-N 3.35Å; E128-Y130 PolarHBondContact O-N 3.49Å; Y130-W132 VanDerWaalsContact C-N 3.34Å; Y130-W132 PolarHBondContact O-N 3.13Å; Y130-H162 AromaticContact CD1-CE1 3.69Å; Y130-H162 AromaticContact CD1-ND1 3.93Å; Y130-H162 AromaticContact CE1-CE1 3.21Å; Y130-H162 WeakPolarHBondContact CE1-CE1 3.37Å; Y130-H162 AromaticContact CE1-ND1 3.69Å; Y130-H162 AromaticContact CE1-NE2 3.66Å; Y130-H162 AromaticContact CE2-ND1 4Å; Y130-H162 AromaticContact CZ-CD2 3.91Å; Y130-H162 AromaticContact CZ-CE1 3.55Å; Y130-H162 AromaticContact CZ-CG 3.96Å; Y130-H162 AromaticContact CZ-ND1 3.73Å; Y130-H162 AromaticContact CZ-NE2 3.68Å; Y130-H162 PolarHBondContact O-CE1 3.25Å; Y130-H162 VanDerWaalsContact O-CE1 3.25Å; Y130-H162 PolarHBondContact O-ND1 2.83Å
131	N	92.1	Very high	91.6	Very high	116 Å²	116	49.6 Å²	49.6	62%	0.62	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	1.9	-177	-65.6	-55.6	0	0	0	114.6	E128 V129 T133	E128-N131 PolarHBondContact O-N 2.62Å; V129-N131 PolarHBondContact O-N 3.15Å; N131-T133 PolarHBondContact O-N 3Å
132	W	94.1	Very high	91.6	Very high	29 Å²	29	52 Å²	52	11%	0.11	28%	0.275	C	S	.	.			trans	-62	133.2	-177.8	-76.4	-2.5	0	0	0	113.5	E128 V129 Y130 E136 V137 W140 G161 M164 T197 P202	E128-W132 VanDerWaalsContact O-CD1 3.23Å; V129-W132 HydrophobicContact CB-CD2 4.31Å; V129-W132 HydrophobicContact CB-CZ2 4.45Å; V129-W132 HydrophobicContact CG1-CD2 3.9Å; V129-W132 HydrophobicContact CG1-CE3 3.69Å; V129-W132 HydrophobicContact CG1-CH2 4.13Å; V129-W132 HydrophobicContact CG1-CZ2 4.33Å; V129-W132 HydrophobicContact CG1-CZ3 3.82Å; V129-W132 HydrophobicContact CG2-CH2 4.19Å; V129-W132 HydrophobicContact CG2-CZ2 3.88Å; V129-W132 WeakPolarHBondContact O-CB 3.39Å; V129-W132 PolarHBondContact O-N 3.49Å; V129-W132 VanDerWaalsContact O-N 3.09Å; Y130-W132 VanDerWaalsContact C-N 3.34Å; Y130-W132 PolarHBondContact O-N 3.13Å; W132-E136 HydrophobicContact CB-CB 4.05Å; W132-E136 HydrophobicContact CD2-CB 4.41Å; W132-E136 HydrophobicContact CG-CB 4.01Å; W132-V137 HydrophobicContact CB-CG2 4.06Å; W132-V137 HydrophobicContact CE3-CG2 4.08Å; W132-W140 HydrophobicContact CH2-CB 4.15Å; W132-W140 AromaticContact CH2-CD1 3.49Å; W132-W140 VanDerWaalsContact CH2-CD1 3.49Å; W132-W140 AromaticContact CH2-CG 3.94Å; W132-W140 HydrophobicContact CH2-CG 3.94Å; W132-W140 HydrophobicContact CZ3-CB 3.79Å; W132-W140 AromaticContact CZ3-CD1 3.59Å; W132-W140 HydrophobicContact CZ3-CD2 4.2Å; W132-W140 AromaticContact CZ3-CG 3.61Å; W132-W140 HydrophobicContact CZ3-CG 3.61Å; W132-G161 PolarHBondContact O-N 3.07Å; W132-M164 HydrophobicContact CZ3-CE 4.05Å; W132-T197 HydrophobicContact CH2-CG2 3.5Å; W132-T197 HydrophobicContact CZ2-CG2 4.43Å; W132-T197 HydrophobicContact CZ3-CG2 3.79Å; W132-P202 HydrophobicContact CZ2-CB 3.84Å; W132-P202 HydrophobicContact CZ2-CG 4.02Å
133	T	93.8	Very high	91.5	Very high	74 Å²	74	49.6 Å²	49.6	45%	0.454	27%	0.269	S	S	.	.			trans	-70.5	164.7	167.6	63.1	0	0	0	0	111.8	N131 D135 E136 V137	N131-T133 PolarHBondContact O-N 3Å; T133-D135 PolarHBondContact O-N 3.03Å; T133-E136 WeakPolarHBondContact CB-OE2 3.45Å; T133-E136 WeakPolarHBondContact CG2-OE2 3.3Å; T133-E136 PolarHBondContact N-OE2 3.14Å; T133-E136 PolarHBondContact O-N 2.98Å; T133-E136 VanDerWaalsContact O-N 3.11Å; T133-E136 WeakPolarHBondContact OG1-CG 3.22Å; T133-E136 PolarHBondContact OG1-N 2.96Å; T133-E136 PolarHBondContact OG1-OE2 2.81Å; T133-V137 WeakPolarHBondContact O-CG2 3.3Å; T133-V137 PolarHBondContact O-N 3.3Å
134	V	94.5	Very high	91.4	Very high	23 Å²	23	49.3 Å²	49.3	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-59.5	-33.2	175.7	-174.8	0	0	0	0	111.5	V138 Q158	V134-V138 HydrophobicContact CG1-CG2 4.5Å; V134-V138 WeakPolarHBondContact O-CB 3.5Å; V134-V138 WeakPolarHBondContact O-CG2 3.5Å; V134-V138 PolarHBondContact O-N 3.42Å; V134-Q158 HydrophobicContact CG2-CB 4.43Å
135	D	92.2	Very high	91.4	Very high	97 Å²	97	49.2 Å²	49.2	52%	0.519	26%	0.257	S	S	.	.	H	α-helix	trans	-67.6	-37.5	175.2	-79.3	-70.8	0	0	0	112.9	T133 V138 Q139 R155	T133-D135 PolarHBondContact O-N 3.03Å; D135-V138 PolarHBondContact O-N 3.17Å; D135-Q139 WeakPolarHBondContact O-CB 3.41Å; D135-Q139 PolarHBondContact O-N 3.36Å; D135-R155 IonicContact OD1-CZ 3.54Å; D135-R155 IonicContact OD1-NH1 3.34Å; D135-R155 PolarHBondContact OD1-NH1 3.03Å; D135-R155 IonicContact OD1-NH2 3.72Å; D135-R155 PolarHBondContact OD1-NH2 3.44Å; D135-R155 IonicContact OD2-NH1 2.76Å
136	E	91.9	Very high	91.4	Very high	92 Å²	92	52.8 Å²	52.8	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-71.8	-41	177.1	-71.6	159.5	129.3	0	0	111.8	W132 T133 V138 Q139 W140	W132-E136 HydrophobicContact CB-CB 4.05Å; W132-E136 HydrophobicContact CD2-CB 4.41Å; W132-E136 HydrophobicContact CG-CB 4.01Å; T133-E136 WeakPolarHBondContact CB-OE2 3.45Å; T133-E136 WeakPolarHBondContact CG2-OE2 3.3Å; T133-E136 PolarHBondContact N-OE2 3.14Å; T133-E136 PolarHBondContact O-N 2.98Å; T133-E136 VanDerWaalsContact O-N 3.11Å; T133-E136 WeakPolarHBondContact OG1-CG 3.22Å; T133-E136 PolarHBondContact OG1-N 2.96Å; T133-E136 PolarHBondContact OG1-OE2 2.81Å; E136-V138 VanDerWaalsContact C-N 3.31Å; E136-V138 PolarHBondContact O-N 2.76Å; E136-Q139 PolarHBondContact O-N 2.71Å; E136-W140 WeakPolarHBondContact O-CB 3.31Å; E136-W140 PolarHBondContact O-N 2.85Å
137	V	93.2	Very high	91.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-40.1	171.6	178.4	0	0	0	0	111.1	W132 T133 W140 L141 F154 M164	W132-V137 HydrophobicContact CB-CG2 4.06Å; W132-V137 HydrophobicContact CE3-CG2 4.08Å; T133-V137 WeakPolarHBondContact O-CG2 3.3Å; T133-V137 PolarHBondContact O-N 3.3Å; V137-W140 HydrophobicContact CG1-CE3 4.42Å; V137-W140 WeakPolarHBondContact O-CB 3.47Å; V137-W140 PolarHBondContact O-N 3.38Å; V137-L141 WeakPolarHBondContact O-CB 3.38Å; V137-L141 PolarHBondContact O-N 3.44Å; V137-F154 HydrophobicContact CG1-CD1 3.87Å; V137-F154 HydrophobicContact CG1-CE1 4.12Å; V137-M164 HydrophobicContact CG1-SD 4.24Å
138	V	92.8	Very high	91.6	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-42.1	175.1	165.2	0	0	0	0	111.6	V134 D135 E136 W140 L141 I142 E151 F154 R155	V134-V138 HydrophobicContact CG1-CG2 4.5Å; V134-V138 WeakPolarHBondContact O-CB 3.5Å; V134-V138 WeakPolarHBondContact O-CG2 3.5Å; V134-V138 PolarHBondContact O-N 3.42Å; D135-V138 PolarHBondContact O-N 3.17Å; E136-V138 VanDerWaalsContact C-N 3.31Å; E136-V138 PolarHBondContact O-N 2.76Å; V138-W140 VanDerWaalsContact C-N 3.31Å; V138-W140 PolarHBondContact O-N 2.87Å; V138-L141 WeakPolarHBondContact O-CB 3.31Å; V138-L141 PolarHBondContact O-N 2.92Å; V138-I142 HydrophobicContact CG1-CD1 3.68Å; V138-I142 HydrophobicContact CG1-CG1 4.42Å; V138-I142 VanDerWaalsContact O-CG1 3.27Å; V138-I142 WeakPolarHBondContact O-CG1 3.26Å; V138-I142 PolarHBondContact O-N 3Å; V138-E151 HydrophobicContact CG1-CB 4.18Å; V138-E151 HydrophobicContact CG1-CG 3.6Å; V138-E151 WeakPolarHBondContact CG1-OE1 3.29Å; V138-F154 HydrophobicContact CG2-CB 3.94Å; V138-R155 HydrophobicContact CG2-CG 3.79Å
139	Q	91.3	Very high	91.7	Very high	107 Å²	107	49.4 Å²	49.4	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-38.7	176.6	-175	65.1	3.3	0	0	111.4	D135 E136 I142 T143	D135-Q139 WeakPolarHBondContact O-CB 3.41Å; D135-Q139 PolarHBondContact O-N 3.36Å; E136-Q139 PolarHBondContact O-N 2.71Å; Q139-I142 PolarHBondContact O-N 2.95Å; Q139-T143 HydrophobicContact CG-CG2 4.46Å; Q139-T143 WeakPolarHBondContact O-CB 3.38Å; Q139-T143 WeakPolarHBondContact O-CG2 3.31Å; Q139-T143 PolarHBondContact O-N 3.49Å; Q139-T143 PolarHBondContact O-OG1 3.12Å
140	W	93.4	Very high	91.6	Very high	6 Å²	6	50.5 Å²	50.5	2%	0.023	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-45.8	170.9	167.7	92.6	0	0	0	112.2	W132 E136 V137 V138 I142 T143 Y144 V145 M164 L190 K193 A194 T197	W132-W140 HydrophobicContact CH2-CB 4.15Å; W132-W140 AromaticContact CH2-CD1 3.49Å; W132-W140 VanDerWaalsContact CH2-CD1 3.49Å; W132-W140 AromaticContact CH2-CG 3.94Å; W132-W140 HydrophobicContact CH2-CG 3.94Å; W132-W140 HydrophobicContact CZ3-CB 3.79Å; W132-W140 AromaticContact CZ3-CD1 3.59Å; W132-W140 HydrophobicContact CZ3-CD2 4.2Å; W132-W140 AromaticContact CZ3-CG 3.61Å; W132-W140 HydrophobicContact CZ3-CG 3.61Å; E136-W140 WeakPolarHBondContact O-CB 3.31Å; E136-W140 PolarHBondContact O-N 2.85Å; V137-W140 HydrophobicContact CG1-CE3 4.42Å; V137-W140 WeakPolarHBondContact O-CB 3.47Å; V137-W140 PolarHBondContact O-N 3.38Å; V138-W140 VanDerWaalsContact C-N 3.31Å; V138-W140 PolarHBondContact O-N 2.87Å; W140-I142 VanDerWaalsContact C-N 3.31Å; W140-I142 PolarHBondContact O-N 3.31Å; W140-T143 PolarHBondContact O-N 2.93Å; W140-Y144 AromaticContact CD1-CD1 3.98Å; W140-Y144 AromaticContact NE1-CD1 3.56Å; W140-Y144 WeakPolarHBondContact O-CA 3.49Å; W140-Y144 WeakPolarHBondContact O-CB 3.28Å; W140-Y144 PolarHBondContact O-N 3.18Å; W140-V145 HydrophobicContact CD2-CG2 3.8Å; W140-V145 HydrophobicContact CE3-CG2 3.74Å; W140-V145 HydrophobicContact CH2-CG2 3.49Å; W140-V145 VanDerWaalsContact CH2-CG2 3.49Å; W140-V145 HydrophobicContact CZ2-CG2 3.53Å; W140-V145 HydrophobicContact CZ3-CG2 3.6Å; W140-V145 PolarHBondContact O-N 3.38Å; W140-V145 VanDerWaalsContact O-N 3.12Å; W140-M164 HydrophobicContact CD2-CE 4.12Å; W140-M164 HydrophobicContact CE3-CE 4.27Å; W140-M164 HydrophobicContact CE3-SD 4.36Å; W140-M164 HydrophobicContact CH2-CE 3.75Å; W140-M164 HydrophobicContact CH2-SD 4.25Å; W140-M164 HydrophobicContact CZ2-CE 3.56Å; W140-M164 HydrophobicContact CZ3-CE 4.09Å; W140-M164 HydrophobicContact CZ3-SD 4.11Å; W140-L190 HydrophobicContact CH2-CD1 3.65Å; W140-L190 HydrophobicContact CZ3-CD1 3.68Å; W140-K193 HydrophobicContact CZ2-CB 4.03Å; W140-A194 HydrophobicContact CH2-CB 4Å; W140-A194 HydrophobicContact CZ2-CB 4.33Å; W140-T197 PolarHBondContact NE1-OG1 2.59Å
141	L	92.6	Very high	91.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-41	175.7	-178.7	73.5	0	0	0	112	V137 V138 V145 E146 L147 F154 L190	V137-L141 WeakPolarHBondContact O-CB 3.38Å; V137-L141 PolarHBondContact O-N 3.44Å; V138-L141 WeakPolarHBondContact O-CB 3.31Å; V138-L141 PolarHBondContact O-N 2.92Å; L141-V145 HydrophobicContact CD1-CB 4.3Å; L141-V145 HydrophobicContact CD1-CG2 4.45Å; L141-E146 PolarHBondContact O-N 3.38Å; L141-E146 VanDerWaalsContact O-N 3.08Å; L141-L147 HydrophobicContact CD1-CB 3.96Å; L141-L147 HydrophobicContact CG-CB 4.37Å; L141-L147 PolarHBondContact O-N 3.05Å; L141-F154 HydrophobicContact CD1-CE1 4.33Å; L141-F154 HydrophobicContact CD1-CE2 3.98Å; L141-F154 HydrophobicContact CD1-CZ 3.83Å; L141-F154 HydrophobicContact CD2-CB 4.36Å; L141-F154 HydrophobicContact CD2-CD1 4.17Å; L141-F154 HydrophobicContact CD2-CD2 3.54Å; L141-F154 HydrophobicContact CD2-CE1 4.35Å; L141-F154 HydrophobicContact CD2-CE2 3.75Å; L141-F154 HydrophobicContact CD2-CG 3.77Å; L141-F154 HydrophobicContact CD2-CZ 4.16Å; L141-L190 HydrophobicContact CD1-CD1 3.95Å
142	I	90.6	Very high	91.4	Very high	49 Å²	49	52.8 Å²	52.8	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-73.1	-43.5	179.3	-66.2	163.8	0	0	0	111.7	V138 Q139 W140 E146 P148	V138-I142 HydrophobicContact CG1-CD1 3.68Å; V138-I142 HydrophobicContact CG1-CG1 4.42Å; V138-I142 VanDerWaalsContact O-CG1 3.27Å; V138-I142 WeakPolarHBondContact O-CG1 3.26Å; V138-I142 PolarHBondContact O-N 3Å; Q139-I142 PolarHBondContact O-N 2.95Å; W140-I142 VanDerWaalsContact C-N 3.31Å; W140-I142 PolarHBondContact O-N 3.31Å; I142-E146 WeakPolarHBondContact O-CA 3.28Å; I142-P148 HydrophobicContact CG1-CB 4.08Å; I142-P148 HydrophobicContact CG2-CB 4.42Å
143	T	87.9	Confident	91.2	Very high	53 Å²	53	52.8 Å²	52.8	33%	0.325	27%	0.267	S	S	.	.	H	α-helix	trans	-102.9	-24.3	-166.4	61.1	0	0	0	0	115.7	Q139 W140	Q139-T143 HydrophobicContact CG-CG2 4.46Å; Q139-T143 WeakPolarHBondContact O-CB 3.38Å; Q139-T143 WeakPolarHBondContact O-CG2 3.31Å; Q139-T143 PolarHBondContact O-N 3.49Å; Q139-T143 PolarHBondContact O-OG1 3.12Å; W140-T143 PolarHBondContact O-N 2.93Å
144	Y	87.6	Confident	91.1	Very high	46 Å²	46	49.3 Å²	49.3	18%	0.18	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-34.7	-178.7	-170.9	-119	0	0	0	113.5	W140 K193 D196 P203	W140-Y144 AromaticContact CD1-CD1 3.98Å; W140-Y144 AromaticContact NE1-CD1 3.56Å; W140-Y144 WeakPolarHBondContact O-CA 3.49Å; W140-Y144 WeakPolarHBondContact O-CB 3.28Å; W140-Y144 PolarHBondContact O-N 3.18Å; Y144-K193 HydrophobicContact CD1-CD 3.63Å; Y144-K193 HydrophobicContact CE1-CD 3.27Å; Y144-K193 HydrophobicContact CE1-CG 4.48Å; Y144-K193 HydrophobicContact CE2-CD 4.38Å; Y144-K193 HydrophobicContact CG-CD 4.34Å; Y144-K193 PolarHBondContact OH-NZ 3.16Å; Y144-D196 VanDerWaalsContact CE1-OD2 3.3Å; Y144-D196 WeakPolarHBondContact CE1-OD2 3.5Å; Y144-D196 VanDerWaalsContact CZ-OD2 3.29Å; Y144-D196 PolarHBondContact OH-OD2 3.06Å; Y144-P203 HydrophobicContact CD1-CB 3.62Å; Y144-P203 HydrophobicContact CD1-CG 3.7Å; Y144-P203 HydrophobicContact CD2-CB 3.53Å; Y144-P203 HydrophobicContact CD2-CG 4.07Å; Y144-P203 HydrophobicContact CE1-CB 3.62Å; Y144-P203 HydrophobicContact CE1-CG 4.17Å; Y144-P203 HydrophobicContact CE2-CB 3.57Å; Y144-P203 HydrophobicContact CG-CB 3.58Å; Y144-P203 HydrophobicContact CG-CG 3.64Å
145	V	90	Very high	91.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.255	C	S	.	.	S	Bend	trans	-87.4	-22.2	171	-158.6	0	0	0	0	111.4	W140 L141 L147 K189 L190 K193	W140-V145 HydrophobicContact CD2-CG2 3.8Å; W140-V145 HydrophobicContact CE3-CG2 3.74Å; W140-V145 HydrophobicContact CH2-CG2 3.49Å; W140-V145 VanDerWaalsContact CH2-CG2 3.49Å; W140-V145 HydrophobicContact CZ2-CG2 3.53Å; W140-V145 HydrophobicContact CZ3-CG2 3.6Å; W140-V145 PolarHBondContact O-N 3.38Å; W140-V145 VanDerWaalsContact O-N 3.12Å; L141-V145 HydrophobicContact CD1-CB 4.3Å; L141-V145 HydrophobicContact CD1-CG2 4.45Å; V145-L147 VanDerWaalsContact C-N 3.33Å; V145-L147 HydrophobicContact CB-CG 4.49Å; V145-L147 HydrophobicContact CG1-CB 4.49Å; V145-L147 HydrophobicContact CG1-CD1 3.63Å; V145-L147 HydrophobicContact CG1-CG 3.9Å; V145-L147 PolarHBondContact O-N 3.01Å; V145-K189 HydrophobicContact CG1-CG 4.4Å; V145-K189 WeakPolarHBondContact O-CD 3.5Å; V145-K189 WeakPolarHBondContact O-CE 3.48Å; V145-K189 PolarHBondContact O-NZ 2.81Å; V145-L190 HydrophobicContact CG1-CB 4.31Å; V145-L190 HydrophobicContact CG1-CD1 4.19Å; V145-L190 HydrophobicContact CG2-CD1 4.41Å; V145-K193 HydrophobicContact CG1-CB 4.27Å; V145-K193 HydrophobicContact CG1-CG 4.32Å; V145-K193 HydrophobicContact CG2-CB 3.97Å; V145-K193 HydrophobicContact CG2-CG 4.48Å
146	E	90.8	Very high	90.9	Very high	129 Å²	129	54.8 Å²	54.8	60%	0.603	26%	0.26	S	S	*	.			trans	58.4	39.2	-177.8	-41.5	169	121.2	0	0	113	L141 I142 P148 K189	L141-E146 PolarHBondContact O-N 3.38Å; L141-E146 VanDerWaalsContact O-N 3.08Å; I142-E146 WeakPolarHBondContact O-CA 3.28Å; E146-P148 WeakPolarHBondContact O-CD 3.48Å; E146-K189 IonicContact OE2-NZ 2.81Å; E146-K189 PolarHBondContact OE2-NZ 3.32Å
147	L	91.3	Very high	90.7	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.031	26%	0.257	C	S	.	.			trans	-119.7	54.5	-179.6	-63.8	-179.7	0	0	0	113.2	L141 V145 Q149 Y150 M181 H186 L190	L141-L147 HydrophobicContact CD1-CB 3.96Å; L141-L147 HydrophobicContact CG-CB 4.37Å; L141-L147 PolarHBondContact O-N 3.05Å; V145-L147 VanDerWaalsContact C-N 3.33Å; V145-L147 HydrophobicContact CB-CG 4.49Å; V145-L147 HydrophobicContact CG1-CB 4.49Å; V145-L147 HydrophobicContact CG1-CD1 3.63Å; V145-L147 HydrophobicContact CG1-CG 3.9Å; V145-L147 PolarHBondContact O-N 3.01Å; L147-Q149 PolarHBondContact O-N 3.44Å; L147-Y150 HydrophobicContact CB-CD2 4.06Å; L147-Y150 HydrophobicContact CD1-CD2 4.37Å; L147-Y150 HydrophobicContact CD1-CE2 4.46Å; L147-Y150 PolarHBondContact O-N 3.3Å; L147-Y150 VanDerWaalsContact O-N 3.17Å; L147-M181 HydrophobicContact CD1-CE 3.96Å; L147-H186 HydrophobicContact CD1-CB 4.05Å; L147-H186 HydrophobicContact CD2-CB 4.18Å; L147-H186 VanDerWaalsContact CD2-CD2 3.44Å; L147-H186 WeakPolarHBondContact CD2-CD2 3.41Å; L147-L190 HydrophobicContact CD1-CB 4.3Å
148	P	91.3	Very high	90.6	Very high	70 Å²	70	60.1 Å²	60.1	46%	0.455	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-58.2	-27.1	-175.8	25.5	-35.9	0	0	0	113.8	I142 E146 Y150 E151	I142-P148 HydrophobicContact CG1-CB 4.08Å; I142-P148 HydrophobicContact CG2-CB 4.42Å; E146-P148 WeakPolarHBondContact O-CD 3.48Å; P148-Y150 PolarHBondContact O-N 3.45Å; P148-E151 VanDerWaalsContact O-CB 3.25Å; P148-E151 WeakPolarHBondContact O-CB 3.41Å; P148-E151 PolarHBondContact O-N 3.14Å
149	Q	89.3	Confident	90.4	Very high	117 Å²	117	61 Å²	61	55%	0.547	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-59.6	-13	178.2	71	-154.6	0.5	0	0	115.4	L147 H186	L147-Q149 PolarHBondContact O-N 3.44Å; Q149-H186 PolarHBondContact NE2-CE1 2.84Å; Q149-H186 PolarHBondContact NE2-ND1 3.28Å; Q149-H186 PolarHBondContact NE2-NE2 3.39Å
150	Y	90.4	Very high	90.4	Very high	23 Å²	23	57.7 Å²	57.7	9%	0.09	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-106.1	1.7	175.1	-56.7	-60.4	0	0	0	113.7	L147 P148 E152 T153 F154 M181 H186	L147-Y150 HydrophobicContact CB-CD2 4.06Å; L147-Y150 HydrophobicContact CD1-CD2 4.37Å; L147-Y150 HydrophobicContact CD1-CE2 4.46Å; L147-Y150 PolarHBondContact O-N 3.3Å; L147-Y150 VanDerWaalsContact O-N 3.17Å; P148-Y150 PolarHBondContact O-N 3.45Å; Y150-E152 PolarHBondContact O-N 2.97Å; Y150-T153 WeakPolarHBondContact O-CA 3.44Å; Y150-T153 WeakPolarHBondContact O-CB 3.4Å; Y150-T153 PolarHBondContact O-N 3.45Å; Y150-F154 WeakPolarHBondContact O-CD2 3.33Å; Y150-F154 PolarHBondContact O-N 3.03Å; Y150-F154 VanDerWaalsContact O-N 3.08Å; Y150-M181 HydrophobicContact CD1-CG 4.14Å; Y150-M181 HydrophobicContact CD2-CE 3.9Å; Y150-M181 HydrophobicContact CD2-CG 4.17Å; Y150-M181 HydrophobicContact CE1-CB 4.44Å; Y150-M181 HydrophobicContact CE1-CG 3.92Å; Y150-M181 HydrophobicContact CE2-CE 3.74Å; Y150-M181 HydrophobicContact CE2-CG 3.95Å; Y150-M181 HydrophobicContact CG-CG 4.28Å; Y150-H186 HydrophobicContact CE2-CB 3.92Å; Y150-H186 AromaticContact CE2-ND1 3.84Å; Y150-H186 AromaticContact CZ-ND1 3.87Å; Y150-H186 PolarHBondContact OH-ND1 3.12Å
151	E	92.2	Very high	90.2	Very high	58 Å²	58	57.4 Å²	57.4	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-48.5	-52.7	177.9	163.5	168	-154.3	0	0	112.2	V138 P148 T153 F154 R155	V138-E151 HydrophobicContact CG1-CB 4.18Å; V138-E151 HydrophobicContact CG1-CG 3.6Å; V138-E151 WeakPolarHBondContact CG1-OE1 3.29Å; P148-E151 VanDerWaalsContact O-CB 3.25Å; P148-E151 WeakPolarHBondContact O-CB 3.41Å; P148-E151 PolarHBondContact O-N 3.14Å; E151-T153 PolarHBondContact O-N 2.91Å; E151-T153 VanDerWaalsContact O-N 3.16Å; E151-F154 PolarHBondContact O-N 3.19Å; E151-R155 HydrophobicContact CG-CG 4.32Å; E151-R155 WeakPolarHBondContact O-CG 3.44Å; E151-R155 PolarHBondContact O-N 2.55Å; E151-R155 IonicContact OE1-CZ 3.16Å; E151-R155 VanDerWaalsContact OE1-CZ 3.24Å; E151-R155 IonicContact OE1-NE 3.19Å; E151-R155 PolarHBondContact OE1-NE 3.23Å; E151-R155 IonicContact OE1-NH2 2.62Å; E151-R155 PolarHBondContact OE1-NH2 3.25Å
152	E	88.6	Confident	90.2	Very high	128 Å²	128	60.2 Å²	60.2	60%	0.598	29%	0.292	S	S	*	.	H	α-helix	trans	-57.4	-33.1	-179.8	-81.3	-165.7	-144.7	0	0	112.6	Y150 K156	Y150-E152 PolarHBondContact O-N 2.97Å; E152-K156 VanDerWaalsContact O-CB 3.29Å; E152-K156 WeakPolarHBondContact O-CB 3.39Å; E152-K156 WeakPolarHBondContact O-CD 3.18Å; E152-K156 WeakPolarHBondContact O-CG 3.45Å; E152-K156 PolarHBondContact O-N 3.46Å; E152-K156 IonicContact OE2-NZ 2.65Å; E152-K156 PolarHBondContact OE2-NZ 3.21Å
153	T	89.9	Confident	90.2	Very high	30 Å²	30	58.1 Å²	58.1	18%	0.184	28%	0.282	C	S	.	.	H	α-helix	trans	-74.9	-43.8	180	-55	0	0	0	0	110.8	Y150 E151 R155 K156 L157 L179	Y150-T153 WeakPolarHBondContact O-CA 3.44Å; Y150-T153 WeakPolarHBondContact O-CB 3.4Å; Y150-T153 PolarHBondContact O-N 3.45Å; E151-T153 PolarHBondContact O-N 2.91Å; E151-T153 VanDerWaalsContact O-N 3.16Å; T153-R155 PolarHBondContact O-N 3.28Å; T153-K156 PolarHBondContact O-N 3.37Å; T153-L157 HydrophobicContact CG2-CD1 3.73Å; T153-L157 HydrophobicContact CG2-CG 4.46Å; T153-L157 WeakPolarHBondContact O-CB 3.3Å; T153-L157 VanDerWaalsContact O-CG 3.27Å; T153-L157 WeakPolarHBondContact O-CG 3.35Å; T153-L157 PolarHBondContact O-N 3.44Å; T153-L179 HydrophobicContact CG2-CD2 4.26Å
154	F	91.9	Very high	90.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-43	174.7	-84.1	-116.3	0	0	0	111.7	V137 V138 L141 Y150 E151 L157 Q158 L159 L167 L179 L190	V137-F154 HydrophobicContact CG1-CD1 3.87Å; V137-F154 HydrophobicContact CG1-CE1 4.12Å; V138-F154 HydrophobicContact CG2-CB 3.94Å; L141-F154 HydrophobicContact CD1-CE1 4.33Å; L141-F154 HydrophobicContact CD1-CE2 3.98Å; L141-F154 HydrophobicContact CD1-CZ 3.83Å; L141-F154 HydrophobicContact CD2-CB 4.36Å; L141-F154 HydrophobicContact CD2-CD1 4.17Å; L141-F154 HydrophobicContact CD2-CD2 3.54Å; L141-F154 HydrophobicContact CD2-CE1 4.35Å; L141-F154 HydrophobicContact CD2-CE2 3.75Å; L141-F154 HydrophobicContact CD2-CG 3.77Å; L141-F154 HydrophobicContact CD2-CZ 4.16Å; Y150-F154 WeakPolarHBondContact O-CD2 3.33Å; Y150-F154 PolarHBondContact O-N 3.03Å; Y150-F154 VanDerWaalsContact O-N 3.08Å; E151-F154 PolarHBondContact O-N 3.19Å; F154-L157 PolarHBondContact O-N 3.25Å; F154-Q158 PolarHBondContact O-N 3.09Å; F154-Q158 VanDerWaalsContact O-N 3.09Å; F154-L159 HydrophobicContact CD1-CB 4.13Å; F154-L159 HydrophobicContact CD1-CD1 3.73Å; F154-L159 HydrophobicContact CD2-CD1 4.42Å; F154-L159 HydrophobicContact CE1-CD1 3.97Å; F154-L159 HydrophobicContact CG-CD1 3.98Å; F154-L159 HydrophobicContact CZ-CD1 4.42Å; F154-L159 PolarHBondContact O-N 2.66Å; F154-L167 HydrophobicContact CE1-CD1 3.76Å; F154-L167 HydrophobicContact CZ-CD1 4.2Å; F154-L179 HydrophobicContact CD2-CD2 3.87Å; F154-L179 HydrophobicContact CE2-CD2 3.56Å; F154-L179 HydrophobicContact CZ-CD2 4.12Å; F154-L190 HydrophobicContact CZ-CD1 4Å; F154-L190 HydrophobicContact CZ-CD2 3.96Å
155	R	92.8	Very high	90.6	Very high	88 Å²	88	53.4 Å²	53.4	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-43.8	174.2	-68.5	-176.3	179.4	-73.8	0.3	112.7	D135 V138 E151 T153 L157 Q158	D135-R155 IonicContact OD1-CZ 3.54Å; D135-R155 IonicContact OD1-NH1 3.34Å; D135-R155 PolarHBondContact OD1-NH1 3.03Å; D135-R155 IonicContact OD1-NH2 3.72Å; D135-R155 PolarHBondContact OD1-NH2 3.44Å; D135-R155 IonicContact OD2-NH1 2.76Å; V138-R155 HydrophobicContact CG2-CG 3.79Å; E151-R155 HydrophobicContact CG-CG 4.32Å; E151-R155 WeakPolarHBondContact O-CG 3.44Å; E151-R155 PolarHBondContact O-N 2.55Å; E151-R155 IonicContact OE1-CZ 3.16Å; E151-R155 VanDerWaalsContact OE1-CZ 3.24Å; E151-R155 IonicContact OE1-NE 3.19Å; E151-R155 PolarHBondContact OE1-NE 3.23Å; E151-R155 IonicContact OE1-NH2 2.62Å; E151-R155 PolarHBondContact OE1-NH2 3.25Å; T153-R155 PolarHBondContact O-N 3.28Å; R155-L157 VanDerWaalsContact C-N 3.3Å; R155-L157 PolarHBondContact O-N 2.75Å; R155-Q158 PolarHBondContact O-N 2.51Å; R155-Q158 PolarHBondContact O-NE2 2.86Å
156	K	89.9	Confident	90.7	Very high	147 Å²	147	55.3 Å²	55.3	64%	0.639	27%	0.265	S	S	*	.	H	α-helix	trans	-68.8	-26.7	179.3	-73.8	163.5	-162.2	171.6	0	113.4	E152 T153	E152-K156 VanDerWaalsContact O-CB 3.29Å; E152-K156 WeakPolarHBondContact O-CB 3.39Å; E152-K156 WeakPolarHBondContact O-CD 3.18Å; E152-K156 WeakPolarHBondContact O-CG 3.45Å; E152-K156 PolarHBondContact O-N 3.46Å; E152-K156 IonicContact OE2-NZ 2.65Å; E152-K156 PolarHBondContact OE2-NZ 3.21Å; T153-K156 PolarHBondContact O-N 3.37Å
157	L	87.3	Confident	90.7	Very high	69 Å²	69	49.3 Å²	49.3	36%	0.361	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-3.3	177.2	-66.8	168.8	0	0	0	113.6	T153 F154 R155 L159 V178 L179	T153-L157 HydrophobicContact CG2-CD1 3.73Å; T153-L157 HydrophobicContact CG2-CG 4.46Å; T153-L157 WeakPolarHBondContact O-CB 3.3Å; T153-L157 VanDerWaalsContact O-CG 3.27Å; T153-L157 WeakPolarHBondContact O-CG 3.35Å; T153-L157 PolarHBondContact O-N 3.44Å; F154-L157 PolarHBondContact O-N 3.25Å; R155-L157 VanDerWaalsContact C-N 3.3Å; R155-L157 PolarHBondContact O-N 2.75Å; L157-L159 VanDerWaalsContact C-N 3.29Å; L157-L159 HydrophobicContact CB-CD1 4.31Å; L157-L159 HydrophobicContact CB-CD2 4.24Å; L157-L159 HydrophobicContact CB-CG 3.87Å; L157-L159 HydrophobicContact CD1-CD1 4.35Å; L157-L159 PolarHBondContact O-N 3.18Å; L157-V178 HydrophobicContact CD1-CG1 3.78Å; L157-V178 HydrophobicContact CD2-CG1 3.73Å; L157-V178 HydrophobicContact CG-CG1 4.43Å; L157-L179 HydrophobicContact CD1-CD2 3.86Å
158	Q	90.3	Very high	90.6	Very high	136 Å²	136	49.1 Å²	49.1	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	41.7	-179.1	-63.8	-70.1	-69.6	0	0	113.5	V134 F154 R155 S160	V134-Q158 HydrophobicContact CG2-CB 4.43Å; F154-Q158 PolarHBondContact O-N 3.09Å; F154-Q158 VanDerWaalsContact O-N 3.09Å; R155-Q158 PolarHBondContact O-N 2.51Å; R155-Q158 PolarHBondContact O-NE2 2.86Å; Q158-S160 PolarHBondContact O-N 2.85Å
159	L	89.6	Confident	90.5	Very high	20 Å²	20	46.9 Å²	46.9	11%	0.105	22%	0.222	C	C	.	.			trans	-72.2	103.3	-178.9	-62.1	178.2	0	0	0	110.9	F154 L157 A163 L179	F154-L159 HydrophobicContact CD1-CB 4.13Å; F154-L159 HydrophobicContact CD1-CD1 3.73Å; F154-L159 HydrophobicContact CD2-CD1 4.42Å; F154-L159 HydrophobicContact CE1-CD1 3.97Å; F154-L159 HydrophobicContact CG-CD1 3.98Å; F154-L159 HydrophobicContact CZ-CD1 4.42Å; F154-L159 PolarHBondContact O-N 2.66Å; L157-L159 VanDerWaalsContact C-N 3.29Å; L157-L159 HydrophobicContact CB-CD1 4.31Å; L157-L159 HydrophobicContact CB-CD2 4.24Å; L157-L159 HydrophobicContact CB-CG 3.87Å; L157-L159 HydrophobicContact CD1-CD1 4.35Å; L157-L159 PolarHBondContact O-N 3.18Å; L159-A163 HydrophobicContact CD2-CB 4.05Å; L159-L179 HydrophobicContact CD1-CD2 3.77Å
160	S	90.6	Very high	89.9	Confident	37 Å²	37	45.8 Å²	45.8	26%	0.259	22%	0.223	S	C	.	.			trans	-90.1	175.9	172.6	65	0	0	0	0	112	Q158 H162 A163	Q158-S160 PolarHBondContact O-N 2.85Å; S160-H162 PolarHBondContact O-N 2.95Å; S160-A163 WeakPolarHBondContact O-CB 3.21Å; S160-A163 PolarHBondContact O-N 3.33Å
161	G	90.3	Very high	89.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-50	-38.4	175.9	0	0	0	0	0	114.1	W124 V129 W132 A163 M164	W124-G161 VanDerWaalsContact CH2-O 3.31Å; W124-G161 WeakPolarHBondContact CH2-O 3.42Å; W124-G161 VanDerWaalsContact CZ2-O 3.22Å; W124-G161 WeakPolarHBondContact CZ2-O 3.3Å; V129-G161 WeakPolarHBondContact O-CA 3.27Å; W132-G161 PolarHBondContact O-N 3.07Å; G161-A163 PolarHBondContact O-N 3.29Å; G161-M164 VanDerWaalsContact O-CB 3.31Å; G161-M164 WeakPolarHBondContact O-CB 3.42Å; G161-M164 WeakPolarHBondContact O-CG 3.16Å; G161-M164 PolarHBondContact O-N 2.94Å
162	H	90.9	Very high	88.1	Confident	59 Å²	59	50.3 Å²	50.3	27%	0.273	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-57.1	-23.4	177.7	-59.5	18.4	0	0	0	113	E61 S64 Y130 S160	E61-H162 IonicContact OE1-CD2 2.72Å; E61-H162 PolarHBondContact OE1-CD2 3.42Å; E61-H162 IonicContact OE1-CG 3.52Å; S64-H162 PolarHBondContact OG-O 3.38Å; Y130-H162 AromaticContact CD1-CE1 3.69Å; Y130-H162 AromaticContact CD1-ND1 3.93Å; Y130-H162 AromaticContact CE1-CE1 3.21Å; Y130-H162 WeakPolarHBondContact CE1-CE1 3.37Å; Y130-H162 AromaticContact CE1-ND1 3.69Å; Y130-H162 AromaticContact CE1-NE2 3.66Å; Y130-H162 AromaticContact CE2-ND1 4Å; Y130-H162 AromaticContact CZ-CD2 3.91Å; Y130-H162 AromaticContact CZ-CE1 3.55Å; Y130-H162 AromaticContact CZ-CG 3.96Å; Y130-H162 AromaticContact CZ-ND1 3.73Å; Y130-H162 AromaticContact CZ-NE2 3.68Å; Y130-H162 PolarHBondContact O-CE1 3.25Å; Y130-H162 VanDerWaalsContact O-CE1 3.25Å; Y130-H162 PolarHBondContact O-ND1 2.83Å; S160-H162 PolarHBondContact O-N 2.95Å
163	A	90.4	Very high	87.4	Confident	4 Å²	4	48 Å²	48	3%	0.033	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-85.6	-8.6	178.3	0	0	0	0	0	114.6	L159 S160 G161 R166 L167	L159-A163 HydrophobicContact CD2-CB 4.05Å; S160-A163 WeakPolarHBondContact O-CB 3.21Å; S160-A163 PolarHBondContact O-N 3.33Å; G161-A163 PolarHBondContact O-N 3.29Å; A163-R166 WeakPolarHBondContact O-CA 3.27Å; A163-R166 WeakPolarHBondContact O-CB 3.45Å; A163-R166 PolarHBondContact O-N 3.48Å; A163-L167 PolarHBondContact O-N 3.44Å
164	M	92.3	Very high	86.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-41.1	-171.9	-69.2	-73.6	-69	0	0	114.9	W124 V129 W132 V137 W140 G161 R166 L167 A168 T197 V198	W124-M164 HydrophobicContact CH2-CB 3.71Å; W124-M164 HydrophobicContact CH2-CG 4.3Å; W124-M164 HydrophobicContact CZ2-CB 4.32Å; W124-M164 HydrophobicContact CZ3-CB 4.36Å; V129-M164 HydrophobicContact CG1-CB 4.44Å; V129-M164 HydrophobicContact CG1-CE 4.24Å; V129-M164 HydrophobicContact CG1-CG 3.97Å; W132-M164 HydrophobicContact CZ3-CE 4.05Å; V137-M164 HydrophobicContact CG1-SD 4.24Å; W140-M164 HydrophobicContact CD2-CE 4.12Å; W140-M164 HydrophobicContact CE3-CE 4.27Å; W140-M164 HydrophobicContact CE3-SD 4.36Å; W140-M164 HydrophobicContact CH2-CE 3.75Å; W140-M164 HydrophobicContact CH2-SD 4.25Å; W140-M164 HydrophobicContact CZ2-CE 3.56Å; W140-M164 HydrophobicContact CZ3-CE 4.09Å; W140-M164 HydrophobicContact CZ3-SD 4.11Å; G161-M164 VanDerWaalsContact O-CB 3.31Å; G161-M164 WeakPolarHBondContact O-CB 3.42Å; G161-M164 WeakPolarHBondContact O-CG 3.16Å; G161-M164 PolarHBondContact O-N 2.94Å; M164-R166 PolarHBondContact O-N 3.14Å; M164-L167 WeakPolarHBondContact O-CB 3.49Å; M164-L167 PolarHBondContact O-N 3.48Å; M164-L167 HydrophobicContact SD-CD1 4.13Å; M164-A168 PolarHBondContact O-N 3.48Å; M164-T197 HydrophobicContact CE-CG2 3.61Å; M164-V198 HydrophobicContact CB-CG2 3.84Å
165	P	93.4	Very high	85.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-36.6	172.9	-26.2	36.2	0	0	0	112.7	A67 V68 I71 W124 L167 A168 V169 V198	A67-P165 HydrophobicContact CB-CB 3.82Å; V68-P165 HydrophobicContact CG2-CB 3.67Å; V68-P165 HydrophobicContact CG2-CG 3.67Å; I71-P165 HydrophobicContact CD1-CB 4.28Å; W124-P165 HydrophobicContact CD2-CG 4Å; W124-P165 HydrophobicContact CG-CG 4.44Å; W124-P165 HydrophobicContact CZ2-CG 3.86Å; P165-L167 PolarHBondContact O-N 3Å; P165-A168 PolarHBondContact O-N 2.65Å; P165-V169 PolarHBondContact O-N 3.48Å; P165-V198 HydrophobicContact CG-CG1 4.27Å; P165-V198 HydrophobicContact CG-CG2 4.08Å
166	R	90.4	Very high	84.7	Confident	40 Å²	40	46.2 Å²	46.2	15%	0.151	25%	0.25	C	C	.	.	H	α-helix	trans	-70.2	-11.6	177.8	-54	-173.3	-76.7	172.3	-4.4	113.2	D60 S64 A67 A163 M164	D60-R166 IonicContact OD1-CZ 3.58Å; D60-R166 IonicContact OD1-NH1 3.51Å; D60-R166 PolarHBondContact OD1-NH1 3.16Å; D60-R166 IonicContact OD1-NH2 3.35Å; D60-R166 PolarHBondContact OD1-NH2 3.49Å; S64-R166 WeakPolarHBondContact OG-CD 3.27Å; S64-R166 WeakPolarHBondContact OG-CG 3.46Å; S64-R166 PolarHBondContact OG-NE 2.96Å; A67-R166 HydrophobicContact CB-CG 4.02Å; A163-R166 WeakPolarHBondContact O-CA 3.27Å; A163-R166 WeakPolarHBondContact O-CB 3.45Å; A163-R166 PolarHBondContact O-N 3.48Å; M164-R166 PolarHBondContact O-N 3.14Å
167	L	90.9	Very high	83.7	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-95.1	-22.3	170.4	-57.4	-179.8	0	0	0	112.9	F154 A163 M164 P165 L179 Q191 A194	F154-L167 HydrophobicContact CE1-CD1 3.76Å; F154-L167 HydrophobicContact CZ-CD1 4.2Å; A163-L167 PolarHBondContact O-N 3.44Å; M164-L167 WeakPolarHBondContact O-CB 3.49Å; M164-L167 PolarHBondContact O-N 3.48Å; M164-L167 HydrophobicContact SD-CD1 4.13Å; P165-L167 PolarHBondContact O-N 3Å; L167-L179 HydrophobicContact CD2-CD1 3.78Å; L167-Q191 WeakPolarHBondContact O-CA 3.09Å; L167-A194 HydrophobicContact CB-CB 3.84Å
168	A	90.3	Very high	83.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-82.4	-18.9	179.1	0	0	0	0	0	113.9	I71 M164 P165 Q191 A194 L195	I71-A168 HydrophobicContact CD1-CB 3.74Å; I71-A168 HydrophobicContact CG1-CB 4.4Å; M164-A168 PolarHBondContact O-N 3.48Å; P165-A168 PolarHBondContact O-N 2.65Å; A168-Q191 WeakPolarHBondContact O-CG 3.39Å; A168-Q191 PolarHBondContact O-NE2 2.79Å; A168-Q191 VanDerWaalsContact O-NE2 3.09Å; A168-A194 HydrophobicContact CB-CB 3.95Å; A168-L195 HydrophobicContact CB-CB 4Å
169	V	88.1	Confident	82.4	Confident	24 Å²	24	37.2 Å²	37.2	15%	0.145	22%	0.219	C	C	.	.	S	Bend	trans	-93.1	147.4	176.9	178	0	0	0	0	111.4	A67 N70 I71 P165 N171	A67-V169 HydrophobicContact CB-CG2 3.93Å; A67-V169 WeakPolarHBondContact O-CG2 2.99Å; N70-V169 HydrophobicContact CB-CG1 4.17Å; N70-V169 HydrophobicContact CB-CG2 3.98Å; I71-V169 HydrophobicContact CD1-CG2 4.39Å; I71-V169 HydrophobicContact CG1-CG2 3.87Å; P165-V169 PolarHBondContact O-N 3.48Å; V169-N171 PolarHBondContact O-N 3.43Å
170	T	76.5	Confident	82	Confident	94 Å²	94	43.2 Å²	43.2	58%	0.577	25%	0.245	S	C	*	.			trans	-69.3	38.7	-177	49.4	0	0	0	0	115.5	T172	T170-T172 PolarHBondContact O-N 3.4Å
171	N	74.6	Confident	81.5	Confident	73 Å²	73	41.5 Å²	41.5	39%	0.39	23%	0.232	S	C	.	.			trans	-71.7	104	177.7	-167	-35.5	0	0	0	111.3	V169 T173 M174 T175	V169-N171 PolarHBondContact O-N 3.43Å; N171-T173 VanDerWaalsContact C-N 3.26Å; N171-T173 PolarHBondContact O-N 2.99Å; N171-T173 PolarHBondContact OD1-N 3.2Å; N171-T173 PolarHBondContact OD1-OG1 3.16Å; N171-M174 HydrophobicContact CB-CB 4.06Å; N171-M174 PolarHBondContact O-N 2.96Å; N171-M174 PolarHBondContact OD1-N 3.42Å; N171-T175 PolarHBondContact O-N 3.28Å; N171-T175 VanDerWaalsContact O-N 3.09Å; N171-T175 PolarHBondContact O-OG1 3.1Å
172	T	71.8	Confident	80.8	Confident	103 Å²	103	47.3 Å²	47.3	63%	0.632	27%	0.268	S	S	*	.	H	α-helix	trans	-65.9	-23.5	-178.8	57.3	0	0	0	0	113.7	T170 G176	T170-T172 PolarHBondContact O-N 3.4Å; T172-G176 VanDerWaalsContact O-CA 3.3Å; T172-G176 WeakPolarHBondContact O-CA 3.27Å; T172-G176 PolarHBondContact O-N 3.44Å
173	T	73.3	Confident	80.5	Confident	79 Å²	79	47.5 Å²	47.5	49%	0.485	27%	0.271	S	S	.	.	H	α-helix	trans	-77.4	-49.9	174.9	69.4	0	0	0	0	110.8	N171 T175 G176 T177 V178	N171-T173 VanDerWaalsContact C-N 3.26Å; N171-T173 PolarHBondContact O-N 2.99Å; N171-T173 PolarHBondContact OD1-N 3.2Å; N171-T173 PolarHBondContact OD1-OG1 3.16Å; T173-T175 PolarHBondContact O-N 2.63Å; T173-G176 PolarHBondContact O-N 2.71Å; T173-T177 PolarHBondContact O-N 3.04Å; T173-T177 PolarHBondContact O-OG1 3.01Å; T173-V178 PolarHBondContact O-N 3.24Å
174	M	75.1	Confident	80.3	Confident	46 Å²	46	56.7 Å²	56.7	23%	0.227	31%	0.305	C	S	.	.	I	π-helix	trans	-57.2	-50.5	178.1	-172.8	65.3	79.6	0	0	111.3	N171 V178 L179	N171-M174 HydrophobicContact CB-CB 4.06Å; N171-M174 PolarHBondContact O-N 2.96Å; N171-M174 PolarHBondContact OD1-N 3.42Å; M174-V178 WeakPolarHBondContact O-CB 3.43Å; M174-V178 HydrophobicContact SD-CB 4.19Å; M174-V178 HydrophobicContact SD-CG1 4.19Å; M174-V178 HydrophobicContact SD-CG2 4.43Å; M174-L179 WeakPolarHBondContact O-CB 3.38Å; M174-L179 WeakPolarHBondContact O-CG 3.34Å; M174-L179 PolarHBondContact O-N 3.03Å
175	T	71.8	Confident	80	Confident	12 Å²	12	59.8 Å²	59.8	7%	0.074	33%	0.326	C	S	.	.	I	π-helix	trans	-74.4	-34.8	-179.6	55.3	0	0	0	0	113.6	N171 T173 M181	N171-T175 PolarHBondContact O-N 3.28Å; N171-T175 VanDerWaalsContact O-N 3.09Å; N171-T175 PolarHBondContact O-OG1 3.1Å; T173-T175 PolarHBondContact O-N 2.63Å; T175-M181 WeakPolarHBondContact O-CB 3.5Å; T175-M181 PolarHBondContact O-N 2.8Å; T175-M181 VanDerWaalsContact O-N 3.14Å
176	G	69.9	Low	79.8	Confident	22 Å²	22	61.8 Å²	61.8	23%	0.227	34%	0.336	C	S	.	.	I	π-helix	trans	-85	-53.2	-174.7	0	0	0	0	0	114.8	T172 T173 K180	T172-G176 VanDerWaalsContact O-CA 3.3Å; T172-G176 WeakPolarHBondContact O-CA 3.27Å; T172-G176 PolarHBondContact O-N 3.44Å; T173-G176 PolarHBondContact O-N 2.71Å; G176-K180 WeakPolarHBondContact O-CA 3.49Å
177	T	69.5	Low	79.7	Confident	104 Å²	104	63.4 Å²	63.4	64%	0.638	34%	0.342	S	S	*	.	I	π-helix	trans	-97.5	-38.3	-172.5	62.4	0	0	0	0	113	T173	T173-T177 PolarHBondContact O-N 3.04Å; T173-T177 PolarHBondContact O-OG1 3.01Å
178	V	74.4	Confident	79.6	Confident	58 Å²	58	68.2 Å²	68.2	35%	0.352	36%	0.364	S	S	.	.	I	π-helix	trans	-80.5	-56.2	-177.6	-173.2	0	0	0	0	110.7	L157 T173 M174 K180	L157-V178 HydrophobicContact CD1-CG1 3.78Å; L157-V178 HydrophobicContact CD2-CG1 3.73Å; L157-V178 HydrophobicContact CG-CG1 4.43Å; T173-V178 PolarHBondContact O-N 3.24Å; M174-V178 WeakPolarHBondContact O-CB 3.43Å; M174-V178 HydrophobicContact SD-CB 4.19Å; M174-V178 HydrophobicContact SD-CG1 4.19Å; M174-V178 HydrophobicContact SD-CG2 4.43Å; V178-K180 VanDerWaalsContact C-N 3.31Å; V178-K180 PolarHBondContact O-N 2.86Å
179	L	76.9	Confident	79.5	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	38%	0.378	C	S	.	.	S	Bend	trans	-77	-12	177.7	-72.9	172.3	0	0	0	114.4	T153 F154 L157 L159 L167 M174 M181 L190	T153-L179 HydrophobicContact CG2-CD2 4.26Å; F154-L179 HydrophobicContact CD2-CD2 3.87Å; F154-L179 HydrophobicContact CE2-CD2 3.56Å; F154-L179 HydrophobicContact CZ-CD2 4.12Å; L157-L179 HydrophobicContact CD1-CD2 3.86Å; L159-L179 HydrophobicContact CD1-CD2 3.77Å; L167-L179 HydrophobicContact CD2-CD1 3.78Å; M174-L179 WeakPolarHBondContact O-CB 3.38Å; M174-L179 WeakPolarHBondContact O-CG 3.34Å; M174-L179 PolarHBondContact O-N 3.03Å; L179-M181 HydrophobicContact CB-CG 3.93Å; L179-M181 HydrophobicContact CB-SD 4.03Å; L179-M181 HydrophobicContact CD1-SD 4.07Å; L179-M181 PolarHBondContact O-N 3.26Å; L179-M181 VanDerWaalsContact O-N 3.16Å; L179-L190 HydrophobicContact CD1-CD2 4.08Å
180	K	80.4	Confident	79.7	Confident	147 Å²	147	70.3 Å²	70.3	64%	0.639	37%	0.371	S	S	*	.			trans	55.9	26.7	179.8	-57	179.4	-177	176	0	114.4	G176 V178 T182	G176-K180 WeakPolarHBondContact O-CA 3.49Å; V178-K180 VanDerWaalsContact C-N 3.31Å; V178-K180 PolarHBondContact O-N 2.86Å; K180-T182 PolarHBondContact O-N 3.45Å
181	M	81.2	Confident	80.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.352	C	S	.	.			trans	-78.1	93.5	178.4	-58.9	172.8	78.1	0	0	108.5	L147 Y150 T175 L179 H186 R187 L190	L147-M181 HydrophobicContact CD1-CE 3.96Å; Y150-M181 HydrophobicContact CD1-CG 4.14Å; Y150-M181 HydrophobicContact CD2-CE 3.9Å; Y150-M181 HydrophobicContact CD2-CG 4.17Å; Y150-M181 HydrophobicContact CE1-CB 4.44Å; Y150-M181 HydrophobicContact CE1-CG 3.92Å; Y150-M181 HydrophobicContact CE2-CE 3.74Å; Y150-M181 HydrophobicContact CE2-CG 3.95Å; Y150-M181 HydrophobicContact CG-CG 4.28Å; T175-M181 WeakPolarHBondContact O-CB 3.5Å; T175-M181 PolarHBondContact O-N 2.8Å; T175-M181 VanDerWaalsContact O-N 3.14Å; L179-M181 HydrophobicContact CB-CG 3.93Å; L179-M181 HydrophobicContact CB-SD 4.03Å; L179-M181 HydrophobicContact CD1-SD 4.07Å; L179-M181 PolarHBondContact O-N 3.26Å; L179-M181 VanDerWaalsContact O-N 3.16Å; M181-H186 HydrophobicContact CE-CB 3.75Å; M181-H186 VanDerWaalsContact CE-O 3.28Å; M181-H186 WeakPolarHBondContact CE-O 3.41Å; M181-R187 HydrophobicContact CB-CG 3.97Å; M181-R187 PolarHBondContact O-NE 3.44Å; M181-R187 PolarHBondContact O-NH2 3.47Å; M181-L190 HydrophobicContact CE-CB 3.92Å; M181-L190 HydrophobicContact CE-CD2 3.77Å; M181-L190 HydrophobicContact CE-CG 4.47Å; M181-L190 HydrophobicContact SD-CD2 3.52Å; M181-L190 VanDerWaalsContact SD-CD2 3.52Å
182	T	75	Confident	81.1	Confident	123 Å²	123	66.7 Å²	66.7	76%	0.755	35%	0.347	S	S	*	.			trans	-69.6	-35.6	-177.2	46.9	0	0	0	0	113	K180 R187	K180-T182 PolarHBondContact O-N 3.45Å; T182-R187 PolarHBondContact O-NH2 2.93Å
183	D	84.7	Confident	81.9	Confident	63 Å²	63	64.4 Å²	64.4	34%	0.337	33%	0.328	S	S	.	.			trans	-79.4	135.7	179.5	178.6	24	0	0	0	112.7	S185 H186 R187	D183-S185 PolarHBondContact OD1-N 3.04Å; D183-S185 VanDerWaalsContact OD2-CB 3.29Å; D183-S185 WeakPolarHBondContact OD2-CB 3.44Å; D183-S185 PolarHBondContact OD2-OG 3.11Å; D183-H186 IonicContact OD2-CD2 3.04Å; D183-H186 IonicContact OD2-CE1 2.74Å; D183-H186 IonicContact OD2-CG 2.66Å; D183-H186 IonicContact OD2-ND1 3.53Å; D183-H186 IonicContact OD2-NE2 3.67Å; D183-R187 WeakPolarHBondContact O-CG 3.32Å; D183-R187 PolarHBondContact O-N 3.38Å
184	R	85.9	Confident	82.8	Confident	196 Å²	196	60.6 Å²	60.6	74%	0.74	31%	0.305	S	S	*	.	H	α-helix	trans	-65.3	-35.8	173.8	-176	177.3	178.8	172.4	0.7	112	R187 Q188	R184-R187 PolarHBondContact O-N 3.2Å; R184-Q188 PolarHBondContact O-N 2.97Å
185	S	87	Confident	83.6	Confident	65 Å²	65	58.6 Å²	58.6	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-45	-177.2	92.5	0	0	0	0	111.4	D183 R187 Q188 K189	D183-S185 PolarHBondContact OD1-N 3.04Å; D183-S185 VanDerWaalsContact OD2-CB 3.29Å; D183-S185 WeakPolarHBondContact OD2-CB 3.44Å; D183-S185 PolarHBondContact OD2-OG 3.11Å; S185-R187 PolarHBondContact O-N 2.92Å; S185-Q188 PolarHBondContact O-N 3.44Å; S185-K189 WeakPolarHBondContact O-CB 3.34Å; S185-K189 PolarHBondContact O-N 3.31Å
186	H	88.4	Confident	84.5	Confident	43 Å²	43	58.2 Å²	58.2	20%	0.199	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-36.5	177.1	-58.1	150.9	0	0	0	112.7	L147 Q149 Y150 M181 D183 L190	L147-H186 HydrophobicContact CD1-CB 4.05Å; L147-H186 HydrophobicContact CD2-CB 4.18Å; L147-H186 VanDerWaalsContact CD2-CD2 3.44Å; L147-H186 WeakPolarHBondContact CD2-CD2 3.41Å; Q149-H186 PolarHBondContact NE2-CE1 2.84Å; Q149-H186 PolarHBondContact NE2-ND1 3.28Å; Q149-H186 PolarHBondContact NE2-NE2 3.39Å; Y150-H186 HydrophobicContact CE2-CB 3.92Å; Y150-H186 AromaticContact CE2-ND1 3.84Å; Y150-H186 AromaticContact CZ-ND1 3.87Å; Y150-H186 PolarHBondContact OH-ND1 3.12Å; M181-H186 HydrophobicContact CE-CB 3.75Å; M181-H186 VanDerWaalsContact CE-O 3.28Å; M181-H186 WeakPolarHBondContact CE-O 3.41Å; D183-H186 IonicContact OD2-CD2 3.04Å; D183-H186 IonicContact OD2-CE1 2.74Å; D183-H186 IonicContact OD2-CG 2.66Å; D183-H186 IonicContact OD2-ND1 3.53Å; D183-H186 IonicContact OD2-NE2 3.67Å; H186-L190 VanDerWaalsContact O-CB 3.31Å; H186-L190 WeakPolarHBondContact O-CB 3.47Å; H186-L190 PolarHBondContact O-N 3.43Å
187	R	88.4	Confident	85.5	Confident	74 Å²	74	57.2 Å²	57.2	28%	0.279	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-51.3	174.8	-66.1	-177.4	-161.6	159.4	10.7	111.2	M181 T182 D183 R184 S185 K189 L190 Q191	M181-R187 HydrophobicContact CB-CG 3.97Å; M181-R187 PolarHBondContact O-NE 3.44Å; M181-R187 PolarHBondContact O-NH2 3.47Å; T182-R187 PolarHBondContact O-NH2 2.93Å; D183-R187 WeakPolarHBondContact O-CG 3.32Å; D183-R187 PolarHBondContact O-N 3.38Å; R184-R187 PolarHBondContact O-N 3.2Å; S185-R187 PolarHBondContact O-N 2.92Å; R187-K189 VanDerWaalsContact C-N 3.33Å; R187-K189 PolarHBondContact O-N 3.09Å; R187-L190 PolarHBondContact O-N 3.05Å; R187-Q191 VanDerWaalsContact O-CB 3.29Å; R187-Q191 WeakPolarHBondContact O-CB 3.49Å; R187-Q191 PolarHBondContact O-N 3.45Å
188	Q	87.8	Confident	86.5	Confident	104 Å²	104	52.6 Å²	52.6	49%	0.486	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-40.9	-179.7	-173	173.7	-1.9	0	0	111.3	R184 S185 Q191 L192	R184-Q188 PolarHBondContact O-N 2.97Å; S185-Q188 PolarHBondContact O-N 3.44Å; Q188-Q191 PolarHBondContact O-N 3.48Å; Q188-L192 HydrophobicContact CG-CD1 3.93Å; Q188-L192 HydrophobicContact CG-CG 4.39Å; Q188-L192 WeakPolarHBondContact O-CB 3.27Å; Q188-L192 WeakPolarHBondContact O-CG 3.4Å; Q188-L192 PolarHBondContact O-N 2.9Å
189	K	89.6	Confident	87.3	Confident	68 Å²	68	50.6 Å²	50.6	30%	0.296	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-44.2	176.1	-164.5	-175.2	-171.7	-164.2	0	112.5	V145 E146 S185 R187 K193	V145-K189 HydrophobicContact CG1-CG 4.4Å; V145-K189 WeakPolarHBondContact O-CD 3.5Å; V145-K189 WeakPolarHBondContact O-CE 3.48Å; V145-K189 PolarHBondContact O-NZ 2.81Å; E146-K189 IonicContact OE2-NZ 2.81Å; E146-K189 PolarHBondContact OE2-NZ 3.32Å; S185-K189 WeakPolarHBondContact O-CB 3.34Å; S185-K189 PolarHBondContact O-N 3.31Å; R187-K189 VanDerWaalsContact C-N 3.33Å; R187-K189 PolarHBondContact O-N 3.09Å; K189-K193 VanDerWaalsContact O-CB 3.27Å; K189-K193 WeakPolarHBondContact O-CB 3.42Å; K189-K193 WeakPolarHBondContact O-CG 3.18Å; K189-K193 PolarHBondContact O-N 3.08Å; K189-K193 VanDerWaalsContact O-N 3.17Å
190	L	91	Very high	87.8	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-45.6	174.8	176.2	67	0	0	0	111.1	W140 L141 V145 L147 F154 L179 M181 H186 R187 K193 A194	W140-L190 HydrophobicContact CH2-CD1 3.65Å; W140-L190 HydrophobicContact CZ3-CD1 3.68Å; L141-L190 HydrophobicContact CD1-CD1 3.95Å; V145-L190 HydrophobicContact CG1-CB 4.31Å; V145-L190 HydrophobicContact CG1-CD1 4.19Å; V145-L190 HydrophobicContact CG2-CD1 4.41Å; L147-L190 HydrophobicContact CD1-CB 4.3Å; F154-L190 HydrophobicContact CZ-CD1 4Å; F154-L190 HydrophobicContact CZ-CD2 3.96Å; L179-L190 HydrophobicContact CD1-CD2 4.08Å; M181-L190 HydrophobicContact CE-CB 3.92Å; M181-L190 HydrophobicContact CE-CD2 3.77Å; M181-L190 HydrophobicContact CE-CG 4.47Å; M181-L190 HydrophobicContact SD-CD2 3.52Å; M181-L190 VanDerWaalsContact SD-CD2 3.52Å; H186-L190 VanDerWaalsContact O-CB 3.31Å; H186-L190 WeakPolarHBondContact O-CB 3.47Å; H186-L190 PolarHBondContact O-N 3.43Å; R187-L190 PolarHBondContact O-N 3.05Å; L190-K193 PolarHBondContact O-N 3.18Å; L190-A194 VanDerWaalsContact O-CB 3.26Å; L190-A194 WeakPolarHBondContact O-CB 3.34Å; L190-A194 PolarHBondContact O-N 2.92Å
191	Q	90.7	Very high	88	Confident	39 Å²	39	45.3 Å²	45.3	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-54.3	-177.4	-170.3	-156.9	-23.6	0	0	111.8	L167 A168 R187 Q188 K193 A194 L195	L167-Q191 WeakPolarHBondContact O-CA 3.09Å; A168-Q191 WeakPolarHBondContact O-CG 3.39Å; A168-Q191 PolarHBondContact O-NE2 2.79Å; A168-Q191 VanDerWaalsContact O-NE2 3.09Å; R187-Q191 VanDerWaalsContact O-CB 3.29Å; R187-Q191 WeakPolarHBondContact O-CB 3.49Å; R187-Q191 PolarHBondContact O-N 3.45Å; Q188-Q191 PolarHBondContact O-N 3.48Å; Q191-K193 PolarHBondContact O-N 3.08Å; Q191-A194 PolarHBondContact O-N 3.3Å; Q191-A194 VanDerWaalsContact O-N 3.14Å; Q191-L195 VanDerWaalsContact O-CB 3.31Å; Q191-L195 WeakPolarHBondContact O-CB 3.29Å; Q191-L195 PolarHBondContact O-N 3.01Å
192	L	89.6	Confident	88.1	Confident	53 Å²	53	47.1 Å²	47.1	28%	0.277	23%	0.233	S	C	.	.	H	α-helix	trans	-60.7	-36	179.6	-67.9	171.7	0	0	0	111.7	D95 L96 Q188 D196	D95-L192 WeakPolarHBondContact O-CD2 3.38Å; L96-L192 HydrophobicContact CD2-CD2 4.15Å; Q188-L192 HydrophobicContact CG-CD1 3.93Å; Q188-L192 HydrophobicContact CG-CG 4.39Å; Q188-L192 WeakPolarHBondContact O-CB 3.27Å; Q188-L192 WeakPolarHBondContact O-CG 3.4Å; Q188-L192 PolarHBondContact O-N 2.9Å; L192-D196 WeakPolarHBondContact O-CB 3.36Å; L192-D196 PolarHBondContact O-N 3.49Å
193	K	90.4	Very high	88	Confident	54 Å²	54	42.1 Å²	42.1	24%	0.235	20%	0.202	C	C	.	.	H	α-helix	trans	-72	-38.8	175.4	-71.1	-77.5	165.2	-176.1	0	112.5	W140 Y144 V145 K189 L190 Q191 T197	W140-K193 HydrophobicContact CZ2-CB 4.03Å; Y144-K193 HydrophobicContact CD1-CD 3.63Å; Y144-K193 HydrophobicContact CE1-CD 3.27Å; Y144-K193 HydrophobicContact CE1-CG 4.48Å; Y144-K193 HydrophobicContact CE2-CD 4.38Å; Y144-K193 HydrophobicContact CG-CD 4.34Å; Y144-K193 PolarHBondContact OH-NZ 3.16Å; V145-K193 HydrophobicContact CG1-CB 4.27Å; V145-K193 HydrophobicContact CG1-CG 4.32Å; V145-K193 HydrophobicContact CG2-CB 3.97Å; V145-K193 HydrophobicContact CG2-CG 4.48Å; K189-K193 VanDerWaalsContact O-CB 3.27Å; K189-K193 WeakPolarHBondContact O-CB 3.42Å; K189-K193 WeakPolarHBondContact O-CG 3.18Å; K189-K193 PolarHBondContact O-N 3.08Å; K189-K193 VanDerWaalsContact O-N 3.17Å; L190-K193 PolarHBondContact O-N 3.18Å; Q191-K193 PolarHBondContact O-N 3.08Å; K193-T197 WeakPolarHBondContact O-CB 3.19Å; K193-T197 PolarHBondContact O-N 3.31Å; K193-T197 PolarHBondContact O-OG1 2.69Å
194	A	91.9	Very high	86.8	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-43.2	175.2	0	0	0	0	0	110.7	W140 L167 A168 L190 Q191 T197 V198	W140-A194 HydrophobicContact CH2-CB 4Å; W140-A194 HydrophobicContact CZ2-CB 4.33Å; L167-A194 HydrophobicContact CB-CB 3.84Å; A168-A194 HydrophobicContact CB-CB 3.95Å; L190-A194 VanDerWaalsContact O-CB 3.26Å; L190-A194 WeakPolarHBondContact O-CB 3.34Å; L190-A194 PolarHBondContact O-N 2.92Å; Q191-A194 PolarHBondContact O-N 3.3Å; Q191-A194 VanDerWaalsContact O-N 3.14Å; A194-T197 CarbonylContact O-C 3.53Å; A194-T197 PolarHBondContact O-N 2.98Å; A194-T197 VanDerWaalsContact O-N 3.15Å; A194-V198 WeakPolarHBondContact O-CB 3.42Å; A194-V198 VanDerWaalsContact O-CG2 3.3Å; A194-V198 WeakPolarHBondContact O-CG2 3.41Å; A194-V198 PolarHBondContact O-N 2.95Å
195	L	91.5	Very high	85.2	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-58	-53.9	175.3	178.7	62.1	0	0	0	111.6	I71 F91 L96 A168 Q191 T197 V198 L199	I71-L195 HydrophobicContact CD1-CD1 4.44Å; I71-L195 HydrophobicContact CG1-CD1 4.2Å; I71-L195 HydrophobicContact CG2-CD1 3.57Å; F91-L195 HydrophobicContact CE1-CD2 4.14Å; F91-L195 HydrophobicContact CZ-CD1 4.46Å; F91-L195 HydrophobicContact CZ-CD2 3.78Å; L96-L195 HydrophobicContact CD1-CD2 4.26Å; L96-L195 HydrophobicContact CD1-CG 4.38Å; L96-L195 HydrophobicContact CD2-CD2 3.78Å; L96-L195 HydrophobicContact CD2-CG 4.13Å; L96-L195 HydrophobicContact CG-CD2 4.03Å; A168-L195 HydrophobicContact CB-CB 4Å; Q191-L195 VanDerWaalsContact O-CB 3.31Å; Q191-L195 WeakPolarHBondContact O-CB 3.29Å; Q191-L195 PolarHBondContact O-N 3.01Å; L195-T197 PolarHBondContact O-N 2.96Å; L195-V198 PolarHBondContact O-N 3.37Å; L195-V198 VanDerWaalsContact O-N 3.13Å; L195-L199 HydrophobicContact CD1-CD1 3.71Å; L195-L199 HydrophobicContact CD1-CG 4.07Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 WeakPolarHBondContact O-CB 3.08Å; L195-L199 WeakPolarHBondContact O-CG 3.32Å; L195-L199 PolarHBondContact O-N 2.66Å
196	D	89.5	Confident	83.3	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-54.3	-38.2	172.5	168.2	49.4	0	0	0	112.7	Y98 K104 Y144 L192 F200	Y98-D196 VanDerWaalsContact OH-CG 3.24Å; Y98-D196 PolarHBondContact OH-OD1 3.17Å; Y98-D196 VanDerWaalsContact OH-OD1 3.04Å; Y98-D196 PolarHBondContact OH-OD2 3.45Å; K104-D196 IonicContact NZ-OD1 3.56Å; K104-D196 PolarHBondContact NZ-OD1 3.01Å; Y144-D196 VanDerWaalsContact CE1-OD2 3.3Å; Y144-D196 WeakPolarHBondContact CE1-OD2 3.5Å; Y144-D196 VanDerWaalsContact CZ-OD2 3.29Å; Y144-D196 PolarHBondContact OH-OD2 3.06Å; L192-D196 WeakPolarHBondContact O-CB 3.36Å; L192-D196 PolarHBondContact O-N 3.49Å; D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 VanDerWaalsContact O-CD2 3.3Å; D196-F200 WeakPolarHBondContact O-CD2 3.45Å; D196-F200 PolarHBondContact O-N 2.88Å; D196-F200 WeakPolarHBondContact OD1-CD2 3.37Å
197	T	91.1	Very high	81.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-76.6	-28.9	-179.9	-51.6	0	0	0	0	112.8	V129 W132 W140 M164 K193 A194 L195 G201	V129-T197 HydrophobicContact CG1-CG2 3.78Å; V129-T197 HydrophobicContact CG2-CG2 3.85Å; W132-T197 HydrophobicContact CH2-CG2 3.5Å; W132-T197 HydrophobicContact CZ2-CG2 4.43Å; W132-T197 HydrophobicContact CZ3-CG2 3.79Å; W140-T197 PolarHBondContact NE1-OG1 2.59Å; M164-T197 HydrophobicContact CE-CG2 3.61Å; K193-T197 WeakPolarHBondContact O-CB 3.19Å; K193-T197 PolarHBondContact O-N 3.31Å; K193-T197 PolarHBondContact O-OG1 2.69Å; A194-T197 CarbonylContact O-C 3.53Å; A194-T197 PolarHBondContact O-N 2.98Å; A194-T197 VanDerWaalsContact O-N 3.15Å; L195-T197 PolarHBondContact O-N 2.96Å; T197-G201 WeakPolarHBondContact CA-O 3.4Å; T197-G201 CarbonylContact O-C 3.58Å; T197-G201 WeakPolarHBondContact O-CA 3.33Å; T197-G201 PolarHBondContact O-N 3.4Å; T197-G201 VanDerWaalsContact O-N 3.17Å
198	V	91.8	Very high	79.3	Confident	7 Å²	7	56.4 Å²	56.4	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-77.4	-41.6	175.7	167.7	0	0	0	0	111.3	I71 W124 M164 P165 A194 L195	I71-V198 HydrophobicContact CD1-CG1 4.05Å; W124-V198 HydrophobicContact CD2-CG1 4.27Å; W124-V198 HydrophobicContact CE3-CB 4.15Å; W124-V198 HydrophobicContact CE3-CG1 3.84Å; W124-V198 HydrophobicContact CE3-CG2 4.08Å; W124-V198 HydrophobicContact CH2-CG2 4.38Å; W124-V198 HydrophobicContact CZ3-CB 4.28Å; W124-V198 HydrophobicContact CZ3-CG1 4.43Å; W124-V198 HydrophobicContact CZ3-CG2 3.84Å; M164-V198 HydrophobicContact CB-CG2 3.84Å; P165-V198 HydrophobicContact CG-CG1 4.27Å; P165-V198 HydrophobicContact CG-CG2 4.08Å; A194-V198 WeakPolarHBondContact O-CB 3.42Å; A194-V198 VanDerWaalsContact O-CG2 3.3Å; A194-V198 WeakPolarHBondContact O-CG2 3.41Å; A194-V198 PolarHBondContact O-N 2.95Å; L195-V198 PolarHBondContact O-N 3.37Å; L195-V198 VanDerWaalsContact O-N 3.13Å
199	L	89.9	Confident	77.8	Confident	17 Å²	17	55.5 Å²	55.5	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-76.2	-31.5	-178.6	-65	176.5	0	0	0	113.4	I71 M75 F91 L96 F108 L120 L195	I71-L199 HydrophobicContact CG2-CD2 3.89Å; M75-L199 HydrophobicContact SD-CD1 4.12Å; M75-L199 HydrophobicContact SD-CD2 3.95Å; F91-L199 HydrophobicContact CE1-CD1 4.1Å; L96-L199 HydrophobicContact CD1-CD1 4.12Å; F108-L199 HydrophobicContact CE2-CD2 3.78Å; F108-L199 HydrophobicContact CZ-CD2 4.44Å; L120-L199 HydrophobicContact CD1-CD2 3.98Å; L195-L199 HydrophobicContact CD1-CD1 3.71Å; L195-L199 HydrophobicContact CD1-CG 4.07Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 WeakPolarHBondContact O-CB 3.08Å; L195-L199 WeakPolarHBondContact O-CG 3.32Å; L195-L199 PolarHBondContact O-N 2.66Å
200	F	88.6	Confident	76.4	Confident	25 Å²	25	59 Å²	59	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-126.9	10.4	-170.1	-53	-71.2	0	0	0	114.8	L92 L96 K104 F108 D196	L92-F200 HydrophobicContact CD1-CZ 4.09Å; L92-F200 HydrophobicContact CD2-CE2 3.77Å; L92-F200 HydrophobicContact CD2-CZ 3.53Å; L92-F200 HydrophobicContact CG-CZ 4.32Å; L96-F200 HydrophobicContact CD1-CE2 4.5Å; K104-F200 HydrophobicContact CB-CD1 4.21Å; K104-F200 HydrophobicContact CB-CE1 3.78Å; K104-F200 HydrophobicContact CB-CZ 4.05Å; K104-F200 HydrophobicContact CD-CB 3.93Å; K104-F200 HydrophobicContact CD-CD1 3.47Å; K104-F200 VanDerWaalsContact CD-CD1 3.47Å; K104-F200 HydrophobicContact CD-CD2 3.53Å; K104-F200 HydrophobicContact CD-CE1 3.81Å; K104-F200 HydrophobicContact CD-CE2 3.89Å; K104-F200 HydrophobicContact CD-CG 3.33Å; K104-F200 HydrophobicContact CD-CZ 4.04Å; K104-F200 HydrophobicContact CG-CD1 4.49Å; K104-F200 HydrophobicContact CG-CE1 4.46Å; K104-F200 VanDerWaalsContact O-CE1 3.27Å; K104-F200 WeakPolarHBondContact O-CE1 3.33Å; F108-F200 HydrophobicContact CB-CE1 4.04Å; D196-F200 WeakPolarHBondContact O-CB 3.48Å; D196-F200 VanDerWaalsContact O-CD2 3.3Å; D196-F200 WeakPolarHBondContact O-CD2 3.45Å; D196-F200 PolarHBondContact O-N 2.88Å; D196-F200 WeakPolarHBondContact OD1-CD2 3.37Å
201	G	84.9	Confident	75.5	Confident	11 Å²	11	65.6 Å²	65.6	11%	0.113	33%	0.326	C	S	.	.			trans	73	-158.6	179.8	0	0	0	0	0	113.7	T197	T197-G201 WeakPolarHBondContact CA-O 3.4Å; T197-G201 CarbonylContact O-C 3.58Å; T197-G201 WeakPolarHBondContact O-CA 3.33Å; T197-G201 PolarHBondContact O-N 3.4Å; T197-G201 VanDerWaalsContact O-N 3.17Å
202	P	83.1	Confident	74.4	Confident	38 Å²	38	70.7 Å²	70.7	25%	0.247	35%	0.348	C	S	.	.	S	Bend	trans	-56	138.7	-178	-27.1	37.4	0	0	0	111.8	E128 V129 W132 L204	E128-P202 HydrophobicContact CB-CG 3.73Å; E128-P202 HydrophobicContact CG-CG 4.47Å; V129-P202 HydrophobicContact CG2-CG 3.92Å; V129-P202 VanDerWaalsContact CG2-N 3.33Å; W132-P202 HydrophobicContact CZ2-CB 3.84Å; W132-P202 HydrophobicContact CZ2-CG 4.02Å; P202-L204 PolarHBondContact O-N 2.84Å
203	P	71.8	Confident	73.6	Confident	18 Å²	18	71.6 Å²	71.6	12%	0.117	35%	0.352	C	S	.	.			trans	-59	131.6	168.3	27.5	-34.2	0	0	0	108.7	Y144 L205	Y144-P203 HydrophobicContact CD1-CB 3.62Å; Y144-P203 HydrophobicContact CD1-CG 3.7Å; Y144-P203 HydrophobicContact CD2-CB 3.53Å; Y144-P203 HydrophobicContact CD2-CG 4.07Å; Y144-P203 HydrophobicContact CE1-CB 3.62Å; Y144-P203 HydrophobicContact CE1-CG 4.17Å; Y144-P203 HydrophobicContact CE2-CB 3.57Å; Y144-P203 HydrophobicContact CG-CB 3.58Å; Y144-P203 HydrophobicContact CG-CG 3.64Å; P203-L205 HydrophobicContact CG-CG 4.4Å; P203-L205 PolarHBondContact O-N 2.87Å
204	L	59.4	Low	73.1	Confident	166 Å²	166	75.4 Å²	75.4	87%	0.869	37%	0.369	S	S	*	.			trans	-71.5	62.4	171.2	-63.7	-179.9	0	0	0	110.3	P202 T206	P202-L204 PolarHBondContact O-N 2.84Å; L204-T206 PolarHBondContact O-N 3.2Å
205	L	52.9	Low	72.5	Confident	94 Å²	94	81.1 Å²	81.1	49%	0.492	40%	0.397	S	S	.	.			trans	-47	113	159.6	-77.9	168.7	0	0	0	106.3	P203 R207	P203-L205 HydrophobicContact CG-CG 4.4Å; P203-L205 PolarHBondContact O-N 2.87Å; L205-R207 PolarHBondContact O-N 2.75Å
206	T	46.2	Very low	72.1	Confident	107 Å²	107	85.6 Å²	85.6	66%	0.656	42%	0.421	S	S	*	.			trans	-70.1	82.2	-175.8	54.5	0	0	0	0	109.2	L204 H208	L204-T206 PolarHBondContact O-N 3.2Å; T206-H208 VanDerWaalsContact O-CA 3.32Å; T206-H208 WeakPolarHBondContact O-CA 3.25Å; T206-H208 PolarHBondContact O-N 2.68Å
207	R	46.5	Very low	71.9	Confident	235 Å²	235	89.5 Å²	89.5	89%	0.887	45%	0.445	S	S	*	.			trans	-43.4	110.2	174.5	-177.9	179	-177.5	175.5	2.3	107.2	L205 N209	L205-R207 PolarHBondContact O-N 2.75Å; R207-N209 PolarHBondContact O-N 3.02Å; R207-N209 VanDerWaalsContact O-N 3.12Å
208	H	46.9	Very low	71.8	Confident	139 Å²	139	91.9 Å²	91.9	64%	0.644	46%	0.459	S	S	*	.			trans	-46	119.8	-150.9	-98.3	-89.8	0	0	0	111.9	T206 H210	T206-H208 VanDerWaalsContact O-CA 3.32Å; T206-H208 WeakPolarHBondContact O-CA 3.25Å; T206-H208 PolarHBondContact O-N 2.68Å; H208-H210 PolarHBondContact O-CD2 2.92Å; H208-H210 PolarHBondContact O-N 2.79Å
209	N	56	Low	71.6	Confident	85 Å²	85	94.6 Å²	94.6	46%	0.455	48%	0.479	S	S	.	.			trans	-75.4	66.6	-175.5	-80	-73.3	0	0	0	109.8	R207 L211 K212 D213	R207-N209 PolarHBondContact O-N 3.02Å; R207-N209 VanDerWaalsContact O-N 3.12Å; N209-L211 PolarHBondContact O-N 3.12Å; N209-K212 HydrophobicContact CB-CB 3.67Å; N209-K212 HydrophobicContact CB-CD 4.44Å; N209-K212 WeakPolarHBondContact O-CA 3.39Å; N209-K212 WeakPolarHBondContact O-CB 3.18Å; N209-K212 PolarHBondContact O-N 2.74Å; N209-D213 PolarHBondContact O-N 3.19Å
210	H	61.5	Low	71.7	Confident	142 Å²	142	98.3 Å²	98.3	66%	0.657	50%	0.497	S	S	*	.	H	α-helix	trans	-53	-28.7	177.3	-68.4	-72.6	0	0	0	111.9	H208 F214	H208-H210 PolarHBondContact O-CD2 2.92Å; H208-H210 PolarHBondContact O-N 2.79Å; H210-F214 WeakPolarHBondContact O-CB 3.35Å; H210-F214 PolarHBondContact O-N 2.71Å
211	L	71.3	Confident	71.9	Confident	139 Å²	139	101.7 Å²	101.7	73%	0.728	52%	0.52	S	S	*	.	H	α-helix	trans	-66.5	-42.8	171.6	-162.3	75.6	0	0	0	112.8	N209 M215	N209-L211 PolarHBondContact O-N 3.12Å; L211-M215 VanDerWaalsContact O-CB 3.32Å; L211-M215 WeakPolarHBondContact O-CB 3.39Å; L211-M215 WeakPolarHBondContact O-CG 3.02Å; L211-M215 PolarHBondContact O-N 3.48Å
212	K	66.7	Low	72.3	Confident	147 Å²	147	106.8 Å²	106.8	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-67.5	-43.5	175.4	-175.9	-178.3	178.2	179.6	0	111	N209 M215 L216	N209-K212 HydrophobicContact CB-CB 3.67Å; N209-K212 HydrophobicContact CB-CD 4.44Å; N209-K212 WeakPolarHBondContact O-CA 3.39Å; N209-K212 WeakPolarHBondContact O-CB 3.18Å; N209-K212 PolarHBondContact O-N 2.74Å; K212-M215 PolarHBondContact O-N 2.87Å; K212-L216 WeakPolarHBondContact O-CB 3.35Å; K212-L216 PolarHBondContact O-N 3.48Å
213	D	73.6	Confident	72.8	Confident	71 Å²	71	106.8 Å²	106.8	38%	0.38	55%	0.551	S	S	.	*	H	α-helix	trans	-70.3	-36.9	-179.8	-60.5	-25.9	0	0	0	111.2	N209 L216 V217	N209-D213 PolarHBondContact O-N 3.19Å; D213-L216 WeakPolarHBondContact O-CB 3.34Å; D213-L216 PolarHBondContact O-N 3.2Å; D213-V217 WeakPolarHBondContact O-CG2 3.32Å; D213-V217 PolarHBondContact O-N 3.4Å
214	F	79.6	Confident	73.8	Confident	134 Å²	134	110.6 Å²	110.6	59%	0.588	57%	0.573	S	S	*	*	H	α-helix	trans	-64.6	-46.5	170.7	-178.8	-99.1	0	0	0	111.7	H210 L216 V217 V218	H210-F214 WeakPolarHBondContact O-CB 3.35Å; H210-F214 PolarHBondContact O-N 2.71Å; F214-L216 VanDerWaalsContact C-N 3.3Å; F214-L216 PolarHBondContact O-N 2.87Å; F214-V217 PolarHBondContact O-N 3.49Å; F214-V218 HydrophobicContact CD1-CG2 4.11Å; F214-V218 HydrophobicContact CE1-CG2 3.79Å; F214-V218 HydrophobicContact CE2-CG2 4.37Å; F214-V218 HydrophobicContact CZ-CG2 3.94Å; F214-V218 WeakPolarHBondContact O-CB 3.37Å; F214-V218 WeakPolarHBondContact O-CG2 3.32Å; F214-V218 PolarHBondContact O-N 3.41Å
215	M	79.3	Confident	75.4	Confident	120 Å²	120	104.5 Å²	104.5	59%	0.591	55%	0.55	S	S	*	*	H	α-helix	trans	-61.8	-36.6	174.9	-75.5	-66.4	-70.7	0	0	112.3	L211 K212 S219	L211-M215 VanDerWaalsContact O-CB 3.32Å; L211-M215 WeakPolarHBondContact O-CB 3.39Å; L211-M215 WeakPolarHBondContact O-CG 3.02Å; L211-M215 PolarHBondContact O-N 3.48Å; K212-M215 PolarHBondContact O-N 2.87Å; M215-S219 WeakPolarHBondContact O-CB 3.33Å; M215-S219 PolarHBondContact O-N 2.83Å; M215-S219 PolarHBondContact O-OG 2.82Å
216	L	82.8	Confident	77.3	Confident	99 Å²	99	102 Å²	102	52%	0.518	55%	0.547	S	S	.	.	H	α-helix	trans	-60.7	-51.7	172	-172.7	77.1	0	0	0	110.6	K212 D213 F214 V218 S219 I220	K212-L216 WeakPolarHBondContact O-CB 3.35Å; K212-L216 PolarHBondContact O-N 3.48Å; D213-L216 WeakPolarHBondContact O-CB 3.34Å; D213-L216 PolarHBondContact O-N 3.2Å; F214-L216 VanDerWaalsContact C-N 3.3Å; F214-L216 PolarHBondContact O-N 2.87Å; L216-V218 PolarHBondContact O-N 2.84Å; L216-S219 PolarHBondContact O-N 3.24Å; L216-S219 PolarHBondContact O-OG 3.41Å; L216-I220 HydrophobicContact CG-CD1 4.08Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 2.91Å
217	V	86.7	Confident	79.3	Confident	86 Å²	86	101.4 Å²	101.4	52%	0.521	55%	0.546	S	S	.	.	H	α-helix	trans	-60.1	-44.5	178	170	0	0	0	0	111.6	D213 F214 S219 I220 V221	D213-V217 WeakPolarHBondContact O-CG2 3.32Å; D213-V217 PolarHBondContact O-N 3.4Å; F214-V217 PolarHBondContact O-N 3.49Å; V217-S219 PolarHBondContact O-N 2.97Å; V217-I220 PolarHBondContact O-N 3.28Å; V217-V221 WeakPolarHBondContact O-CG2 3.45Å; V217-V221 PolarHBondContact O-N 3.42Å
218	V	87.9	Confident	81.4	Confident	50 Å²	50	98.6 Å²	98.6	30%	0.303	54%	0.536	S	S	.	.	H	α-helix	trans	-61.1	-43.1	175.6	169.8	0	0	0	0	111.1	F214 L216 I220 V221 I222	F214-V218 HydrophobicContact CD1-CG2 4.11Å; F214-V218 HydrophobicContact CE1-CG2 3.79Å; F214-V218 HydrophobicContact CE2-CG2 4.37Å; F214-V218 HydrophobicContact CZ-CG2 3.94Å; F214-V218 WeakPolarHBondContact O-CB 3.37Å; F214-V218 WeakPolarHBondContact O-CG2 3.32Å; F214-V218 PolarHBondContact O-N 3.41Å; L216-V218 PolarHBondContact O-N 2.84Å; V218-I220 VanDerWaalsContact C-N 3.33Å; V218-I220 PolarHBondContact O-N 3.38Å; V218-V221 PolarHBondContact O-N 2.93Å; V218-I222 HydrophobicContact CG1-CD1 3.75Å; V218-I222 HydrophobicContact CG1-CG1 4.45Å; V218-I222 VanDerWaalsContact O-CG1 3.32Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.45Å
219	S	87.4	Confident	83.5	Confident	64 Å²	64	98.1 Å²	98.1	45%	0.448	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-37.7	176.3	78.6	0	0	0	0	112.7	M215 L216 V217 I222 G223	M215-S219 WeakPolarHBondContact O-CB 3.33Å; M215-S219 PolarHBondContact O-N 2.83Å; M215-S219 PolarHBondContact O-OG 2.82Å; L216-S219 PolarHBondContact O-N 3.24Å; L216-S219 PolarHBondContact O-OG 3.41Å; V217-S219 PolarHBondContact O-N 2.97Å; S219-I222 PolarHBondContact O-N 2.96Å; S219-G223 PolarHBondContact O-N 3.34Å
220	I	91.9	Very high	85.1	Confident	94 Å²	94	96.6 Å²	96.6	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-68.1	-43	176.1	-68.4	164.6	0	0	0	110.5	L216 V217 V218 G223 V224	L216-I220 HydrophobicContact CG-CD1 4.08Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 2.91Å; V217-I220 PolarHBondContact O-N 3.28Å; V218-I220 VanDerWaalsContact C-N 3.33Å; V218-I220 PolarHBondContact O-N 3.38Å; I220-G223 PolarHBondContact O-N 3.45Å; I220-V224 HydrophobicContact CG2-CG2 4.34Å; I220-V224 WeakPolarHBondContact O-CB 3.31Å; I220-V224 VanDerWaalsContact O-CG2 3.31Å; I220-V224 WeakPolarHBondContact O-CG2 3.4Å; I220-V224 PolarHBondContact O-N 2.97Å
221	V	93.9	Very high	86.4	Confident	97 Å²	97	96.6 Å²	96.6	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-62.8	-42.6	176.1	170.6	0	0	0	0	111.2	V217 V218 G225	V217-V221 WeakPolarHBondContact O-CG2 3.45Å; V217-V221 PolarHBondContact O-N 3.42Å; V218-V221 PolarHBondContact O-N 2.93Å; V221-G225 PolarHBondContact O-N 2.83Å
222	I	92.9	Very high	87	Confident	117 Å²	117	92.6 Å²	92.6	60%	0.6	51%	0.505	S	S	*	.	H	α-helix	trans	-65.4	-44	175.4	-67.9	167.7	0	0	0	110.9	V218 S219 G225 G226	V218-I222 HydrophobicContact CG1-CD1 3.75Å; V218-I222 HydrophobicContact CG1-CG1 4.45Å; V218-I222 VanDerWaalsContact O-CG1 3.32Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.45Å; S219-I222 PolarHBondContact O-N 2.96Å; I222-G225 PolarHBondContact O-N 3.21Å; I222-G226 PolarHBondContact O-N 3.34Å
223	G	93.1	Very high	87.5	Confident	39 Å²	39	91.1 Å²	91.1	40%	0.402	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-45.7	177.8	0	0	0	0	0	113.1	S219 I220 C227	S219-G223 PolarHBondContact O-N 3.34Å; I220-G223 PolarHBondContact O-N 3.45Å; G223-C227 WeakPolarHBondContact O-CB 3.47Å; G223-C227 PolarHBondContact O-N 3.39Å; G223-C227 PolarHBondContact O-SG 3.36Å; G223-C227 VanDerWaalsContact O-SG 3.34Å
224	V	94.2	Very high	87.9	Confident	97 Å²	97	91.1 Å²	91.1	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-66.9	-42	175.8	172.8	0	0	0	0	111	I220 C227 W228	I220-V224 HydrophobicContact CG2-CG2 4.34Å; I220-V224 WeakPolarHBondContact O-CB 3.31Å; I220-V224 VanDerWaalsContact O-CG2 3.31Å; I220-V224 WeakPolarHBondContact O-CG2 3.4Å; I220-V224 PolarHBondContact O-N 2.97Å; V224-C227 PolarHBondContact O-N 2.87Å; V224-W228 VanDerWaalsContact O-CB 3.26Å; V224-W228 WeakPolarHBondContact O-CB 3.46Å; V224-W228 PolarHBondContact O-N 3.44Å
225	G	92.9	Very high	88.1	Confident	38 Å²	38	91.8 Å²	91.8	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-43.8	176.2	0	0	0	0	0	112.8	V221 I222 W228 F229	V221-G225 PolarHBondContact O-N 2.83Å; I222-G225 PolarHBondContact O-N 3.21Å; G225-W228 PolarHBondContact O-N 2.86Å; G225-F229 WeakPolarHBondContact O-CB 3.34Å; G225-F229 PolarHBondContact O-N 2.85Å
226	G	92.1	Very high	87.9	Confident	41 Å²	41	93 Å²	93	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-46.7	175	0	0	0	0	0	112.5	I222 W228 F229 A230	I222-G226 PolarHBondContact O-N 3.34Å; G226-W228 VanDerWaalsContact C-N 3.33Å; G226-W228 PolarHBondContact O-N 2.92Å; G226-F229 PolarHBondContact O-N 2.83Å; G226-A230 VanDerWaalsContact O-CB 3.3Å; G226-A230 WeakPolarHBondContact O-CB 3.37Å; G226-A230 PolarHBondContact O-N 3.16Å
227	C	88.6	Confident	87.3	Confident	95 Å²	95	91.4 Å²	91.4	64%	0.642	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-39.8	174.1	-76.3	0	0	0	0	112.5	G223 V224 Y231	G223-C227 WeakPolarHBondContact O-CB 3.47Å; G223-C227 PolarHBondContact O-N 3.39Å; G223-C227 PolarHBondContact O-SG 3.36Å; G223-C227 VanDerWaalsContact O-SG 3.34Å; V224-C227 PolarHBondContact O-N 2.87Å; C227-Y231 VanDerWaalsContact O-CB 3.28Å; C227-Y231 WeakPolarHBondContact O-CB 3.44Å; C227-Y231 PolarHBondContact O-N 3.22Å
228	W	89.8	Confident	86.6	Confident	176 Å²	176	92.3 Å²	92.3	67%	0.667	49%	0.493	S	S	*	.	H	α-helix	trans	-67.7	-44.1	176.2	-179.6	-94.4	0	0	0	112.3	V224 G225 G226 Y231 I232	V224-W228 VanDerWaalsContact O-CB 3.26Å; V224-W228 WeakPolarHBondContact O-CB 3.46Å; V224-W228 PolarHBondContact O-N 3.44Å; G225-W228 PolarHBondContact O-N 2.86Å; G226-W228 VanDerWaalsContact C-N 3.33Å; G226-W228 PolarHBondContact O-N 2.92Å; W228-Y231 WeakPolarHBondContact O-CB 3.14Å; W228-Y231 PolarHBondContact O-N 2.85Å; W228-I232 HydrophobicContact CD2-CD1 4.26Å; W228-I232 HydrophobicContact CZ2-CD1 4.05Å; W228-I232 PolarHBondContact O-N 2.84Å
229	F	90.8	Very high	86	Confident	130 Å²	130	94.2 Å²	94.2	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-62.5	-46.5	175.8	-178.1	-94.1	0	0	0	111.4	G225 G226 Y231 I232 Q233	G225-F229 WeakPolarHBondContact O-CB 3.34Å; G225-F229 PolarHBondContact O-N 2.85Å; G226-F229 PolarHBondContact O-N 2.83Å; F229-Y231 VanDerWaalsContact C-N 3.3Å; F229-Y231 PolarHBondContact O-N 3.38Å; F229-I232 WeakPolarHBondContact O-CB 3.3Å; F229-I232 PolarHBondContact O-N 3.19Å; F229-I232 VanDerWaalsContact O-N 3.16Å; F229-Q233 WeakPolarHBondContact O-CB 3.41Å; F229-Q233 PolarHBondContact O-N 3.19Å
230	A	89.5	Confident	85	Confident	53 Å²	53	97.1 Å²	97.1	44%	0.438	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-37.2	174.7	0	0	0	0	0	112.1	G226 Q233 N234	G226-A230 VanDerWaalsContact O-CB 3.3Å; G226-A230 WeakPolarHBondContact O-CB 3.37Å; G226-A230 PolarHBondContact O-N 3.16Å; A230-Q233 PolarHBondContact O-N 2.78Å; A230-N234 WeakPolarHBondContact O-CB 3.24Å; A230-N234 PolarHBondContact O-N 3.26Å
231	Y	88.4	Confident	83.6	Confident	141 Å²	141	97.8 Å²	97.8	55%	0.553	51%	0.507	S	S	*	.	H	α-helix	trans	-65.1	-42.1	173.1	176.7	-104.1	0	0	0	112.5	C227 W228 F229 R235	C227-Y231 VanDerWaalsContact O-CB 3.28Å; C227-Y231 WeakPolarHBondContact O-CB 3.44Å; C227-Y231 PolarHBondContact O-N 3.22Å; W228-Y231 WeakPolarHBondContact O-CB 3.14Å; W228-Y231 PolarHBondContact O-N 2.85Å; F229-Y231 VanDerWaalsContact C-N 3.3Å; F229-Y231 PolarHBondContact O-N 3.38Å; Y231-R235 PolarHBondContact O-N 3Å
232	I	84.4	Confident	82.7	Confident	55 Å²	55	100.5 Å²	100.5	28%	0.282	51%	0.511	S	S	.	.	H	α-helix	trans	-60.7	-46.4	172.2	-100.6	59.9	0	0	0	111	W228 F229 R235 Y236	W228-I232 HydrophobicContact CD2-CD1 4.26Å; W228-I232 HydrophobicContact CZ2-CD1 4.05Å; W228-I232 PolarHBondContact O-N 2.84Å; F229-I232 WeakPolarHBondContact O-CB 3.3Å; F229-I232 PolarHBondContact O-N 3.19Å; F229-I232 VanDerWaalsContact O-N 3.16Å; I232-R235 WeakPolarHBondContact O-CB 3.43Å; I232-R235 PolarHBondContact O-N 2.9Å; I232-R235 VanDerWaalsContact O-N 3.14Å; I232-Y236 HydrophobicContact CG2-CD2 4.21Å; I232-Y236 HydrophobicContact CG2-CE2 4.44Å; I232-Y236 WeakPolarHBondContact O-CD2 3.33Å; I232-Y236 PolarHBondContact O-N 3.11Å
233	Q	78.5	Confident	81.9	Confident	116 Å²	116	101.5 Å²	101.5	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-69.9	-36.4	-177.8	-161.4	175.3	16.2	0	0	111.9	F229 A230 R235 Y236 S237	F229-Q233 WeakPolarHBondContact O-CB 3.41Å; F229-Q233 PolarHBondContact O-N 3.19Å; A230-Q233 PolarHBondContact O-N 2.78Å; Q233-R235 VanDerWaalsContact C-N 3.29Å; Q233-R235 PolarHBondContact O-N 2.86Å; Q233-Y236 PolarHBondContact O-N 3.45Å; Q233-S237 WeakPolarHBondContact O-CB 3.27Å; Q233-S237 PolarHBondContact O-N 3.45Å; Q233-S237 PolarHBondContact O-OG 2.72Å
234	N	81.8	Confident	80.8	Confident	72 Å²	72	105.9 Å²	105.9	39%	0.385	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-30.6	170.8	-175.1	-0	0	0	0	112.2	A230 S237 K238	A230-N234 WeakPolarHBondContact O-CB 3.24Å; A230-N234 PolarHBondContact O-N 3.26Å; N234-S237 WeakPolarHBondContact CA-OG 3.43Å; N234-S237 PolarHBondContact O-OG 2.97Å; N234-K238 WeakPolarHBondContact O-CB 3.08Å; N234-K238 WeakPolarHBondContact O-CD 3.28Å; N234-K238 VanDerWaalsContact O-CG 3.24Å; N234-K238 WeakPolarHBondContact O-CG 3.47Å; N234-K238 PolarHBondContact O-N 2.93Å; N234-K238 WeakPolarHBondContact OD1-CE 3.26Å; N234-K238 PolarHBondContact OD1-NZ 3.42Å
235	R	82.9	Confident	79.7	Confident	148 Å²	148	106.1 Å²	106.1	56%	0.558	52%	0.518	S	S	*	.	H	α-helix	trans	-72.6	-50.5	171.9	-177.7	177	177.2	163.3	0.8	111.7	Y231 I232 Q233 S237 K238 E239	Y231-R235 PolarHBondContact O-N 3Å; I232-R235 WeakPolarHBondContact O-CB 3.43Å; I232-R235 PolarHBondContact O-N 2.9Å; I232-R235 VanDerWaalsContact O-N 3.14Å; Q233-R235 VanDerWaalsContact C-N 3.29Å; Q233-R235 PolarHBondContact O-N 2.86Å; R235-S237 VanDerWaalsContact C-N 3.33Å; R235-S237 PolarHBondContact O-N 3.48Å; R235-K238 WeakPolarHBondContact O-CB 3.36Å; R235-K238 PolarHBondContact O-N 3.34Å; R235-E239 WeakPolarHBondContact CG-OE1 3.37Å; R235-E239 IonicContact CZ-OE1 2.75Å; R235-E239 IonicContact NE-OE1 2.7Å; R235-E239 PolarHBondContact NE-OE1 3.43Å; R235-E239 IonicContact NH2-OE1 3.69Å; R235-E239 WeakPolarHBondContact O-CG 3.26Å; R235-E239 PolarHBondContact O-N 3.49Å
236	Y	74.6	Confident	79	Confident	146 Å²	146	111.5 Å²	111.5	57%	0.573	53%	0.531	S	S	*	.	H	α-helix	trans	-60.8	-40.9	177.4	-87.2	-76.7	0	0	0	112.1	I232 Q233 K238 E239 H240	I232-Y236 HydrophobicContact CG2-CD2 4.21Å; I232-Y236 HydrophobicContact CG2-CE2 4.44Å; I232-Y236 WeakPolarHBondContact O-CD2 3.33Å; I232-Y236 PolarHBondContact O-N 3.11Å; Q233-Y236 PolarHBondContact O-N 3.45Å; Y236-K238 VanDerWaalsContact C-N 3.34Å; Y236-K238 PolarHBondContact O-N 3.27Å; Y236-E239 PolarHBondContact O-N 2.78Å; Y236-E239 VanDerWaalsContact O-N 3.15Å; Y236-H240 PolarHBondContact O-CD2 2.8Å; Y236-H240 PolarHBondContact O-N 3.33Å
237	S	71.3	Confident	78.5	Confident	65 Å²	65	114 Å²	114	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-64.9	-36.4	175.8	69	0	0	0	0	112.3	Q233 N234 R235 E239 M241	Q233-S237 WeakPolarHBondContact O-CB 3.27Å; Q233-S237 PolarHBondContact O-N 3.45Å; Q233-S237 PolarHBondContact O-OG 2.72Å; N234-S237 WeakPolarHBondContact CA-OG 3.43Å; N234-S237 PolarHBondContact O-OG 2.97Å; R235-S237 VanDerWaalsContact C-N 3.33Å; R235-S237 PolarHBondContact O-N 3.48Å; S237-E239 VanDerWaalsContact C-N 3.35Å; S237-M241 WeakPolarHBondContact O-CB 3.41Å; S237-M241 PolarHBondContact O-N 2.9Å
238	K	72.3	Confident	78	Confident	105 Å²	105	114.9 Å²	114.9	46%	0.457	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-33.1	171.3	-79	167.5	178.2	152.1	0	113.3	N234 R235 Y236 K242	N234-K238 WeakPolarHBondContact O-CB 3.08Å; N234-K238 WeakPolarHBondContact O-CD 3.28Å; N234-K238 VanDerWaalsContact O-CG 3.24Å; N234-K238 WeakPolarHBondContact O-CG 3.47Å; N234-K238 PolarHBondContact O-N 2.93Å; N234-K238 WeakPolarHBondContact OD1-CE 3.26Å; N234-K238 PolarHBondContact OD1-NZ 3.42Å; R235-K238 WeakPolarHBondContact O-CB 3.36Å; R235-K238 PolarHBondContact O-N 3.34Å; Y236-K238 VanDerWaalsContact C-N 3.34Å; Y236-K238 PolarHBondContact O-N 3.27Å; K238-K242 WeakPolarHBondContact O-CB 3.39Å; K238-K242 VanDerWaalsContact O-CG 3.22Å; K238-K242 WeakPolarHBondContact O-CG 3.33Å; K238-K242 PolarHBondContact O-N 2.98Å
239	E	73.8	Confident	77.7	Confident	89 Å²	89	112.2 Å²	112.2	42%	0.416	53%	0.527	S	S	.	.	H	α-helix	trans	-74.6	-41	176.8	-70.4	171.7	-165.3	0	0	110.8	R235 Y236 S237 K243	R235-E239 WeakPolarHBondContact CG-OE1 3.37Å; R235-E239 IonicContact CZ-OE1 2.75Å; R235-E239 IonicContact NE-OE1 2.7Å; R235-E239 PolarHBondContact NE-OE1 3.43Å; R235-E239 IonicContact NH2-OE1 3.69Å; R235-E239 WeakPolarHBondContact O-CG 3.26Å; R235-E239 PolarHBondContact O-N 3.49Å; Y236-E239 PolarHBondContact O-N 2.78Å; Y236-E239 VanDerWaalsContact O-N 3.15Å; S237-E239 VanDerWaalsContact C-N 3.35Å; E239-K243 PolarHBondContact O-N 3.39Å
240	H	66.6	Low	77.4	Confident	126 Å²	126	107.9 Å²	107.9	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-63.5	-43.8	169.1	-85.9	-92.9	0	0	0	113.1	Y236 K243 M244	Y236-H240 PolarHBondContact O-CD2 2.8Å; Y236-H240 PolarHBondContact O-N 3.33Å; H240-K243 WeakPolarHBondContact O-CB 3.12Å; H240-K243 PolarHBondContact O-N 2.77Å; H240-M244 WeakPolarHBondContact O-CB 3.33Å; H240-M244 PolarHBondContact O-N 3.15Å
241	M	62.3	Low	77.1	Confident	108 Å²	108	111.3 Å²	111.3	53%	0.532	53%	0.53	S	S	.	.	H	α-helix	trans	-69.2	-33.5	-179.7	-170.8	179.7	78	0	0	112	S237 M244 M245	S237-M241 WeakPolarHBondContact O-CB 3.41Å; S237-M241 PolarHBondContact O-N 2.9Å; M241-M244 PolarHBondContact O-N 3.43Å; M241-M245 WeakPolarHBondContact O-CB 3.22Å; M241-M245 WeakPolarHBondContact O-CG 3.4Å; M241-M245 PolarHBondContact O-N 3.18Å
242	K	75.6	Confident	76.6	Confident	153 Å²	153	109 Å²	109	67%	0.665	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-39.1	169.8	-81.4	174.5	177.7	-175.6	0	112.4	K238 K246	K238-K242 WeakPolarHBondContact O-CB 3.39Å; K238-K242 VanDerWaalsContact O-CG 3.22Å; K238-K242 WeakPolarHBondContact O-CG 3.33Å; K238-K242 PolarHBondContact O-N 2.98Å; K242-K246 WeakPolarHBondContact O-CB 3.44Å; K242-K246 PolarHBondContact O-N 2.96Å; K242-K246 VanDerWaalsContact O-N 3.09Å
243	K	75.8	Confident	76.7	Confident	139 Å²	139	115.4 Å²	115.4	60%	0.604	54%	0.544	S	S	*	.	H	α-helix	trans	-64.2	-49.2	172.8	-168	-177.2	175.5	-174.3	0	110.4	E239 H240 M245 K246 D247	E239-K243 PolarHBondContact O-N 3.39Å; H240-K243 WeakPolarHBondContact O-CB 3.12Å; H240-K243 PolarHBondContact O-N 2.77Å; K243-M245 PolarHBondContact O-N 3.43Å; K243-K246 PolarHBondContact O-N 3.46Å; K243-K246 VanDerWaalsContact O-N 3.11Å; K243-D247 WeakPolarHBondContact O-CB 3.37Å; K243-D247 PolarHBondContact O-N 3.14Å
244	M	70	Confident	77	Confident	130 Å²	130	112.2 Å²	112.2	64%	0.64	54%	0.537	S	S	*	.	H	α-helix	trans	-61.9	-40.5	179.9	-165.3	179.7	-66.9	0	0	113.2	H240 M241 D247 L248	H240-M244 WeakPolarHBondContact O-CB 3.33Å; H240-M244 PolarHBondContact O-N 3.15Å; M241-M244 PolarHBondContact O-N 3.43Å; M244-D247 PolarHBondContact O-N 2.99Å; M244-L248 VanDerWaalsContact O-CB 3.27Å; M244-L248 WeakPolarHBondContact O-CB 3.44Å; M244-L248 PolarHBondContact O-N 3.45Å
245	M	71.7	Confident	77.2	Confident	103 Å²	103	113.6 Å²	113.6	51%	0.507	54%	0.541	S	S	.	.	H	α-helix	trans	-63.5	-42.6	171.8	-79.2	-170.2	70.9	0	0	111.7	M241 K243 D247 L248 E249	M241-M245 WeakPolarHBondContact O-CB 3.22Å; M241-M245 WeakPolarHBondContact O-CG 3.4Å; M241-M245 PolarHBondContact O-N 3.18Å; K243-M245 PolarHBondContact O-N 3.43Å; M245-D247 VanDerWaalsContact C-N 3.34Å; M245-D247 PolarHBondContact O-N 2.83Å; M245-L248 PolarHBondContact O-N 2.87Å; M245-E249 WeakPolarHBondContact O-CB 3.49Å; M245-E249 WeakPolarHBondContact O-CG 3.5Å; M245-E249 PolarHBondContact O-N 3.41Å
246	K	79.3	Confident	77.1	Confident	151 Å²	151	111.6 Å²	111.6	66%	0.657	54%	0.538	S	S	*	.	H	α-helix	trans	-66.1	-37.4	177.4	-173.3	177.3	179.2	-177.7	0	112.3	K242 K243 G250	K242-K246 WeakPolarHBondContact O-CB 3.44Å; K242-K246 PolarHBondContact O-N 2.96Å; K242-K246 VanDerWaalsContact O-N 3.09Å; K243-K246 PolarHBondContact O-N 3.46Å; K243-K246 VanDerWaalsContact O-N 3.11Å; K246-G250 PolarHBondContact O-N 2.88Å
247	D	81.8	Confident	77.4	Confident	92 Å²	92	107.5 Å²	107.5	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-69.9	-34.5	176.2	-63.1	-19.3	0	0	0	110.6	K243 M244 M245 G250 L251	K243-D247 WeakPolarHBondContact O-CB 3.37Å; K243-D247 PolarHBondContact O-N 3.14Å; M244-D247 PolarHBondContact O-N 2.99Å; M245-D247 VanDerWaalsContact C-N 3.34Å; M245-D247 PolarHBondContact O-N 2.83Å; D247-G250 PolarHBondContact O-N 2.95Å; D247-L251 WeakPolarHBondContact O-CB 3.31Å; D247-L251 PolarHBondContact O-N 3.27Å
248	L	77.6	Confident	77.8	Confident	114 Å²	114	109 Å²	109	60%	0.597	53%	0.534	S	S	*	.	H	α-helix	trans	-73.1	-43.3	174.3	-161.4	165.1	0	0	0	112.2	M244 M245 G250 L251 H252	M244-L248 VanDerWaalsContact O-CB 3.27Å; M244-L248 WeakPolarHBondContact O-CB 3.44Å; M244-L248 PolarHBondContact O-N 3.45Å; M245-L248 PolarHBondContact O-N 2.87Å; L248-G250 VanDerWaalsContact C-N 3.27Å; L248-G250 PolarHBondContact O-N 3.23Å; L248-L251 PolarHBondContact O-N 3.2Å; L248-H252 WeakPolarHBondContact O-CB 3.37Å; L248-H252 PolarHBondContact O-N 3.47Å
249	E	82.1	Confident	78.2	Confident	121 Å²	121	109.2 Å²	109.2	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-59.2	-39.1	169.9	-75.9	170.1	-159.8	0	0	111.2	M245 R253	M245-E249 WeakPolarHBondContact O-CB 3.49Å; M245-E249 WeakPolarHBondContact O-CG 3.5Å; M245-E249 PolarHBondContact O-N 3.41Å; E249-R253 VanDerWaalsContact O-CB 3.26Å; E249-R253 WeakPolarHBondContact O-CB 3.03Å; E249-R253 PolarHBondContact O-N 3.18Å
250	G	85.9	Confident	78.7	Confident	39 Å²	39	108.2 Å²	108.2	40%	0.402	53%	0.533	S	S	.	.	H	α-helix	trans	-64.1	-45.2	173.1	0	0	0	0	0	112.6	K246 D247 L248 R253 A254	K246-G250 PolarHBondContact O-N 2.88Å; D247-G250 PolarHBondContact O-N 2.95Å; L248-G250 VanDerWaalsContact C-N 3.27Å; L248-G250 PolarHBondContact O-N 3.23Å; G250-R253 PolarHBondContact O-N 2.81Å; G250-A254 WeakPolarHBondContact O-CB 3.31Å; G250-A254 PolarHBondContact O-N 2.84Å
251	L	81.8	Confident	79.2	Confident	125 Å²	125	107.3 Å²	107.3	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-66.3	-42.8	177.9	-173	64.2	0	0	0	112.1	D247 L248 R253 A254 E255	D247-L251 WeakPolarHBondContact O-CB 3.31Å; D247-L251 PolarHBondContact O-N 3.27Å; L248-L251 PolarHBondContact O-N 3.2Å; L251-R253 VanDerWaalsContact C-N 3.34Å; L251-R253 PolarHBondContact O-N 3.29Å; L251-A254 WeakPolarHBondContact O-CB 3.39Å; L251-A254 PolarHBondContact O-N 3.03Å; L251-E255 WeakPolarHBondContact O-CB 3.42Å; L251-E255 PolarHBondContact O-N 2.89Å
252	H	79.7	Confident	79.9	Confident	91 Å²	91	107.2 Å²	107.2	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-67.6	-33.9	176.4	-170.4	53.4	0	0	0	111.8	L248 E255 Q256	L248-H252 WeakPolarHBondContact O-CB 3.37Å; L248-H252 PolarHBondContact O-N 3.47Å; H252-E255 IonicContact CE1-OE2 2.75Å; H252-E255 IonicContact CG-OE2 2.74Å; H252-E255 IonicContact ND1-OE2 3.52Å; H252-E255 PolarHBondContact ND1-OE2 3.36Å; H252-E255 PolarHBondContact O-N 3.18Å; H252-Q256 PolarHBondContact CD2-NE2 3.36Å; H252-Q256 VanDerWaalsContact CD2-NE2 3.34Å; H252-Q256 PolarHBondContact NE2-NE2 2.99Å; H252-Q256 WeakPolarHBondContact O-CB 3.36Å; H252-Q256 VanDerWaalsContact O-CG 3.26Å; H252-Q256 WeakPolarHBondContact O-CG 3.49Å; H252-Q256 PolarHBondContact O-N 2.86Å
253	R	85.8	Confident	80.2	Confident	191 Å²	191	106.7 Å²	106.7	72%	0.721	53%	0.531	S	S	*	.	H	α-helix	trans	-68.5	-35.4	171.3	-161.5	-177.9	-154.3	93.7	3.7	112.1	E249 G250 L251 S257	E249-R253 VanDerWaalsContact O-CB 3.26Å; E249-R253 WeakPolarHBondContact O-CB 3.03Å; E249-R253 PolarHBondContact O-N 3.18Å; G250-R253 PolarHBondContact O-N 2.81Å; L251-R253 VanDerWaalsContact C-N 3.34Å; L251-R253 PolarHBondContact O-N 3.29Å; R253-S257 WeakPolarHBondContact O-CB 3.38Å; R253-S257 PolarHBondContact O-N 2.94Å; R253-S257 PolarHBondContact O-OG 3.35Å
254	A	84.8	Confident	80.2	Confident	48 Å²	48	107.5 Å²	107.5	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-67.4	-45	173.4	0	0	0	0	0	111.4	G250 L251 S257 L258	G250-A254 WeakPolarHBondContact O-CB 3.31Å; G250-A254 PolarHBondContact O-N 2.84Å; L251-A254 WeakPolarHBondContact O-CB 3.39Å; L251-A254 PolarHBondContact O-N 3.03Å; A254-S257 WeakPolarHBondContact CA-OG 3.27Å; A254-S257 CarbonylContact O-C 3.58Å; A254-S257 PolarHBondContact O-N 3.42Å; A254-S257 VanDerWaalsContact O-N 3.17Å; A254-S257 PolarHBondContact O-OG 3.45Å; A254-L258 WeakPolarHBondContact O-CB 3.4Å; A254-L258 PolarHBondContact O-N 2.82Å
255	E	84.9	Confident	80.3	Confident	101 Å²	101	106.7 Å²	106.7	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-55.8	-50	172.7	177	-179.1	-131	0	0	111.8	L251 H252 S257 L258 H259	L251-E255 WeakPolarHBondContact O-CB 3.42Å; L251-E255 PolarHBondContact O-N 2.89Å; H252-E255 IonicContact CE1-OE2 2.75Å; H252-E255 IonicContact CG-OE2 2.74Å; H252-E255 IonicContact ND1-OE2 3.52Å; H252-E255 PolarHBondContact ND1-OE2 3.36Å; H252-E255 PolarHBondContact O-N 3.18Å; E255-S257 PolarHBondContact O-N 3.37Å; E255-L258 PolarHBondContact O-N 3.49Å; E255-H259 PolarHBondContact O-N 3.17Å
256	Q	81	Confident	80.3	Confident	106 Å²	106	107.8 Å²	107.8	50%	0.495	53%	0.531	S	S	.	.	H	α-helix	trans	-59.4	-42.4	173.4	-73.1	175.2	4.7	0	0	112.3	H252 L258 H259 D260	H252-Q256 PolarHBondContact CD2-NE2 3.36Å; H252-Q256 VanDerWaalsContact CD2-NE2 3.34Å; H252-Q256 PolarHBondContact NE2-NE2 2.99Å; H252-Q256 WeakPolarHBondContact O-CB 3.36Å; H252-Q256 VanDerWaalsContact O-CG 3.26Å; H252-Q256 WeakPolarHBondContact O-CG 3.49Å; H252-Q256 PolarHBondContact O-N 2.86Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; Q256-L258 PolarHBondContact O-N 2.8Å; Q256-H259 PolarHBondContact O-N 2.98Å; Q256-D260 WeakPolarHBondContact O-CB 3.49Å; Q256-D260 PolarHBondContact O-N 3.19Å
257	S	80.7	Confident	80	Confident	61 Å²	61	106.5 Å²	106.5	43%	0.427	53%	0.526	S	S	.	.	H	α-helix	trans	-69	-28.5	177.4	73.9	0	0	0	0	113.4	R253 A254 E255 L261	R253-S257 WeakPolarHBondContact O-CB 3.38Å; R253-S257 PolarHBondContact O-N 2.94Å; R253-S257 PolarHBondContact O-OG 3.35Å; A254-S257 WeakPolarHBondContact CA-OG 3.27Å; A254-S257 CarbonylContact O-C 3.58Å; A254-S257 PolarHBondContact O-N 3.42Å; A254-S257 VanDerWaalsContact O-N 3.17Å; A254-S257 PolarHBondContact O-OG 3.45Å; E255-S257 PolarHBondContact O-N 3.37Å; S257-L261 WeakPolarHBondContact O-CB 3.41Å; S257-L261 WeakPolarHBondContact O-CG 3.47Å; S257-L261 PolarHBondContact O-N 2.82Å
258	L	81.1	Confident	79.3	Confident	96 Å²	96	104.5 Å²	104.5	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-75.4	-37.2	175.8	-169.4	149.5	0	0	0	110.5	A254 E255 Q256 L261 Q262	A254-L258 WeakPolarHBondContact O-CB 3.4Å; A254-L258 PolarHBondContact O-N 2.82Å; E255-L258 PolarHBondContact O-N 3.49Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; Q256-L258 PolarHBondContact O-N 2.8Å; L258-L261 PolarHBondContact O-N 2.92Å; L258-Q262 HydrophobicContact CD2-CG 4.14Å; L258-Q262 WeakPolarHBondContact O-CB 3.26Å; L258-Q262 VanDerWaalsContact O-CG 3.31Å; L258-Q262 WeakPolarHBondContact O-CG 3.39Å; L258-Q262 PolarHBondContact O-N 3.43Å
259	H	80.3	Confident	78.4	Confident	110 Å²	110	105.7 Å²	105.7	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-46	169.1	-84.7	-54.7	0	0	0	112.5	E255 Q256 L261 Q262 E263	E255-H259 PolarHBondContact O-N 3.17Å; Q256-H259 PolarHBondContact O-N 2.98Å; H259-L261 VanDerWaalsContact C-N 3.32Å; H259-L261 PolarHBondContact O-N 3.46Å; H259-Q262 PolarHBondContact ND1-OE1 2.91Å; H259-Q262 PolarHBondContact O-N 2.74Å; H259-Q262 VanDerWaalsContact O-N 3.14Å; H259-E263 WeakPolarHBondContact O-CB 3.46Å; H259-E263 PolarHBondContact O-N 3.41Å
260	D	83.1	Confident	77.5	Confident	67 Å²	67	105.6 Å²	105.6	36%	0.358	52%	0.524	S	S	.	.	H	α-helix	trans	-60.7	-39.5	174.6	-179.5	29.8	0	0	0	111.6	Q256 R264	Q256-D260 WeakPolarHBondContact O-CB 3.49Å; Q256-D260 PolarHBondContact O-N 3.19Å; D260-R264 VanDerWaalsContact CG-NE 3.35Å; D260-R264 VanDerWaalsContact CG-NH2 3.29Å; D260-R264 WeakPolarHBondContact O-CB 3.46Å; D260-R264 WeakPolarHBondContact O-CG 3.43Å; D260-R264 PolarHBondContact O-N 2.96Å; D260-R264 IonicContact OD1-CZ 3.62Å; D260-R264 VanDerWaalsContact OD1-CZ 3.32Å; D260-R264 IonicContact OD1-NE 2.59Å; D260-R264 PolarHBondContact OD1-NE 2.81Å; D260-R264 IonicContact OD1-NH2 3.72Å; D260-R264 PolarHBondContact OD1-NH2 2.89Å; D260-R264 IonicContact OD2-CZ 3.58Å; D260-R264 IonicContact OD2-NE 3.68Å; D260-R264 PolarHBondContact OD2-NE 3.22Å; D260-R264 IonicContact OD2-NH2 2.65Å; D260-R264 PolarHBondContact OD2-NH2 3.42Å
261	L	78.6	Confident	76.3	Confident	108 Å²	108	108.5 Å²	108.5	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-67.1	-38	172.1	-86.6	162.6	0	0	0	113.3	S257 L258 H259 L265	S257-L261 WeakPolarHBondContact O-CB 3.41Å; S257-L261 WeakPolarHBondContact O-CG 3.47Å; S257-L261 PolarHBondContact O-N 2.82Å; L258-L261 PolarHBondContact O-N 2.92Å; H259-L261 VanDerWaalsContact C-N 3.32Å; H259-L261 PolarHBondContact O-N 3.46Å; L261-L265 WeakPolarHBondContact O-CB 3.31Å; L261-L265 PolarHBondContact O-N 3.49Å
262	Q	77.1	Confident	74.7	Confident	106 Å²	106	108.6 Å²	108.6	50%	0.495	52%	0.524	S	S	.	.	H	α-helix	trans	-67.2	-41.9	174.3	-79.9	178.7	-27.4	0	0	111.8	L258 H259 L265 H266	L258-Q262 HydrophobicContact CD2-CG 4.14Å; L258-Q262 WeakPolarHBondContact O-CB 3.26Å; L258-Q262 VanDerWaalsContact O-CG 3.31Å; L258-Q262 WeakPolarHBondContact O-CG 3.39Å; L258-Q262 PolarHBondContact O-N 3.43Å; H259-Q262 PolarHBondContact ND1-OE1 2.91Å; H259-Q262 PolarHBondContact O-N 2.74Å; H259-Q262 VanDerWaalsContact O-N 3.14Å; Q262-L265 PolarHBondContact O-N 3.5Å; Q262-H266 VanDerWaalsContact O-CB 3.31Å; Q262-H266 WeakPolarHBondContact O-CB 3.36Å; Q262-H266 PolarHBondContact O-N 2.93Å
263	E	80.8	Confident	73.7	Confident	142 Å²	142	113.3 Å²	113.3	66%	0.664	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-44	176.8	-173	174.4	178.7	0	0	110.8	H259 H266 K267	H259-E263 WeakPolarHBondContact O-CB 3.46Å; H259-E263 PolarHBondContact O-N 3.41Å; E263-H266 PolarHBondContact O-N 2.84Å; E263-K267 VanDerWaalsContact O-CB 3.27Å; E263-K267 WeakPolarHBondContact O-CB 3.27Å; E263-K267 PolarHBondContact O-N 3.4Å
264	R	77.1	Confident	72.7	Confident	155 Å²	155	107.4 Å²	107.4	59%	0.585	52%	0.523	S	S	*	.	H	α-helix	trans	-64.6	-39.1	173.2	-70.2	173.8	-160.6	-144.7	11.5	113	D260 A268	D260-R264 VanDerWaalsContact CG-NE 3.35Å; D260-R264 VanDerWaalsContact CG-NH2 3.29Å; D260-R264 WeakPolarHBondContact O-CB 3.46Å; D260-R264 WeakPolarHBondContact O-CG 3.43Å; D260-R264 PolarHBondContact O-N 2.96Å; D260-R264 IonicContact OD1-CZ 3.62Å; D260-R264 VanDerWaalsContact OD1-CZ 3.32Å; D260-R264 IonicContact OD1-NE 2.59Å; D260-R264 PolarHBondContact OD1-NE 2.81Å; D260-R264 IonicContact OD1-NH2 3.72Å; D260-R264 PolarHBondContact OD1-NH2 2.89Å; D260-R264 IonicContact OD2-CZ 3.58Å; D260-R264 IonicContact OD2-NE 3.68Å; D260-R264 PolarHBondContact OD2-NE 3.22Å; D260-R264 IonicContact OD2-NH2 2.65Å; D260-R264 PolarHBondContact OD2-NH2 3.42Å; R264-A268 WeakPolarHBondContact O-CB 3.45Å; R264-A268 PolarHBondContact O-N 3.11Å
265	L	70.2	Confident	71.5	Confident	114 Å²	114	109 Å²	109	60%	0.597	53%	0.528	S	S	*	.	H	α-helix	trans	-66	-42.7	173.8	-101.2	167.8	0	0	0	111.7	L261 Q262 A268 Q269	L261-L265 WeakPolarHBondContact O-CB 3.31Å; L261-L265 PolarHBondContact O-N 3.49Å; Q262-L265 PolarHBondContact O-N 3.5Å; L265-A268 PolarHBondContact O-N 2.9Å; L265-Q269 WeakPolarHBondContact O-CB 3.24Å; L265-Q269 PolarHBondContact O-N 3.09Å
266	H	72.4	Confident	70.2	Confident	125 Å²	125	110.2 Å²	110.2	58%	0.579	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-48.5	178.1	-161.6	64.6	0	0	0	110.4	Q262 E263 Q269 E270	Q262-H266 VanDerWaalsContact O-CB 3.31Å; Q262-H266 WeakPolarHBondContact O-CB 3.36Å; Q262-H266 PolarHBondContact O-N 2.93Å; E263-H266 PolarHBondContact O-N 2.84Å; H266-Q269 PolarHBondContact O-N 2.85Å; H266-E270 WeakPolarHBondContact O-CB 3.44Å; H266-E270 PolarHBondContact O-N 3.17Å
267	K	73.6	Confident	69.4	Low	125 Å²	125	109.9 Å²	109.9	54%	0.543	54%	0.539	S	S	.	.	H	α-helix	trans	-59.8	-48.1	175.3	-178.5	170.1	177	173.4	0	112.5	E263 Q269 E270 E271	E263-K267 VanDerWaalsContact O-CB 3.27Å; E263-K267 WeakPolarHBondContact O-CB 3.27Å; E263-K267 PolarHBondContact O-N 3.4Å; K267-Q269 VanDerWaalsContact C-N 3.29Å; K267-Q269 PolarHBondContact O-N 3.2Å; K267-E270 PolarHBondContact O-N 2.86Å; K267-E271 WeakPolarHBondContact CE-OE1 3.27Å; K267-E271 HydrophobicContact CG-CG 4.43Å; K267-E271 WeakPolarHBondContact CG-OE1 3.49Å; K267-E271 IonicContact NZ-OE1 2.71Å; K267-E271 WeakPolarHBondContact O-CB 3.34Å; K267-E271 VanDerWaalsContact O-CG 3.3Å; K267-E271 WeakPolarHBondContact O-CG 3.38Å; K267-E271 PolarHBondContact O-N 3.44Å
268	A	66.7	Low	68.5	Low	50 Å²	50	113 Å²	113	41%	0.413	55%	0.546	S	S	.	.	H	α-helix	trans	-63.3	-34.6	177.8	0	0	0	0	0	112.5	R264 L265 H272	R264-A268 WeakPolarHBondContact O-CB 3.45Å; R264-A268 PolarHBondContact O-N 3.11Å; L265-A268 PolarHBondContact O-N 2.9Å; A268-H272 WeakPolarHBondContact O-CB 3.37Å; A268-H272 PolarHBondContact O-N 3.33Å
269	Q	58.1	Low	67.7	Low	138 Å²	138	114.6 Å²	114.6	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-80.3	-27.6	178.7	-164.3	168.4	-90.9	0	0	112.8	L265 H266 K267 R273	L265-Q269 WeakPolarHBondContact O-CB 3.24Å; L265-Q269 PolarHBondContact O-N 3.09Å; H266-Q269 PolarHBondContact O-N 2.85Å; K267-Q269 VanDerWaalsContact C-N 3.29Å; K267-Q269 PolarHBondContact O-N 3.2Å; Q269-R273 WeakPolarHBondContact O-CB 3.19Å; Q269-R273 PolarHBondContact O-N 3.17Å; Q269-R273 VanDerWaalsContact O-N 3.13Å
270	E	64.8	Low	67.1	Low	120 Å²	120	114 Å²	114	56%	0.561	55%	0.554	S	S	*	*	H	α-helix	trans	-73.8	-43.4	170.3	-170.9	159.1	-127.9	0	0	111.1	H266 K267 H272 R273 T274	H266-E270 WeakPolarHBondContact O-CB 3.44Å; H266-E270 PolarHBondContact O-N 3.17Å; K267-E270 PolarHBondContact O-N 2.86Å; E270-H272 VanDerWaalsContact C-N 3.33Å; E270-H272 PolarHBondContact O-N 3.29Å; E270-R273 PolarHBondContact O-N 2.82Å; E270-R273 VanDerWaalsContact O-N 3.08Å; E270-T274 PolarHBondContact O-N 3.16Å; E270-T274 PolarHBondContact O-OG1 3.08Å
271	E	58.7	Low	66.8	Low	99 Å²	99	116.9 Å²	116.9	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-58.9	-41	169.6	-74.5	172.2	-176.6	0	0	111.5	K267 R273 T274 V275	K267-E271 WeakPolarHBondContact CE-OE1 3.27Å; K267-E271 HydrophobicContact CG-CG 4.43Å; K267-E271 WeakPolarHBondContact CG-OE1 3.49Å; K267-E271 IonicContact NZ-OE1 2.71Å; K267-E271 WeakPolarHBondContact O-CB 3.34Å; K267-E271 VanDerWaalsContact O-CG 3.3Å; K267-E271 WeakPolarHBondContact O-CG 3.38Å; K267-E271 PolarHBondContact O-N 3.44Å; E271-R273 VanDerWaalsContact C-N 3.3Å; E271-R273 PolarHBondContact O-N 3.31Å; E271-T274 PolarHBondContact O-OG1 3.45Å; E271-T274 VanDerWaalsContact O-OG1 3.11Å; E271-V275 WeakPolarHBondContact O-CB 3.39Å; E271-V275 WeakPolarHBondContact O-CG2 3.29Å; E271-V275 PolarHBondContact O-N 2.84Å
272	H	49	Very low	66	Low	128 Å²	128	116.4 Å²	116.4	59%	0.593	56%	0.562	S	S	*	*	H	α-helix	trans	-64.4	-34.9	174	-131.9	-81.1	0	0	0	112.5	A268 E270 E276	A268-H272 WeakPolarHBondContact O-CB 3.37Å; A268-H272 PolarHBondContact O-N 3.33Å; E270-H272 VanDerWaalsContact C-N 3.33Å; E270-H272 PolarHBondContact O-N 3.29Å; H272-E276 WeakPolarHBondContact O-CG 3.32Å; H272-E276 PolarHBondContact O-N 3.38Å
273	R	59.4	Low	65.6	Low	190 Å²	190	114.9 Å²	114.9	72%	0.717	56%	0.555	S	S	*	*	H	α-helix	trans	-77.5	-38.2	-178.6	-172.3	175.9	-176.6	170.6	1.2	112.8	Q269 E270 E271 V277	Q269-R273 WeakPolarHBondContact O-CB 3.19Å; Q269-R273 PolarHBondContact O-N 3.17Å; Q269-R273 VanDerWaalsContact O-N 3.13Å; E270-R273 PolarHBondContact O-N 2.82Å; E270-R273 VanDerWaalsContact O-N 3.08Å; E271-R273 VanDerWaalsContact C-N 3.3Å; E271-R273 PolarHBondContact O-N 3.31Å; R273-V277 WeakPolarHBondContact O-CG2 3.4Å; R273-V277 PolarHBondContact O-N 3.34Å
274	T	64.6	Low	65.3	Low	67 Å²	67	114.5 Å²	114.5	41%	0.411	55%	0.551	S	S	.	*	H	α-helix	trans	-66.6	-46.2	170.4	54.1	0	0	0	0	109.9	E270 E271 E276 V277 E278	E270-T274 PolarHBondContact O-N 3.16Å; E270-T274 PolarHBondContact O-OG1 3.08Å; E271-T274 PolarHBondContact O-OG1 3.45Å; E271-T274 VanDerWaalsContact O-OG1 3.11Å; T274-E276 PolarHBondContact O-N 2.84Å; T274-V277 PolarHBondContact O-N 2.98Å; T274-E278 VanDerWaalsContact O-CB 3.3Å; T274-E278 WeakPolarHBondContact O-CB 3.38Å; T274-E278 WeakPolarHBondContact O-CG 3.3Å; T274-E278 PolarHBondContact O-N 3.08Å
275	V	58.4	Low	65.1	Low	82 Å²	82	112.1 Å²	112.1	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-61.5	-37.3	178.1	170.1	0	0	0	0	112.4	E271 K279	E271-V275 WeakPolarHBondContact O-CB 3.39Å; E271-V275 WeakPolarHBondContact O-CG2 3.29Å; E271-V275 PolarHBondContact O-N 2.84Å; V275-K279 WeakPolarHBondContact O-CA 3.3Å; V275-K279 WeakPolarHBondContact O-CB 3.16Å; V275-K279 PolarHBondContact O-N 3.36Å
276	E	59.2	Low	64.8	Low	125 Å²	125	110.5 Å²	110.5	58%	0.584	54%	0.536	S	S	*	.	H	α-helix	trans	-68.1	-43.5	174.1	-79.1	-164.8	141	0	0	113.2	H272 T274 V280	H272-E276 WeakPolarHBondContact O-CG 3.32Å; H272-E276 PolarHBondContact O-N 3.38Å; T274-E276 PolarHBondContact O-N 2.84Å; E276-V280 WeakPolarHBondContact O-CB 3.45Å; E276-V280 WeakPolarHBondContact O-CG2 3.2Å; E276-V280 PolarHBondContact O-N 2.92Å
277	V	64.1	Low	64.9	Low	100 Å²	100	110.6 Å²	110.6	61%	0.606	53%	0.531	S	S	*	.	H	α-helix	trans	-67.4	-44.2	178.8	173.8	0	0	0	0	111.1	R273 T274 V280 H281	R273-V277 WeakPolarHBondContact O-CG2 3.4Å; R273-V277 PolarHBondContact O-N 3.34Å; T274-V277 PolarHBondContact O-N 2.98Å; V277-V280 PolarHBondContact O-N 2.88Å; V277-H281 VanDerWaalsContact O-CB 3.27Å; V277-H281 WeakPolarHBondContact O-CB 3.34Å; V277-H281 PolarHBondContact O-N 2.82Å
278	E	61.3	Low	65.1	Low	126 Å²	126	109 Å²	109	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-67.3	-41.3	175.8	-71.3	-175.7	-178.8	0	0	111.6	T274 V280 H281 L282	T274-E278 VanDerWaalsContact O-CB 3.3Å; T274-E278 WeakPolarHBondContact O-CB 3.38Å; T274-E278 WeakPolarHBondContact O-CG 3.3Å; T274-E278 PolarHBondContact O-N 3.08Å; E278-V280 PolarHBondContact O-N 3.37Å; E278-H281 PolarHBondContact O-N 3.31Å; E278-L282 WeakPolarHBondContact O-CA 3.36Å; E278-L282 WeakPolarHBondContact O-CB 3.47Å; E278-L282 PolarHBondContact O-N 2.9Å
279	K	63.5	Low	65.5	Low	130 Å²	130	111.2 Å²	111.2	57%	0.565	53%	0.531	S	S	*	.	H	α-helix	trans	-61.2	-45	174.7	179.2	-179.3	176.5	-174.5	0	111.5	V275 E283	V275-K279 WeakPolarHBondContact O-CA 3.3Å; V275-K279 WeakPolarHBondContact O-CB 3.16Å; V275-K279 PolarHBondContact O-N 3.36Å; K279-E283 HydrophobicContact CG-CG 4.3Å; K279-E283 WeakPolarHBondContact O-CA 3.44Å; K279-E283 WeakPolarHBondContact O-CB 3.21Å; K279-E283 VanDerWaalsContact O-CG 3.31Å; K279-E283 WeakPolarHBondContact O-CG 3.32Å; K279-E283 PolarHBondContact O-N 3.19Å
280	V	68.3	Low	66.1	Low	98 Å²	98	108.4 Å²	108.4	59%	0.594	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-38.9	177.9	171.8	0	0	0	0	111.4	E276 V277 E278 K284	E276-V280 WeakPolarHBondContact O-CB 3.45Å; E276-V280 WeakPolarHBondContact O-CG2 3.2Å; E276-V280 PolarHBondContact O-N 2.92Å; V277-V280 PolarHBondContact O-N 2.88Å; E278-V280 PolarHBondContact O-N 3.37Å; V280-K284 VanDerWaalsContact O-CB 3.28Å; V280-K284 WeakPolarHBondContact O-CB 2.83Å; V280-K284 PolarHBondContact O-N 3.45Å; V280-K284 VanDerWaalsContact O-N 3.09Å
281	H	75.9	Confident	66.6	Low	127 Å²	127	107.1 Å²	107.1	59%	0.588	52%	0.517	S	S	*	.	H	α-helix	trans	-65.9	-48.3	175.6	-178.4	79	0	0	0	112.1	V277 E278 K284 K285	V277-H281 VanDerWaalsContact O-CB 3.27Å; V277-H281 WeakPolarHBondContact O-CB 3.34Å; V277-H281 PolarHBondContact O-N 2.82Å; E278-H281 PolarHBondContact O-N 3.31Å; H281-K284 PolarHBondContact O-N 3.47Å; H281-K285 WeakPolarHBondContact O-CB 2.86Å; H281-K285 PolarHBondContact O-N 2.93Å
282	L	62.1	Low	67.5	Low	97 Å²	97	107.5 Å²	107.5	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-74.4	-37.5	-176.6	-161.3	75	0	0	0	111.7	E278 K284 K285 L286	E278-L282 WeakPolarHBondContact O-CA 3.36Å; E278-L282 WeakPolarHBondContact O-CB 3.47Å; E278-L282 PolarHBondContact O-N 2.9Å; L282-K284 VanDerWaalsContact C-N 3.32Å; L282-K284 PolarHBondContact O-N 3.03Å; L282-K285 PolarHBondContact O-N 3.22Å; L282-L286 HydrophobicContact CG-CD1 4.21Å; L282-L286 WeakPolarHBondContact O-CB 3.34Å; L282-L286 VanDerWaalsContact O-CG 3.23Å; L282-L286 WeakPolarHBondContact O-CG 3.19Å; L282-L286 PolarHBondContact O-N 3.24Å
283	E	69.9	Low	68.4	Low	75 Å²	75	104 Å²	104	35%	0.35	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-39.6	168.9	-84.4	-154.8	111.8	0	0	111.6	K279 R287	K279-E283 HydrophobicContact CG-CG 4.3Å; K279-E283 WeakPolarHBondContact O-CA 3.44Å; K279-E283 WeakPolarHBondContact O-CB 3.21Å; K279-E283 VanDerWaalsContact O-CG 3.31Å; K279-E283 WeakPolarHBondContact O-CG 3.32Å; K279-E283 PolarHBondContact O-N 3.19Å; E283-R287 VanDerWaalsContact O-CB 3.29Å; E283-R287 WeakPolarHBondContact O-CB 3.32Å; E283-R287 VanDerWaalsContact O-CG 3.29Å; E283-R287 WeakPolarHBondContact O-CG 3.36Å; E283-R287 PolarHBondContact O-N 3.13Å; E283-R287 IonicContact OE1-CZ 2.68Å; E283-R287 IonicContact OE1-NH1 2.72Å; E283-R287 PolarHBondContact OE1-NH1 3.41Å; E283-R287 IonicContact OE1-NH2 2.75Å; E283-R287 PolarHBondContact OE1-NH2 3.08Å; E283-R287 IonicContact OE2-CZ 2.87Å; E283-R287 IonicContact OE2-NH1 3.57Å; E283-R287 IonicContact OE2-NH2 4Å; E283-R287 PolarHBondContact OE2-NH2 3.3Å
284	K	73.3	Confident	68.9	Low	134 Å²	134	101.1 Å²	101.1	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-66.8	-48.7	177.6	-172.4	174.9	-178.8	-179.2	0	110.5	V280 H281 L282 L286 R287 D288	V280-K284 VanDerWaalsContact O-CB 3.28Å; V280-K284 WeakPolarHBondContact O-CB 2.83Å; V280-K284 PolarHBondContact O-N 3.45Å; V280-K284 VanDerWaalsContact O-N 3.09Å; H281-K284 PolarHBondContact O-N 3.47Å; L282-K284 VanDerWaalsContact C-N 3.32Å; L282-K284 PolarHBondContact O-N 3.03Å; K284-L286 PolarHBondContact O-N 2.85Å; K284-R287 PolarHBondContact O-N 3.49Å; K284-R287 VanDerWaalsContact O-N 3.12Å; K284-D288 PolarHBondContact O-N 2.81Å
285	K	74.4	Confident	69.2	Low	104 Å²	104	104.9 Å²	104.9	45%	0.452	52%	0.52	S	S	.	.	H	α-helix	trans	-56.9	-46.5	175	-176.7	173.9	174.4	179.8	0	111.9	H281 L282 D288 E289	H281-K285 WeakPolarHBondContact O-CB 2.86Å; H281-K285 PolarHBondContact O-N 2.93Å; L282-K285 PolarHBondContact O-N 3.22Å; K285-D288 PolarHBondContact O-N 3.25Å; K285-E289 WeakPolarHBondContact CE-OE1 3.34Å; K285-E289 HydrophobicContact CG-CG 4.47Å; K285-E289 WeakPolarHBondContact CG-OE1 3.26Å; K285-E289 IonicContact NZ-OE1 3.72Å; K285-E289 WeakPolarHBondContact O-CB 3.24Å; K285-E289 WeakPolarHBondContact O-CG 3.44Å; K285-E289 PolarHBondContact O-N 3.47Å
286	L	63.8	Low	69.5	Low	81 Å²	81	106.8 Å²	106.8	42%	0.424	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-38.5	174.6	-76.9	167.3	0	0	0	112.2	L282 K284 I290	L282-L286 HydrophobicContact CG-CD1 4.21Å; L282-L286 WeakPolarHBondContact O-CB 3.34Å; L282-L286 VanDerWaalsContact O-CG 3.23Å; L282-L286 WeakPolarHBondContact O-CG 3.19Å; L282-L286 PolarHBondContact O-N 3.24Å; K284-L286 PolarHBondContact O-N 2.85Å; L286-I290 HydrophobicContact CB-CD1 4.46Å; L286-I290 WeakPolarHBondContact O-CB 3.35Å; L286-I290 VanDerWaalsContact O-CD1 3.32Å; L286-I290 WeakPolarHBondContact O-CD1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.16Å; L286-I290 PolarHBondContact O-N 3.35Å
287	R	74.4	Confident	69.3	Low	126 Å²	126	103.5 Å²	103.5	48%	0.475	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-40.3	175	-80.8	-172.8	-88.2	-95.9	9.5	111.6	E283 K284 N291	E283-R287 VanDerWaalsContact O-CB 3.29Å; E283-R287 WeakPolarHBondContact O-CB 3.32Å; E283-R287 VanDerWaalsContact O-CG 3.29Å; E283-R287 WeakPolarHBondContact O-CG 3.36Å; E283-R287 PolarHBondContact O-N 3.13Å; E283-R287 IonicContact OE1-CZ 2.68Å; E283-R287 IonicContact OE1-NH1 2.72Å; E283-R287 PolarHBondContact OE1-NH1 3.41Å; E283-R287 IonicContact OE1-NH2 2.75Å; E283-R287 PolarHBondContact OE1-NH2 3.08Å; E283-R287 IonicContact OE2-CZ 2.87Å; E283-R287 IonicContact OE2-NH1 3.57Å; E283-R287 IonicContact OE2-NH2 4Å; E283-R287 PolarHBondContact OE2-NH2 3.3Å; K284-R287 PolarHBondContact O-N 3.49Å; K284-R287 VanDerWaalsContact O-N 3.12Å; R287-N291 WeakPolarHBondContact O-CB 3.36Å; R287-N291 PolarHBondContact O-N 2.79Å; R287-N291 PolarHBondContact O-ND2 3.45Å
288	D	77.1	Confident	69.2	Low	91 Å²	91	104.5 Å²	104.5	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-70	-44.4	177.7	-64.9	-25.6	0	0	0	111.3	K284 K285 N291 L292	K284-D288 PolarHBondContact O-N 2.81Å; K285-D288 PolarHBondContact O-N 3.25Å; D288-N291 PolarHBondContact O-N 2.92Å; D288-L292 PolarHBondContact O-N 3.37Å
289	E	75.6	Confident	69.2	Low	97 Å²	97	107.8 Å²	107.8	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-40.1	173.8	-73.9	173.2	-174.4	0	0	112.4	K285 N291 L292 A293	K285-E289 WeakPolarHBondContact CE-OE1 3.34Å; K285-E289 HydrophobicContact CG-CG 4.47Å; K285-E289 WeakPolarHBondContact CG-OE1 3.26Å; K285-E289 IonicContact NZ-OE1 3.72Å; K285-E289 WeakPolarHBondContact O-CB 3.24Å; K285-E289 WeakPolarHBondContact O-CG 3.44Å; K285-E289 PolarHBondContact O-N 3.47Å; E289-N291 VanDerWaalsContact C-N 3.33Å; E289-N291 PolarHBondContact O-N 2.93Å; E289-L292 PolarHBondContact O-N 2.94Å; E289-A293 WeakPolarHBondContact O-CB 3.13Å; E289-A293 PolarHBondContact O-N 2.82Å
290	I	70	Confident	68.7	Low	79 Å²	79	106.6 Å²	106.6	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-34.9	174.6	-74.3	165.4	0	0	0	111.2	L286 K294	L286-I290 HydrophobicContact CB-CD1 4.46Å; L286-I290 WeakPolarHBondContact O-CB 3.35Å; L286-I290 VanDerWaalsContact O-CD1 3.32Å; L286-I290 WeakPolarHBondContact O-CD1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.16Å; L286-I290 PolarHBondContact O-N 3.35Å; I290-K294 HydrophobicContact CG2-CD 3.88Å; I290-K294 HydrophobicContact CG2-CG 4.36Å; I290-K294 WeakPolarHBondContact O-CB 3.45Å; I290-K294 WeakPolarHBondContact O-CG 3.36Å; I290-K294 PolarHBondContact O-N 3.14Å
291	N	75.1	Confident	68	Low	94 Å²	94	109.3 Å²	109.3	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-71.3	-41.2	176.6	-74.5	-29	0	0	0	111.7	R287 D288 E289 K294 Q295	R287-N291 WeakPolarHBondContact O-CB 3.36Å; R287-N291 PolarHBondContact O-N 2.79Å; R287-N291 PolarHBondContact O-ND2 3.45Å; D288-N291 PolarHBondContact O-N 2.92Å; E289-N291 VanDerWaalsContact C-N 3.33Å; E289-N291 PolarHBondContact O-N 2.93Å; N291-K294 PolarHBondContact O-N 3.11Å; N291-Q295 PolarHBondContact O-N 3.27Å
292	L	77.7	Confident	67	Low	106 Å²	106	110.8 Å²	110.8	56%	0.555	53%	0.532	S	S	*	.	H	α-helix	trans	-63	-51.5	173.3	-175	65.9	0	0	0	111.2	D288 E289 K294 Q295 E296	D288-L292 PolarHBondContact O-N 3.37Å; E289-L292 PolarHBondContact O-N 2.94Å; L292-K294 VanDerWaalsContact C-N 3.27Å; L292-K294 PolarHBondContact O-N 2.9Å; L292-Q295 PolarHBondContact O-N 2.93Å; L292-E296 PolarHBondContact O-N 2.94Å
293	A	67.9	Low	66.6	Low	54 Å²	54	113.4 Å²	113.4	45%	0.446	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-29.8	177.7	0	0	0	0	0	112.5	E289 A297	E289-A293 WeakPolarHBondContact O-CB 3.13Å; E289-A293 PolarHBondContact O-N 2.82Å; A293-A297 WeakPolarHBondContact O-CB 3.28Å; A293-A297 PolarHBondContact O-N 2.87Å
294	K	71.2	Confident	65.9	Low	130 Å²	130	118.9 Å²	118.9	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-69.2	-40.9	170.2	-83.2	172	-180	172.8	0	112.2	I290 N291 L292 A297 Q298	I290-K294 HydrophobicContact CG2-CD 3.88Å; I290-K294 HydrophobicContact CG2-CG 4.36Å; I290-K294 WeakPolarHBondContact O-CB 3.45Å; I290-K294 WeakPolarHBondContact O-CG 3.36Å; I290-K294 PolarHBondContact O-N 3.14Å; N291-K294 PolarHBondContact O-N 3.11Å; L292-K294 VanDerWaalsContact C-N 3.27Å; L292-K294 PolarHBondContact O-N 2.9Å; K294-A297 PolarHBondContact O-N 3.05Å; K294-Q298 VanDerWaalsContact O-CB 3.29Å; K294-Q298 WeakPolarHBondContact O-CB 3.48Å; K294-Q298 PolarHBondContact O-N 3.42Å
295	Q	69.1	Low	65.1	Low	147 Å²	147	121.9 Å²	121.9	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-63.5	-43.4	174.6	-80.1	-172	-31	0	0	111.8	N291 L292 R299	N291-Q295 PolarHBondContact O-N 3.27Å; L292-Q295 PolarHBondContact O-N 2.93Å; Q295-R299 WeakPolarHBondContact O-CB 3.34Å; Q295-R299 PolarHBondContact O-N 2.97Å; Q295-R299 VanDerWaalsContact O-N 3.14Å
296	E	65.1	Low	64.3	Low	122 Å²	122	120.1 Å²	120.1	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-67.8	-41.7	174.9	-68.6	-163.5	120.8	0	0	112.5	L292 Q298 R299 L300	L292-E296 PolarHBondContact O-N 2.94Å; E296-Q298 PolarHBondContact O-N 2.72Å; E296-R299 PolarHBondContact O-N 3.31Å; E296-L300 WeakPolarHBondContact O-CB 3.33Å; E296-L300 PolarHBondContact O-N 2.71Å
297	A	56.2	Low	64	Low	55 Å²	55	120.9 Å²	120.9	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-65.3	-35.7	176.5	0	0	0	0	0	112.5	A293 K294 L300 K301	A293-A297 WeakPolarHBondContact O-CB 3.28Å; A293-A297 PolarHBondContact O-N 2.87Å; K294-A297 PolarHBondContact O-N 3.05Å; A297-L300 PolarHBondContact O-N 2.91Å; A297-K301 WeakPolarHBondContact O-CB 3.47Å; A297-K301 PolarHBondContact O-N 3.39Å
298	Q	61.4	Low	63.1	Low	121 Å²	121	122.4 Å²	122.4	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-61.9	-49.1	173.2	-156	94.4	-23.2	0	0	109.9	K294 E296 L300 K301 E302	K294-Q298 VanDerWaalsContact O-CB 3.29Å; K294-Q298 WeakPolarHBondContact O-CB 3.48Å; K294-Q298 PolarHBondContact O-N 3.42Å; E296-Q298 PolarHBondContact O-N 2.72Å; Q298-L300 VanDerWaalsContact C-N 3.35Å; Q298-L300 PolarHBondContact O-N 2.66Å; Q298-K301 WeakPolarHBondContact O-CB 3.41Å; Q298-K301 PolarHBondContact O-N 2.69Å; Q298-K301 VanDerWaalsContact O-N 3.16Å; Q298-E302 PolarHBondContact O-N 3.3Å; Q298-E302 VanDerWaalsContact O-N 3.1Å
299	R	61.1	Low	62.2	Low	196 Å²	196	124.9 Å²	124.9	74%	0.74	63%	0.625	S	S	*	*	H	α-helix	trans	-64.4	-33.1	178.8	-170.3	177.9	-174.2	169.2	2.6	113.7	Q295 E296	Q295-R299 WeakPolarHBondContact O-CB 3.34Å; Q295-R299 PolarHBondContact O-N 2.97Å; Q295-R299 VanDerWaalsContact O-N 3.14Å; E296-R299 PolarHBondContact O-N 3.31Å
300	L	52.3	Low	61.4	Low	104 Å²	104	127.2 Å²	127.2	55%	0.545	64%	0.636	S	S	.	*	H	α-helix	trans	-80.3	-25.2	174.2	-85.8	158.8	0	0	0	113.1	E296 A297 Q298 L303 R304	E296-L300 WeakPolarHBondContact O-CB 3.33Å; E296-L300 PolarHBondContact O-N 2.71Å; A297-L300 PolarHBondContact O-N 2.91Å; Q298-L300 VanDerWaalsContact C-N 3.35Å; Q298-L300 PolarHBondContact O-N 2.66Å; L300-L303 PolarHBondContact O-N 3.47Å; L300-R304 WeakPolarHBondContact O-CB 3.34Å
301	K	54.2	Low	60.8	Low	156 Å²	156	132.2 Å²	132.2	68%	0.678	65%	0.649	S	S	*	*	H	α-helix	trans	-74.8	-39.2	177.1	-176	-179.8	179.5	-171.2	0	111.6	A297 Q298 L303 R304	A297-K301 WeakPolarHBondContact O-CB 3.47Å; A297-K301 PolarHBondContact O-N 3.39Å; Q298-K301 WeakPolarHBondContact O-CB 3.41Å; Q298-K301 PolarHBondContact O-N 2.69Å; Q298-K301 VanDerWaalsContact O-N 3.16Å; K301-L303 PolarHBondContact O-N 2.8Å; K301-R304 PolarHBondContact O-N 3.29Å; K301-R304 VanDerWaalsContact O-N 3.13Å
302	E	54.4	Low	60.1	Low	157 Å²	157	131 Å²	131	73%	0.734	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-24	170.9	-71.3	171.7	-179.5	0	0	112.8	Q298	Q298-E302 PolarHBondContact O-N 3.3Å; Q298-E302 VanDerWaalsContact O-N 3.1Å
303	L	55	Low	59.7	Low	152 Å²	152	136 Å²	136	80%	0.796	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	0.9	176.5	-123.8	79.1	0	0	0	114.6	L300 K301	L300-L303 PolarHBondContact O-N 3.47Å; K301-L303 PolarHBondContact O-N 2.8Å
304	R	55.4	Low	59.4	Low	190 Å²	190	139.7 Å²	139.7	72%	0.717	67%	0.668	S	S	*	*			trans	-140.2	30.4	-165.2	-145.6	169.6	-169.4	150.7	1.5	115.4	L300 K301 G306	L300-R304 WeakPolarHBondContact O-CB 3.34Å; K301-R304 PolarHBondContact O-N 3.29Å; K301-R304 VanDerWaalsContact O-N 3.13Å; R304-G306 PolarHBondContact O-N 2.8Å
305	E	54.8	Low	59.3	Low	198 Å²	198	139 Å²	139	93%	0.925	67%	0.665	S	S	*	*			trans	-71.9	74	163.1	-171.7	165.3	-118.6	0	0	109.7
306	G	57.8	Low	59.6	Low	66 Å²	66	138.9 Å²	138.9	68%	0.68	66%	0.659	S	S	*	*			trans	-175.5	17.1	-168.5	0	0	0	0	0	121.1	R304	R304-G306 PolarHBondContact O-N 2.8Å
307	T	57.9	Low	60.1	Low	97 Å²	97	135.8 Å²	135.8	60%	0.595	65%	0.654	S	S	*	*			trans	-153.3	86.7	166.8	40.9	0	0	0	0	111.8
308	E	56.8	Low	61	Low	158 Å²	158	139.2 Å²	139.2	74%	0.738	66%	0.661	S	S	*	*			trans	-83.2	-27.2	-177.7	-161.6	162.5	-159.1	0	0	113.4	E310 R311	E308-E310 PolarHBondContact O-N 2.95Å; E308-R311 WeakPolarHBondContact O-CB 3.37Å; E308-R311 PolarHBondContact O-N 3.32Å
309	N	57.1	Low	61.9	Low	143 Å²	143	139.1 Å²	139.1	77%	0.765	66%	0.66	S	S	*	*	H	α-helix	trans	-72.1	-26.8	-165.4	-69	-19.7	0	0	0	116.5
310	E	59	Low	62.9	Low	147 Å²	147	133.9 Å²	133.9	69%	0.687	64%	0.644	S	S	*	*	H	α-helix	trans	-74	-31.7	174.8	-68.5	-171.7	121.3	0	0	111.8	E308 S312 R313 Q314	E308-E310 PolarHBondContact O-N 2.95Å; E310-S312 VanDerWaalsContact C-N 3.32Å; E310-S312 PolarHBondContact O-N 2.99Å; E310-R313 PolarHBondContact O-N 3.5Å; E310-Q314 PolarHBondContact O-N 3.24Å; E310-Q314 VanDerWaalsContact O-N 3.15Å
311	R	57	Low	64.1	Low	183 Å²	183	133.3 Å²	133.3	69%	0.691	64%	0.641	S	S	*	*	H	α-helix	trans	-66.2	-35.6	-177.3	-157.5	174.9	-161.6	140.2	8.7	112.1	E308 R313 K315	E308-R311 WeakPolarHBondContact O-CB 3.37Å; E308-R311 PolarHBondContact O-N 3.32Å; R311-R313 VanDerWaalsContact C-N 3.35Å; R311-K315 PolarHBondContact O-N 3.43Å
312	S	61.3	Low	65.4	Low	69 Å²	69	131.1 Å²	131.1	48%	0.483	63%	0.633	S	S	.	*	H	α-helix	trans	-62.9	-39.8	174.6	-48.1	0	0	0	0	112.3	E310 Y316	E310-S312 VanDerWaalsContact C-N 3.32Å; E310-S312 PolarHBondContact O-N 2.99Å; S312-Y316 PolarHBondContact O-N 3.47Å; S312-Y316 VanDerWaalsContact O-N 3.13Å
313	R	68.6	Low	67.1	Low	212 Å²	212	130 Å²	130	80%	0.8	63%	0.628	S	S	*	*	H	α-helix	trans	-74	-35.4	-179.1	-175.3	178.1	173.2	-159.2	-2.7	112.4	E310 R311 A317	E310-R313 PolarHBondContact O-N 3.5Å; R311-R313 VanDerWaalsContact C-N 3.35Å; R313-A317 PolarHBondContact O-N 2.93Å
314	Q	61.6	Low	68.6	Low	130 Å²	130	127.1 Å²	127.1	61%	0.607	62%	0.617	S	S	*	*	H	α-helix	trans	-67.4	-46.2	172.7	-74.2	179.7	-27.4	0	0	111.3	E310 Y316 A317 E318	E310-Q314 PolarHBondContact O-N 3.24Å; E310-Q314 VanDerWaalsContact O-N 3.15Å; Q314-Y316 VanDerWaalsContact C-N 3.35Å; Q314-Y316 PolarHBondContact O-N 3.49Å; Q314-A317 PolarHBondContact O-N 2.91Å; Q314-A317 VanDerWaalsContact O-N 3.11Å; Q314-E318 WeakPolarHBondContact O-CG 3.23Å; Q314-E318 PolarHBondContact O-N 2.73Å
315	K	69.6	Low	70.1	Confident	116 Å²	116	124.5 Å²	124.5	50%	0.504	61%	0.607	S	S	.	*	H	α-helix	trans	-53.4	-48	174	-86	-170.4	161.9	-156.1	0	113.3	R311 A317 E318 E319	R311-K315 PolarHBondContact O-N 3.43Å; K315-A317 VanDerWaalsContact C-N 3.29Å; K315-A317 PolarHBondContact O-N 2.98Å; K315-E318 PolarHBondContact O-N 2.7Å; K315-E318 VanDerWaalsContact O-N 3.11Å; K315-E319 WeakPolarHBondContact O-CB 3.07Å; K315-E319 WeakPolarHBondContact O-CG 3.31Å; K315-E319 PolarHBondContact O-N 3.32Å
316	Y	74.3	Confident	71.8	Confident	145 Å²	145	122.1 Å²	122.1	57%	0.569	60%	0.596	S	S	*	*	H	α-helix	trans	-59.6	-41	179	-170.6	-86.1	0	0	0	111.9	S312 Q314 E319 E320	S312-Y316 PolarHBondContact O-N 3.47Å; S312-Y316 VanDerWaalsContact O-N 3.13Å; Q314-Y316 VanDerWaalsContact C-N 3.35Å; Q314-Y316 PolarHBondContact O-N 3.49Å; Y316-E319 PolarHBondContact O-N 3.33Å; Y316-E320 HydrophobicContact CD1-CG 3.92Å; Y316-E320 HydrophobicContact CE1-CG 3.47Å; Y316-E320 VanDerWaalsContact CE1-CG 3.47Å; Y316-E320 WeakPolarHBondContact CE1-OE1 3.19Å; Y316-E320 VanDerWaalsContact O-CG 3.26Å; Y316-E320 WeakPolarHBondContact O-CG 3.49Å; Y316-E320 PolarHBondContact O-N 2.77Å; Y316-E320 PolarHBondContact OH-OE1 2.95Å
317	A	75.4	Confident	73.3	Confident	56 Å²	56	121.9 Å²	121.9	46%	0.463	59%	0.587	S	S	.	*	H	α-helix	trans	-69.7	-30.3	176.1	0	0	0	0	0	113.4	R313 Q314 K315 L321	R313-A317 PolarHBondContact O-N 2.93Å; Q314-A317 PolarHBondContact O-N 2.91Å; Q314-A317 VanDerWaalsContact O-N 3.11Å; K315-A317 VanDerWaalsContact C-N 3.29Å; K315-A317 PolarHBondContact O-N 2.98Å; A317-L321 WeakPolarHBondContact O-CB 2.92Å; A317-L321 PolarHBondContact O-N 3.36Å; A317-L321 VanDerWaalsContact O-N 3.16Å
318	E	75.1	Confident	74.6	Confident	128 Å²	128	122.2 Å²	122.2	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-71.8	-41.1	172.5	-70.6	175.3	149.3	0	0	111.7	Q314 K315 L321 E322	Q314-E318 WeakPolarHBondContact O-CG 3.23Å; Q314-E318 PolarHBondContact O-N 2.73Å; K315-E318 PolarHBondContact O-N 2.7Å; K315-E318 VanDerWaalsContact O-N 3.11Å; E318-L321 PolarHBondContact O-N 3.09Å; E318-E322 PolarHBondContact O-N 3.5Å
319	E	81	Confident	76	Confident	118 Å²	118	123.7 Å²	123.7	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-65.5	-42.6	177.2	-73.5	167.1	-176.7	0	0	111.7	K315 Y316 E322 Q323	K315-E319 WeakPolarHBondContact O-CB 3.07Å; K315-E319 WeakPolarHBondContact O-CG 3.31Å; K315-E319 PolarHBondContact O-N 3.32Å; Y316-E319 PolarHBondContact O-N 3.33Å; E319-E322 PolarHBondContact O-N 3Å; E319-Q323 WeakPolarHBondContact O-CB 3.48Å; E319-Q323 PolarHBondContact O-N 2.96Å
320	E	82.5	Confident	77.5	Confident	87 Å²	87	123.4 Å²	123.4	41%	0.407	58%	0.575	S	S	.	*	H	α-helix	trans	-60.7	-42.5	170.2	-70.8	-90.8	165.4	0	0	111.8	Y316 Q323 V324	Y316-E320 HydrophobicContact CD1-CG 3.92Å; Y316-E320 HydrophobicContact CE1-CG 3.47Å; Y316-E320 VanDerWaalsContact CE1-CG 3.47Å; Y316-E320 WeakPolarHBondContact CE1-OE1 3.19Å; Y316-E320 VanDerWaalsContact O-CG 3.26Å; Y316-E320 WeakPolarHBondContact O-CG 3.49Å; Y316-E320 PolarHBondContact O-N 2.77Å; Y316-E320 PolarHBondContact OH-OE1 2.95Å; E320-Q323 PolarHBondContact O-N 3.32Å; E320-V324 WeakPolarHBondContact O-CG2 3.12Å; E320-V324 PolarHBondContact O-N 3.49Å
321	L	77.5	Confident	78.6	Confident	91 Å²	91	119 Å²	119	48%	0.476	56%	0.564	S	S	.	*	H	α-helix	trans	-64.9	-39.8	178.2	-116	168.6	0	0	0	112.5	A317 E318 V324 R325	A317-L321 WeakPolarHBondContact O-CB 2.92Å; A317-L321 PolarHBondContact O-N 3.36Å; A317-L321 VanDerWaalsContact O-N 3.16Å; E318-L321 PolarHBondContact O-N 3.09Å; L321-V324 PolarHBondContact O-N 2.83Å; L321-R325 VanDerWaalsContact O-CG 3.28Å; L321-R325 WeakPolarHBondContact O-CG 3.48Å; L321-R325 PolarHBondContact O-N 3.28Å
322	E	82.3	Confident	79.7	Confident	110 Å²	110	115.1 Å²	115.1	51%	0.514	55%	0.553	S	S	.	*	H	α-helix	trans	-69.9	-37.7	177.5	-154.9	66	-176	0	0	111.2	E318 E319 R325 E326	E318-E322 PolarHBondContact O-N 3.5Å; E319-E322 PolarHBondContact O-N 3Å; E322-R325 WeakPolarHBondContact O-CB 3.42Å; E322-R325 PolarHBondContact O-N 2.89Å; E322-R325 VanDerWaalsContact OE2-CD 3.31Å; E322-R325 WeakPolarHBondContact OE2-CD 3.46Å; E322-R325 IonicContact OE2-CZ 2.73Å; E322-R325 IonicContact OE2-NE 2.7Å; E322-R325 IonicContact OE2-NH1 2.69Å; E322-R325 PolarHBondContact OE2-NH1 2.78Å; E322-E326 PolarHBondContact O-N 3.48Å
323	Q	89.5	Confident	80.6	Confident	135 Å²	135	119 Å²	119	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-64.9	-39.5	173.6	-165.5	173.1	114.7	0	0	112.2	E319 E320 E326 A327	E319-Q323 WeakPolarHBondContact O-CB 3.48Å; E319-Q323 PolarHBondContact O-N 2.96Å; E320-Q323 PolarHBondContact O-N 3.32Å; Q323-E326 PolarHBondContact O-N 2.88Å; Q323-A327 WeakPolarHBondContact O-CB 3.45Å; Q323-A327 PolarHBondContact O-N 2.78Å
324	V	87.2	Confident	81	Confident	90 Å²	90	113.6 Å²	113.6	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-66.5	-38.2	172.7	169.7	0	0	0	0	111.7	E320 L321 A327 L328	E320-V324 WeakPolarHBondContact O-CG2 3.12Å; E320-V324 PolarHBondContact O-N 3.49Å; L321-V324 PolarHBondContact O-N 2.83Å; V324-A327 PolarHBondContact O-N 2.73Å; V324-L328 WeakPolarHBondContact O-CB 3.46Å; V324-L328 PolarHBondContact O-N 2.85Å
325	R	86.6	Confident	81.6	Confident	135 Å²	135	113.2 Å²	113.2	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-42.9	173.6	-74.3	165.4	-178.2	152.2	3.7	112.1	L321 E322 L328 R329	L321-R325 VanDerWaalsContact O-CG 3.28Å; L321-R325 WeakPolarHBondContact O-CG 3.48Å; L321-R325 PolarHBondContact O-N 3.28Å; E322-R325 WeakPolarHBondContact O-CB 3.42Å; E322-R325 PolarHBondContact O-N 2.89Å; E322-R325 VanDerWaalsContact OE2-CD 3.31Å; E322-R325 WeakPolarHBondContact OE2-CD 3.46Å; E322-R325 IonicContact OE2-CZ 2.73Å; E322-R325 IonicContact OE2-NE 2.7Å; E322-R325 IonicContact OE2-NH1 2.69Å; E322-R325 PolarHBondContact OE2-NH1 2.78Å; R325-L328 PolarHBondContact O-N 3.44Å; R325-R329 VanDerWaalsContact O-CB 3.25Å; R325-R329 WeakPolarHBondContact O-CB 3.47Å; R325-R329 PolarHBondContact O-N 3.31Å
326	E	90.2	Very high	81.6	Confident	149 Å²	149	114.3 Å²	114.3	70%	0.696	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-39.2	177.2	-171.9	165.2	-139.7	0	0	111.5	E322 Q323 R329 K330	E322-E326 PolarHBondContact O-N 3.48Å; Q323-E326 PolarHBondContact O-N 2.88Å; E326-R329 PolarHBondContact O-N 2.71Å; E326-K330 VanDerWaalsContact O-CB 3.28Å; E326-K330 WeakPolarHBondContact O-CB 3.4Å; E326-K330 PolarHBondContact O-N 3.12Å
327	A	88.4	Confident	81.1	Confident	60 Å²	60	111 Å²	111	50%	0.496	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-43.4	172.6	0	0	0	0	0	112.6	Q323 V324 K330 A331	Q323-A327 WeakPolarHBondContact O-CB 3.45Å; Q323-A327 PolarHBondContact O-N 2.78Å; V324-A327 PolarHBondContact O-N 2.73Å; A327-K330 PolarHBondContact O-N 3.48Å; A327-A331 WeakPolarHBondContact O-CB 3.24Å; A327-A331 PolarHBondContact O-N 2.8Å
328	L	86.2	Confident	80.3	Confident	104 Å²	104	115.2 Å²	115.2	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-49	175.3	179.9	63.8	0	0	0	111.1	V324 R325 K330 A331 E332	V324-L328 WeakPolarHBondContact O-CB 3.46Å; V324-L328 PolarHBondContact O-N 2.85Å; R325-L328 PolarHBondContact O-N 3.44Å; L328-K330 PolarHBondContact O-N 2.95Å; L328-A331 CarbonylContact O-C 3.55Å; L328-A331 WeakPolarHBondContact O-CA 3.49Å; L328-A331 WeakPolarHBondContact O-CB 3.46Å; L328-A331 PolarHBondContact O-N 2.86Å; L328-E332 WeakPolarHBondContact O-CG 3.29Å; L328-E332 PolarHBondContact O-N 3.19Å
329	R	85.4	Confident	79.3	Confident	190 Å²	190	112.9 Å²	112.9	72%	0.717	56%	0.56	S	S	*	*	H	α-helix	trans	-63	-31.5	178.8	-162.7	-174.9	-143.7	157.4	7.5	112.6	R325 E326 K333	R325-R329 VanDerWaalsContact O-CB 3.25Å; R325-R329 WeakPolarHBondContact O-CB 3.47Å; R325-R329 PolarHBondContact O-N 3.31Å; E326-R329 PolarHBondContact O-N 2.71Å; R329-K333 WeakPolarHBondContact O-CB 3.29Å; R329-K333 PolarHBondContact O-N 2.95Å; R329-K333 VanDerWaalsContact O-N 3.13Å
330	K	88.3	Confident	78.3	Confident	137 Å²	137	111.9 Å²	111.9	60%	0.596	57%	0.566	S	S	*	*	H	α-helix	trans	-68.1	-47.3	170	-175.2	-174.1	171.6	-167.5	0	110.7	E326 A327 L328 E332 K333 E334	E326-K330 VanDerWaalsContact O-CB 3.28Å; E326-K330 WeakPolarHBondContact O-CB 3.4Å; E326-K330 PolarHBondContact O-N 3.12Å; A327-K330 PolarHBondContact O-N 3.48Å; L328-K330 PolarHBondContact O-N 2.95Å; K330-E332 PolarHBondContact O-N 3.06Å; K330-K333 PolarHBondContact O-N 2.86Å; K330-E334 VanDerWaalsContact O-CB 3.23Å; K330-E334 WeakPolarHBondContact O-CB 3.26Å; K330-E334 PolarHBondContact O-N 3.49Å
331	A	82.4	Confident	77.7	Confident	53 Å²	53	116.1 Å²	116.1	44%	0.438	58%	0.578	S	S	.	*	H	α-helix	trans	-63.4	-38.2	178.2	0	0	0	0	0	112.8	A327 L328 E334 L335	A327-A331 WeakPolarHBondContact O-CB 3.24Å; A327-A331 PolarHBondContact O-N 2.8Å; L328-A331 CarbonylContact O-C 3.55Å; L328-A331 WeakPolarHBondContact O-CA 3.49Å; L328-A331 WeakPolarHBondContact O-CB 3.46Å; L328-A331 PolarHBondContact O-N 2.86Å; A331-E334 PolarHBondContact O-N 3.46Å; A331-L335 VanDerWaalsContact O-CB 3.22Å; A331-L335 WeakPolarHBondContact O-CB 3.15Å; A331-L335 PolarHBondContact O-N 3.33Å
332	E	80.6	Confident	77.5	Confident	102 Å²	102	120.1 Å²	120.1	48%	0.477	59%	0.588	S	S	.	*	H	α-helix	trans	-59.9	-51.3	170.9	-72.4	173.4	152.8	0	0	110.7	L328 K330 E334 L335 E336	L328-E332 WeakPolarHBondContact O-CG 3.29Å; L328-E332 PolarHBondContact O-N 3.19Å; K330-E332 PolarHBondContact O-N 3.06Å; E332-E334 VanDerWaalsContact C-N 3.32Å; E332-E334 PolarHBondContact O-N 3.43Å; E332-L335 WeakPolarHBondContact O-CB 3.44Å; E332-L335 PolarHBondContact O-N 3.5Å; E332-E336 WeakPolarHBondContact O-CG 3.09Å; E332-E336 PolarHBondContact O-N 3.02Å
333	K	79.3	Confident	77.5	Confident	152 Å²	152	115.1 Å²	115.1	66%	0.661	57%	0.566	S	S	*	*	H	α-helix	trans	-65.4	-33.6	179.1	-172.9	175.8	-178.3	179.5	0	113.3	R329 K330 S337	R329-K333 WeakPolarHBondContact O-CB 3.29Å; R329-K333 PolarHBondContact O-N 2.95Å; R329-K333 VanDerWaalsContact O-N 3.13Å; K330-K333 PolarHBondContact O-N 2.86Å; K333-S337 WeakPolarHBondContact O-CB 3.38Å; K333-S337 PolarHBondContact O-N 2.97Å
334	E	78.4	Confident	77.4	Confident	97 Å²	97	112.3 Å²	112.3	45%	0.453	56%	0.559	S	S	.	*	H	α-helix	trans	-69.7	-43.4	175.1	-164.3	161.6	165.4	0	0	109.7	K330 A331 E332 S337 H338	K330-E334 VanDerWaalsContact O-CB 3.23Å; K330-E334 WeakPolarHBondContact O-CB 3.26Å; K330-E334 PolarHBondContact O-N 3.49Å; A331-E334 PolarHBondContact O-N 3.46Å; E332-E334 VanDerWaalsContact C-N 3.32Å; E332-E334 PolarHBondContact O-N 3.43Å; E334-S337 PolarHBondContact O-N 2.93Å; E334-S337 PolarHBondContact O-OG 3.35Å; E334-H338 PolarHBondContact O-CD2 2.74Å; E334-H338 PolarHBondContact O-N 2.96Å
335	L	73	Confident	77.2	Confident	122 Å²	122	114.4 Å²	114.4	64%	0.639	56%	0.563	S	S	*	*	H	α-helix	trans	-62.7	-44.3	172.5	-176.8	63.8	0	0	0	112.5	A331 E332 S337 H338 S339	A331-L335 VanDerWaalsContact O-CB 3.22Å; A331-L335 WeakPolarHBondContact O-CB 3.15Å; A331-L335 PolarHBondContact O-N 3.33Å; E332-L335 WeakPolarHBondContact O-CB 3.44Å; E332-L335 PolarHBondContact O-N 3.5Å; L335-S337 VanDerWaalsContact C-N 3.3Å; L335-S337 PolarHBondContact O-N 3.49Å; L335-H338 CarbonylContact O-C 3.44Å; L335-H338 WeakPolarHBondContact O-CA 3.17Å; L335-H338 PolarHBondContact O-N 3.4Å; L335-H338 VanDerWaalsContact O-N 3.08Å; L335-S339 WeakPolarHBondContact O-CB 3.32Å; L335-S339 PolarHBondContact O-N 3.44Å
336	E	70.1	Confident	77.3	Confident	139 Å²	139	110.7 Å²	110.7	65%	0.65	56%	0.561	S	S	*	*	H	α-helix	trans	-60.7	-38.3	173.5	-75.3	-178.7	158	0	0	111.9	E332 H338 S339	E332-E336 WeakPolarHBondContact O-CG 3.09Å; E332-E336 PolarHBondContact O-N 3.02Å; E336-H338 VanDerWaalsContact C-N 3.25Å; E336-H338 PolarHBondContact O-N 3.45Å; E336-S339 WeakPolarHBondContact CA-OG 3.05Å; E336-S339 PolarHBondContact O-N 2.95Å; E336-S339 PolarHBondContact O-OG 3.05Å; E336-S339 VanDerWaalsContact O-OG 3.14Å
337	S	64.5	Low	77.4	Confident	77 Å²	77	106.7 Å²	106.7	54%	0.538	54%	0.544	S	S	.	.	H	α-helix	trans	-69.5	-22.9	175.1	79.7	0	0	0	0	113.4	K333 E334 L335	K333-S337 WeakPolarHBondContact O-CB 3.38Å; K333-S337 PolarHBondContact O-N 2.97Å; E334-S337 PolarHBondContact O-N 2.93Å; E334-S337 PolarHBondContact O-OG 3.35Å; L335-S337 VanDerWaalsContact C-N 3.3Å; L335-S337 PolarHBondContact O-N 3.49Å
338	H	58.1	Low	77.7	Confident	143 Å²	143	106 Å²	106	66%	0.662	53%	0.531	S	S	*	.	H	α-helix	trans	-93.1	-16	173.2	-72.5	-53.2	0	0	0	113.6	E334 L335 E336 S340	E334-H338 PolarHBondContact O-CD2 2.74Å; E334-H338 PolarHBondContact O-N 2.96Å; L335-H338 CarbonylContact O-C 3.44Å; L335-H338 WeakPolarHBondContact O-CA 3.17Å; L335-H338 PolarHBondContact O-N 3.4Å; L335-H338 VanDerWaalsContact O-N 3.08Å; E336-H338 VanDerWaalsContact C-N 3.25Å; E336-H338 PolarHBondContact O-N 3.45Å; H338-S340 PolarHBondContact O-N 3.49Å
339	S	53.4	Low	78	Confident	80 Å²	80	104.6 Å²	104.6	56%	0.559	52%	0.52	S	S	*	.			trans	-85.2	15.8	-177	73.5	0	0	0	0	114.3	L335 E336 W341	L335-S339 WeakPolarHBondContact O-CB 3.32Å; L335-S339 PolarHBondContact O-N 3.44Å; E336-S339 WeakPolarHBondContact CA-OG 3.05Å; E336-S339 PolarHBondContact O-N 2.95Å; E336-S339 PolarHBondContact O-OG 3.05Å; E336-S339 VanDerWaalsContact O-OG 3.14Å; S339-W341 PolarHBondContact O-N 2.97Å
340	S	59.9	Low	78.5	Confident	96 Å²	96	101.5 Å²	101.5	67%	0.671	51%	0.509	S	S	*	.			trans	-72.7	69.4	169.1	65.9	0	0	0	0	110.6	H338 Y342	H338-S340 PolarHBondContact O-N 3.49Å; S340-Y342 PolarHBondContact O-N 3.25Å; S340-Y342 VanDerWaalsContact O-N 3.14Å
341	W	70.2	Confident	78.8	Confident	176 Å²	176	96.4 Å²	96.4	67%	0.667	49%	0.488	S	S	*	.			trans	-62.8	115.3	175.8	-178.4	84	0	0	0	109.8	S339 A343	S339-W341 PolarHBondContact O-N 2.97Å; W341-A343 HydrophobicContact CH2-CB 3.8Å; W341-A343 HydrophobicContact CZ2-CB 4.34Å; W341-A343 HydrophobicContact CZ3-CB 4.1Å
342	Y	73.9	Confident	79.5	Confident	176 Å²	176	94.7 Å²	94.7	69%	0.69	47%	0.471	S	S	*	.			trans	-112.7	131.2	173.8	-151.2	-84.1	0	0	0	109	S340 P344	S340-Y342 PolarHBondContact O-N 3.25Å; S340-Y342 VanDerWaalsContact O-N 3.14Å; Y342-P344 WeakPolarHBondContact O-CD 3.05Å
343	A	82.3	Confident	80.1	Confident	5 Å²	5	90.3 Å²	90.3	4%	0.041	45%	0.451	C	S	.	.			trans	-66.6	124.8	-177.9	0	0	0	0	0	110.4	W341 L347 C437 F439	W341-A343 HydrophobicContact CH2-CB 3.8Å; W341-A343 HydrophobicContact CZ2-CB 4.34Å; W341-A343 HydrophobicContact CZ3-CB 4.1Å; A343-L347 HydrophobicContact CB-CD2 4.41Å; A343-C437 HydrophobicContact CB-CB 3.9Å; A343-F439 HydrophobicContact CB-CD1 4.22Å; A343-F439 HydrophobicContact CB-CE1 3.4Å; A343-F439 VanDerWaalsContact CB-CE1 3.4Å; A343-F439 HydrophobicContact CB-CZ 3.97Å
344	P	87.1	Confident	80.9	Confident	75 Å²	75	86.6 Å²	86.6	49%	0.487	44%	0.441	S	S	.	.			trans	-63.6	145.9	-174.7	-25.3	34.7	0	0	0	113.9	Y342 A346 L347 Q348	Y342-P344 WeakPolarHBondContact O-CD 3.05Å; P344-A346 PolarHBondContact O-N 2.63Å; P344-A346 VanDerWaalsContact O-N 3.1Å; P344-L347 WeakPolarHBondContact O-CA 3.17Å; P344-L347 VanDerWaalsContact O-CB 3.27Å; P344-L347 WeakPolarHBondContact O-CB 3.49Å; P344-L347 PolarHBondContact O-N 2.69Å; P344-Q348 PolarHBondContact O-N 3.03Å
345	E	83.4	Confident	81.8	Confident	134 Å²	134	82.7 Å²	82.7	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-56.5	-30.6	176.9	-68.4	-167.8	-175.9	0	0	114.1	L347 Q348 K349	E345-L347 VanDerWaalsContact C-N 3.29Å; E345-L347 PolarHBondContact O-N 3.06Å; E345-Q348 WeakPolarHBondContact O-CB 3.44Å; E345-Q348 PolarHBondContact O-N 3.42Å; E345-K349 PolarHBondContact O-N 2.76Å; E345-K349 IonicContact OE2-NZ 2.63Å; E345-K349 PolarHBondContact OE2-NZ 2.78Å
346	A	89	Confident	82.8	Confident	58 Å²	58	78.3 Å²	78.3	48%	0.479	40%	0.399	S	S	.	.	H	α-helix	trans	-62.2	-40.2	174.4	0	0	0	0	0	111.1	P344 K349 W350	P344-A346 PolarHBondContact O-N 2.63Å; P344-A346 VanDerWaalsContact O-N 3.1Å; A346-K349 PolarHBondContact O-N 2.86Å; A346-W350 PolarHBondContact O-N 2.82Å; A346-W350 VanDerWaalsContact O-N 3.14Å
347	L	92.3	Very high	84	Confident	64 Å²	64	74 Å²	74	34%	0.335	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-37.6	176.2	-177.9	61.5	0	0	0	111.2	A343 P344 E345 K349 W350 L351	A343-L347 HydrophobicContact CB-CD2 4.41Å; P344-L347 WeakPolarHBondContact O-CA 3.17Å; P344-L347 VanDerWaalsContact O-CB 3.27Å; P344-L347 WeakPolarHBondContact O-CB 3.49Å; P344-L347 PolarHBondContact O-N 2.69Å; E345-L347 VanDerWaalsContact C-N 3.29Å; E345-L347 PolarHBondContact O-N 3.06Å; L347-K349 PolarHBondContact O-N 3.48Å; L347-W350 PolarHBondContact O-N 2.72Å; L347-L351 HydrophobicContact CD1-CD1 4.1Å; L347-L351 HydrophobicContact CD1-CG 3.99Å; L347-L351 HydrophobicContact CD2-CD1 4.45Å; L347-L351 HydrophobicContact CG-CD1 3.83Å; L347-L351 HydrophobicContact CG-CG 4.19Å; L347-L351 WeakPolarHBondContact O-CB 3.45Å; L347-L351 VanDerWaalsContact O-CG 3.29Å; L347-L351 WeakPolarHBondContact O-CG 3.32Å; L347-L351 PolarHBondContact O-N 3.42Å
348	Q	93.8	Very high	85.4	Confident	47 Å²	47	72.5 Å²	72.5	22%	0.22	37%	0.366	C	S	.	.	H	α-helix	trans	-56	-50.8	173.3	-175.5	178.5	20	0	0	111.7	P344 E345 W350 L351 Q352 F439 Q440	P344-Q348 PolarHBondContact O-N 3.03Å; E345-Q348 WeakPolarHBondContact O-CB 3.44Å; E345-Q348 PolarHBondContact O-N 3.42Å; Q348-W350 VanDerWaalsContact C-N 3.34Å; Q348-W350 PolarHBondContact O-N 2.99Å; Q348-L351 PolarHBondContact O-N 3.49Å; Q348-Q352 HydrophobicContact CG-CG 4.37Å; Q348-Q352 WeakPolarHBondContact O-CB 3.5Å; Q348-Q352 VanDerWaalsContact O-CG 3.28Å; Q348-Q352 WeakPolarHBondContact O-CG 3.39Å; Q348-Q352 PolarHBondContact O-N 2.81Å; Q348-F439 HydrophobicContact CB-CD1 3.98Å; Q348-F439 HydrophobicContact CB-CD2 3.9Å; Q348-F439 HydrophobicContact CB-CE1 3.69Å; Q348-F439 HydrophobicContact CB-CE2 3.65Å; Q348-F439 HydrophobicContact CB-CG 4.09Å; Q348-F439 HydrophobicContact CB-CZ 3.54Å; Q348-F439 HydrophobicContact CG-CB 4.47Å; Q348-F439 HydrophobicContact CG-CD1 4.27Å; Q348-F439 HydrophobicContact CG-CD2 3.56Å; Q348-F439 HydrophobicContact CG-CE1 4.38Å; Q348-F439 HydrophobicContact CG-CE2 3.74Å; Q348-F439 HydrophobicContact CG-CG 3.87Å; Q348-F439 HydrophobicContact CG-CZ 4.16Å; Q348-Q440 PolarHBondContact NE2-O 2.8Å
349	K	93.2	Very high	87.2	Confident	73 Å²	73	66.8 Å²	66.8	32%	0.317	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-40.7	-178	-66.7	161	-170.4	159.7	0	111.4	E345 A346 L347 L353 L454	E345-K349 PolarHBondContact O-N 2.76Å; E345-K349 IonicContact OE2-NZ 2.63Å; E345-K349 PolarHBondContact OE2-NZ 2.78Å; A346-K349 PolarHBondContact O-N 2.86Å; L347-K349 PolarHBondContact O-N 3.48Å; K349-L353 PolarHBondContact O-N 2.82Å; K349-L353 VanDerWaalsContact O-N 3.1Å; K349-L454 HydrophobicContact CB-CD1 4.41Å; K349-L454 HydrophobicContact CB-CD2 3.77Å; K349-L454 HydrophobicContact CB-CG 4.17Å
350	W	94.9	Very high	89	Confident	125 Å²	125	66 Å²	66	47%	0.473	33%	0.329	S	S	.	.	H	α-helix	trans	-67.7	-41	174.9	-79.3	113.6	0	0	0	113.9	A346 L347 Q348 L353 T354 L454 I456	A346-W350 PolarHBondContact O-N 2.82Å; A346-W350 VanDerWaalsContact O-N 3.14Å; L347-W350 PolarHBondContact O-N 2.72Å; Q348-W350 VanDerWaalsContact C-N 3.34Å; Q348-W350 PolarHBondContact O-N 2.99Å; W350-L353 HydrophobicContact CE3-CD2 4.31Å; W350-L353 HydrophobicContact CZ3-CD2 4.18Å; W350-L353 PolarHBondContact O-N 2.94Å; W350-T354 WeakPolarHBondContact O-CB 3.42Å; W350-T354 PolarHBondContact O-N 3.15Å; W350-T354 PolarHBondContact O-OG1 3.38Å; W350-L454 HydrophobicContact CD2-CD1 4Å; W350-L454 HydrophobicContact CD2-CD2 4.19Å; W350-L454 HydrophobicContact CE3-CD1 4.02Å; W350-L454 HydrophobicContact CG-CD1 4.44Å; W350-L454 HydrophobicContact CG-CD2 4.3Å; W350-L454 HydrophobicContact CZ2-CD2 4.33Å; W350-L454 HydrophobicContact CZ3-CD1 4.36Å; W350-I456 HydrophobicContact CH2-CD1 3.61Å; W350-I456 HydrophobicContact CH2-CG1 4.03Å; W350-I456 HydrophobicContact CZ3-CD1 3.61Å; W350-I456 HydrophobicContact CZ3-CG1 4.5Å
351	L	96.3	Very high	90.7	Very high	30 Å²	30	69.3 Å²	69.3	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-67.4	-40.1	176.4	-72.4	174.7	0	0	0	111.6	L347 Q348 L353 T354 H355 W430 I433 F439 I441	L347-L351 HydrophobicContact CD1-CD1 4.1Å; L347-L351 HydrophobicContact CD1-CG 3.99Å; L347-L351 HydrophobicContact CD2-CD1 4.45Å; L347-L351 HydrophobicContact CG-CD1 3.83Å; L347-L351 HydrophobicContact CG-CG 4.19Å; L347-L351 WeakPolarHBondContact O-CB 3.45Å; L347-L351 VanDerWaalsContact O-CG 3.29Å; L347-L351 WeakPolarHBondContact O-CG 3.32Å; L347-L351 PolarHBondContact O-N 3.42Å; Q348-L351 PolarHBondContact O-N 3.49Å; L351-L353 VanDerWaalsContact C-N 3.34Å; L351-L353 PolarHBondContact O-N 2.97Å; L351-T354 PolarHBondContact O-N 3.06Å; L351-H355 WeakPolarHBondContact O-CB 3.29Å; L351-H355 PolarHBondContact O-N 3.31Å; L351-W430 HydrophobicContact CB-CZ3 4.13Å; L351-W430 HydrophobicContact CD2-CH2 4.19Å; L351-W430 HydrophobicContact CD2-CZ3 4.04Å; L351-I433 HydrophobicContact CD1-CG2 4Å; L351-F439 HydrophobicContact CD1-CE2 4.08Å; L351-F439 HydrophobicContact CD1-CZ 4.16Å; L351-I441 HydrophobicContact CB-CD1 4.13Å; L351-I441 HydrophobicContact CB-CG1 4.43Å; L351-I441 HydrophobicContact CB-CG2 4.15Å; L351-I441 HydrophobicContact CD1-CD1 4Å
352	Q	95.7	Very high	91.9	Very high	17 Å²	17	62.6 Å²	62.6	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-43.4	173.1	-76.4	173.9	-10	0	0	111.6	Q348 E356 Q440 I441 N444 L450	Q348-Q352 HydrophobicContact CG-CG 4.37Å; Q348-Q352 WeakPolarHBondContact O-CB 3.5Å; Q348-Q352 VanDerWaalsContact O-CG 3.28Å; Q348-Q352 WeakPolarHBondContact O-CG 3.39Å; Q348-Q352 PolarHBondContact O-N 2.81Å; Q352-E356 WeakPolarHBondContact O-CB 3.29Å; Q352-E356 PolarHBondContact O-N 3.46Å; Q352-Q440 PolarHBondContact NE2-O 3.02Å; Q352-I441 HydrophobicContact CG-CB 4.46Å; Q352-I441 HydrophobicContact CG-CG2 4.17Å; Q352-N444 HydrophobicContact CB-CB 4.06Å; Q352-N444 HydrophobicContact CG-CB 3.77Å; Q352-L450 HydrophobicContact CB-CD1 3.81Å; Q352-L450 HydrophobicContact CB-CD2 3.73Å; Q352-L450 HydrophobicContact CB-CG 4.44Å
353	L	94.3	Very high	92.9	Very high	11 Å²	11	56.9 Å²	56.9	6%	0.058	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-40	175.4	179.4	61.5	0	0	0	112	K349 W350 L351 E356 V357 I447 L450 V451 L454 I456 M461	K349-L353 PolarHBondContact O-N 2.82Å; K349-L353 VanDerWaalsContact O-N 3.1Å; W350-L353 HydrophobicContact CE3-CD2 4.31Å; W350-L353 HydrophobicContact CZ3-CD2 4.18Å; W350-L353 PolarHBondContact O-N 2.94Å; L351-L353 VanDerWaalsContact C-N 3.34Å; L351-L353 PolarHBondContact O-N 2.97Å; L353-E356 PolarHBondContact O-N 2.95Å; L353-V357 HydrophobicContact CD1-CG2 4.21Å; L353-V357 HydrophobicContact CG-CG2 4.48Å; L353-V357 WeakPolarHBondContact O-CG2 3.35Å; L353-V357 PolarHBondContact O-N 3.04Å; L353-I447 HydrophobicContact CD1-CD1 4.46Å; L353-I447 HydrophobicContact CD1-CG1 3.78Å; L353-L450 HydrophobicContact CB-CB 4.39Å; L353-L450 HydrophobicContact CD1-CB 4.37Å; L353-V451 HydrophobicContact CD1-CG2 4.04Å; L353-L454 HydrophobicContact CB-CD1 4.15Å; L353-L454 HydrophobicContact CD2-CD1 3.79Å; L353-I456 HydrophobicContact CD2-CD1 3.26Å; L353-M461 HydrophobicContact CD1-CE 4.27Å
354	T	95.8	Very high	93.5	Very high	74 Å²	74	61 Å²	61	45%	0.454	30%	0.304	S	S	.	.	H	α-helix	trans	-65.9	-44.7	179.3	-58	0	0	0	0	111.1	W350 L351 E356 V357 E358 W430	W350-T354 WeakPolarHBondContact O-CB 3.42Å; W350-T354 PolarHBondContact O-N 3.15Å; W350-T354 PolarHBondContact O-OG1 3.38Å; L351-T354 PolarHBondContact O-N 3.06Å; T354-E356 VanDerWaalsContact C-N 3.34Å; T354-E356 PolarHBondContact O-N 2.84Å; T354-V357 PolarHBondContact O-N 3.34Å; T354-E358 WeakPolarHBondContact O-CB 3.1Å; T354-E358 PolarHBondContact O-N 3.04Å; T354-W430 HydrophobicContact CG2-CH2 4.07Å; T354-W430 HydrophobicContact CG2-CZ2 4.12Å
355	H	96.4	Very high	93.9	Very high	14 Å²	14	61.8 Å²	61.8	7%	0.065	30%	0.3	C	S	.	.	H	α-helix	trans	-55.3	-48.3	171.9	166.6	-93.9	0	0	0	111.3	L351 E358 V359 W430 I441 N444	L351-H355 WeakPolarHBondContact O-CB 3.29Å; L351-H355 PolarHBondContact O-N 3.31Å; H355-E358 CarbonylContact O-C 3.57Å; H355-E358 WeakPolarHBondContact O-CB 3.24Å; H355-E358 PolarHBondContact O-N 3.32Å; H355-V359 WeakPolarHBondContact O-CG2 3.49Å; H355-V359 PolarHBondContact O-N 2.96Å; H355-W430 HydrophobicContact CB-CD2 4.11Å; H355-W430 HydrophobicContact CB-CE3 4.38Å; H355-W430 HydrophobicContact CB-CH2 4.07Å; H355-W430 HydrophobicContact CB-CZ2 3.78Å; H355-W430 HydrophobicContact CB-CZ3 4.36Å; H355-W430 AromaticContact CD2-CD1 3.72Å; H355-W430 AromaticContact CD2-CG 3.85Å; H355-W430 AromaticContact CD2-NE1 3.81Å; H355-I441 HydrophobicContact CB-CG2 3.91Å; H355-N444 PolarHBondContact ND1-ND2 3.3Å
356	E	95.4	Very high	94.5	Very high	30 Å²	30	59.1 Å²	59.1	14%	0.14	29%	0.286	C	S	.	.	H	α-helix	trans	-69.2	-38.8	-177.2	-177.8	52.4	-145.9	0	0	112.8	Q352 L353 T354 E358 V359 Q360 I447	Q352-E356 WeakPolarHBondContact O-CB 3.29Å; Q352-E356 PolarHBondContact O-N 3.46Å; L353-E356 PolarHBondContact O-N 2.95Å; T354-E356 VanDerWaalsContact C-N 3.34Å; T354-E356 PolarHBondContact O-N 2.84Å; E356-E358 VanDerWaalsContact C-N 3.32Å; E356-E358 PolarHBondContact O-N 3.02Å; E356-V359 WeakPolarHBondContact O-CB 3.39Å; E356-V359 PolarHBondContact O-N 3.43Å; E356-V359 VanDerWaalsContact O-N 3.15Å; E356-Q360 WeakPolarHBondContact O-CG 3.36Å; E356-Q360 PolarHBondContact O-N 3.14Å; E356-Q360 PolarHBondContact OE1-NE2 3.39Å; E356-I447 HydrophobicContact CG-CB 3.57Å; E356-I447 HydrophobicContact CG-CD1 4.19Å; E356-I447 HydrophobicContact CG-CG1 3.97Å
357	V	93.8	Very high	94.8	Very high	48 Å²	48	60.5 Å²	60.5	29%	0.291	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-41.2	170.9	169.6	0	0	0	0	111	L353 T354 V359 Q360 Y361 I447	L353-V357 HydrophobicContact CD1-CG2 4.21Å; L353-V357 HydrophobicContact CG-CG2 4.48Å; L353-V357 WeakPolarHBondContact O-CG2 3.35Å; L353-V357 PolarHBondContact O-N 3.04Å; T354-V357 PolarHBondContact O-N 3.34Å; V357-V359 VanDerWaalsContact C-N 3.31Å; V357-V359 PolarHBondContact O-N 2.91Å; V357-Q360 PolarHBondContact O-N 3.16Å; V357-Y361 HydrophobicContact CG1-CD2 3.84Å; V357-Y361 HydrophobicContact CG1-CE2 3.64Å; V357-Y361 VanDerWaalsContact O-CD2 3.28Å; V357-Y361 WeakPolarHBondContact O-CD2 3.36Å; V357-Y361 PolarHBondContact O-N 3.42Å; V357-I447 HydrophobicContact CG2-CD1 4.08Å
358	E	95.3	Very high	95	Very high	47 Å²	47	61 Å²	61	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-33.9	174.2	-157.9	-162.7	144.2	0	0	112.3	T354 H355 E356 Y361 Y362 R426 R429 W430	T354-E358 WeakPolarHBondContact O-CB 3.1Å; T354-E358 PolarHBondContact O-N 3.04Å; H355-E358 CarbonylContact O-C 3.57Å; H355-E358 WeakPolarHBondContact O-CB 3.24Å; H355-E358 PolarHBondContact O-N 3.32Å; E356-E358 VanDerWaalsContact C-N 3.32Å; E356-E358 PolarHBondContact O-N 3.02Å; E358-Y361 PolarHBondContact O-N 3.46Å; E358-Y362 VanDerWaalsContact O-CB 3.29Å; E358-Y362 WeakPolarHBondContact O-CB 3.39Å; E358-Y362 PolarHBondContact O-N 3.46Å; E358-R426 WeakPolarHBondContact OE1-CD 3.4Å; E358-R426 WeakPolarHBondContact OE1-CG 3.41Å; E358-R429 IonicContact OE1-CZ 2.86Å; E358-R429 IonicContact OE1-NH1 2.66Å; E358-R429 IonicContact OE1-NH2 2.71Å; E358-R429 PolarHBondContact OE1-NH2 2.99Å; E358-R429 IonicContact OE2-CZ 3.55Å; E358-R429 IonicContact OE2-NH1 2.72Å; E358-R429 PolarHBondContact OE2-NH1 2.8Å; E358-R429 IonicContact OE2-NH2 3.32Å; E358-R429 PolarHBondContact OE2-NH2 3.26Å; E358-W430 PolarHBondContact OE2-NE1 3.44Å
359	V	94.6	Very high	95.2	Very high	22 Å²	22	58.8 Å²	58.8	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-44.3	171.7	166.7	0	0	0	0	111.4	H355 E356 V357 Y362 N363	H355-V359 WeakPolarHBondContact O-CG2 3.49Å; H355-V359 PolarHBondContact O-N 2.96Å; E356-V359 WeakPolarHBondContact O-CB 3.39Å; E356-V359 PolarHBondContact O-N 3.43Å; E356-V359 VanDerWaalsContact O-N 3.15Å; V357-V359 VanDerWaalsContact C-N 3.31Å; V357-V359 PolarHBondContact O-N 2.91Å; V359-Y362 PolarHBondContact O-N 2.85Å; V359-N363 WeakPolarHBondContact O-CB 3.38Å; V359-N363 PolarHBondContact O-N 3.06Å; V359-N363 PolarHBondContact O-ND2 3.27Å
360	Q	92.8	Very high	95.3	Very high	64 Å²	64	59.5 Å²	59.5	30%	0.299	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-46.6	175.8	-61.2	-56	-33.5	0	0	112.1	E356 V357 Y362 N363 I364	E356-Q360 WeakPolarHBondContact O-CG 3.36Å; E356-Q360 PolarHBondContact O-N 3.14Å; E356-Q360 PolarHBondContact OE1-NE2 3.39Å; V357-Q360 PolarHBondContact O-N 3.16Å; Q360-Y362 PolarHBondContact O-N 2.82Å; Q360-N363 PolarHBondContact O-N 3.43Å; Q360-I364 WeakPolarHBondContact O-CG1 3.36Å; Q360-I364 PolarHBondContact O-N 2.97Å
361	Y	93.8	Very high	95.4	Very high	165 Å²	165	59 Å²	59	65%	0.647	28%	0.281	S	S	*	.	H	α-helix	trans	-60.5	-42.9	176	-81	-64.5	0	0	0	113	V357 E358 I364 K365	V357-Y361 HydrophobicContact CG1-CD2 3.84Å; V357-Y361 HydrophobicContact CG1-CE2 3.64Å; V357-Y361 VanDerWaalsContact O-CD2 3.28Å; V357-Y361 WeakPolarHBondContact O-CD2 3.36Å; V357-Y361 PolarHBondContact O-N 3.42Å; E358-Y361 PolarHBondContact O-N 3.46Å; Y361-I364 PolarHBondContact O-N 3.32Å; Y361-K365 PolarHBondContact O-N 3.1Å
362	Y	95.8	Very high	95.3	Very high	36 Å²	36	61.5 Å²	61.5	14%	0.141	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-44.7	174	169.4	-91.2	0	0	0	112	E358 V359 Q360 I364 K365 K366 V419 L423	E358-Y362 VanDerWaalsContact O-CB 3.29Å; E358-Y362 WeakPolarHBondContact O-CB 3.39Å; E358-Y362 PolarHBondContact O-N 3.46Å; V359-Y362 PolarHBondContact O-N 2.85Å; Q360-Y362 PolarHBondContact O-N 2.82Å; Y362-I364 VanDerWaalsContact C-N 3.32Å; Y362-I364 PolarHBondContact O-N 3.46Å; Y362-K365 PolarHBondContact O-N 2.88Å; Y362-K366 HydrophobicContact CE1-CB 4.39Å; Y362-K366 HydrophobicContact CE1-CD 4.31Å; Y362-K366 WeakPolarHBondContact O-CB 2.83Å; Y362-K366 PolarHBondContact O-N 3.25Å; Y362-V419 HydrophobicContact CE2-CG1 3.79Å; Y362-L423 HydrophobicContact CE1-CD1 4.46Å; Y362-L423 HydrophobicContact CE2-CB 3.8Å; Y362-L423 HydrophobicContact CE2-CD1 4.3Å
363	N	95.6	Very high	95.3	Very high	56 Å²	56	64.6 Å²	64.6	30%	0.299	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-39.8	179.8	-72.5	-23.6	0	0	0	111.4	V359 Q360 K366 Q367	V359-N363 WeakPolarHBondContact O-CB 3.38Å; V359-N363 PolarHBondContact O-N 3.06Å; V359-N363 PolarHBondContact O-ND2 3.27Å; Q360-N363 PolarHBondContact O-N 3.43Å; N363-K366 PolarHBondContact O-N 3.02Å; N363-Q367 WeakPolarHBondContact O-CG 3.17Å; N363-Q367 PolarHBondContact O-N 3.49Å
364	I	95.4	Very high	95.4	Very high	90 Å²	90	68.6 Å²	68.6	46%	0.462	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-46.6	173.5	-65.5	163.9	0	0	0	110.9	Q360 Y361 Y362 K366 Q367 N368	Q360-I364 WeakPolarHBondContact O-CG1 3.36Å; Q360-I364 PolarHBondContact O-N 2.97Å; Y361-I364 PolarHBondContact O-N 3.32Å; Y362-I364 VanDerWaalsContact C-N 3.32Å; Y362-I364 PolarHBondContact O-N 3.46Å; I364-K366 VanDerWaalsContact C-N 3.34Å; I364-K366 PolarHBondContact O-N 3.46Å; I364-Q367 PolarHBondContact O-N 3.44Å; I364-N368 PolarHBondContact O-N 3.04Å; I364-N368 PolarHBondContact O-ND2 3.5Å
365	K	93.7	Very high	95.4	Very high	92 Å²	92	68.8 Å²	68.8	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-40.8	177.6	-167.8	176.3	179.6	173.7	0	111.7	Y361 Y362 N368 A369 E418 V419	Y361-K365 PolarHBondContact O-N 3.1Å; Y362-K365 PolarHBondContact O-N 2.88Å; K365-N368 PolarHBondContact O-N 2.82Å; K365-A369 PolarHBondContact O-N 3.41Å; K365-E418 WeakPolarHBondContact CE-OE2 3.39Å; K365-E418 IonicContact NZ-OE2 3.36Å; K365-E418 PolarHBondContact NZ-OE2 2.79Å; K365-V419 HydrophobicContact CB-CG2 4.47Å; K365-V419 HydrophobicContact CD-CG2 4.32Å; K365-V419 HydrophobicContact CG-CG2 3.9Å
366	K	96.6	Very high	95.3	Very high	79 Å²	79	68.3 Å²	68.3	34%	0.343	33%	0.329	S	S	.	.	H	α-helix	trans	-58.8	-55.1	174.4	-179.4	-167.5	160.1	-172.1	0	111.3	Y362 N363 I364 N368 A369 E370 V419	Y362-K366 HydrophobicContact CE1-CB 4.39Å; Y362-K366 HydrophobicContact CE1-CD 4.31Å; Y362-K366 WeakPolarHBondContact O-CB 2.83Å; Y362-K366 PolarHBondContact O-N 3.25Å; N363-K366 PolarHBondContact O-N 3.02Å; I364-K366 VanDerWaalsContact C-N 3.34Å; I364-K366 PolarHBondContact O-N 3.46Å; K366-N368 PolarHBondContact O-N 2.92Å; K366-A369 WeakPolarHBondContact O-CB 3.27Å; K366-A369 PolarHBondContact O-N 2.74Å; K366-E370 WeakPolarHBondContact CE-OE1 3.33Å; K366-E370 WeakPolarHBondContact CE-OE2 3.36Å; K366-E370 HydrophobicContact CG-CG 4.49Å; K366-E370 IonicContact NZ-OE1 3.78Å; K366-E370 WeakPolarHBondContact O-CG 3.3Å; K366-E370 PolarHBondContact O-N 3.34Å; K366-V419 HydrophobicContact CB-CG1 3.98Å; K366-V419 HydrophobicContact CG-CG1 4.16Å
367	Q	96.6	Very high	95.3	Very high	86 Å²	86	73.3 Å²	73.3	40%	0.402	35%	0.351	S	S	.	.	H	α-helix	trans	-58.1	-35.8	179.6	-74.9	179.4	5.5	0	0	112.4	N363 I364 E370 K371	N363-Q367 WeakPolarHBondContact O-CG 3.17Å; N363-Q367 PolarHBondContact O-N 3.49Å; I364-Q367 PolarHBondContact O-N 3.44Å; Q367-E370 PolarHBondContact O-N 2.75Å; Q367-K371 VanDerWaalsContact O-CG 3.27Å; Q367-K371 WeakPolarHBondContact O-CG 3.27Å; Q367-K371 PolarHBondContact O-N 2.74Å
368	N	95.7	Very high	95.3	Very high	74 Å²	74	74.9 Å²	74.9	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-70.7	-37.4	176.9	-70.5	-19.5	0	0	0	112.4	I364 K365 K366 K371 Q372	I364-N368 PolarHBondContact O-N 3.04Å; I364-N368 PolarHBondContact O-ND2 3.5Å; K365-N368 PolarHBondContact O-N 2.82Å; K366-N368 PolarHBondContact O-N 2.92Å; N368-K371 PolarHBondContact O-N 3.46Å; N368-Q372 WeakPolarHBondContact O-CG 3.46Å; N368-Q372 PolarHBondContact O-N 2.81Å
369	A	97	Very high	95.1	Very high	2 Å²	2	73.2 Å²	73.2	2%	0.017	35%	0.35	C	S	.	.	H	α-helix	trans	-66.2	-37.7	171.3	0	0	0	0	0	112.2	K365 K366 Q372 L373 A415 L416 V419	K365-A369 PolarHBondContact O-N 3.41Å; K366-A369 WeakPolarHBondContact O-CB 3.27Å; K366-A369 PolarHBondContact O-N 2.74Å; A369-Q372 PolarHBondContact O-N 3.44Å; A369-L373 PolarHBondContact O-N 2.94Å; A369-A415 HydrophobicContact CB-CB 3.83Å; A369-L416 HydrophobicContact CB-CD2 4.02Å; A369-L416 HydrophobicContact CB-CG 4.37Å; A369-V419 HydrophobicContact CB-CG2 3.99Å
370	E	96	Very high	94.8	Very high	88 Å²	88	74 Å²	74	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.2	-71.2	171.7	145.1	0	0	111.9	K366 Q367 L373 L374	K366-E370 WeakPolarHBondContact CE-OE1 3.33Å; K366-E370 WeakPolarHBondContact CE-OE2 3.36Å; K366-E370 HydrophobicContact CG-CG 4.49Å; K366-E370 IonicContact NZ-OE1 3.78Å; K366-E370 WeakPolarHBondContact O-CG 3.3Å; K366-E370 PolarHBondContact O-N 3.34Å; Q367-E370 PolarHBondContact O-N 2.75Å; E370-L373 PolarHBondContact O-N 3.42Å; E370-L374 PolarHBondContact O-N 3.06Å
371	K	96.9	Very high	94.7	Very high	114 Å²	114	74.4 Å²	74.4	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-43.4	171.6	-72.1	165.3	-172	169.7	0	112.3	Q367 N368 L373 L374 V375	Q367-K371 VanDerWaalsContact O-CG 3.27Å; Q367-K371 WeakPolarHBondContact O-CG 3.27Å; Q367-K371 PolarHBondContact O-N 2.74Å; N368-K371 PolarHBondContact O-N 3.46Å; K371-L373 VanDerWaalsContact C-N 3.34Å; K371-L373 PolarHBondContact O-N 3.21Å; K371-L374 PolarHBondContact O-N 3.41Å; K371-V375 WeakPolarHBondContact O-CG2 3.28Å; K371-V375 PolarHBondContact O-N 3.39Å
372	Q	94.1	Very high	94.4	Very high	82 Å²	82	72.1 Å²	72.1	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175	-72.3	177.3	7.8	0	0	111.9	N368 A369 L374 V375 A376 A412 A415	N368-Q372 WeakPolarHBondContact O-CG 3.46Å; N368-Q372 PolarHBondContact O-N 2.81Å; A369-Q372 PolarHBondContact O-N 3.44Å; Q372-L374 VanDerWaalsContact C-N 3.35Å; Q372-L374 PolarHBondContact O-N 2.98Å; Q372-V375 PolarHBondContact O-N 3.13Å; Q372-A376 WeakPolarHBondContact O-CB 3.47Å; Q372-A376 PolarHBondContact O-N 3.28Å; Q372-A412 HydrophobicContact CB-CB 4.1Å; Q372-A415 VanDerWaalsContact OE1-CB 3.22Å
373	L	96.3	Very high	93.6	Very high	82 Å²	82	71.9 Å²	71.9	43%	0.429	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-41.2	174.2	179.6	65.1	0	0	0	112.1	A369 E370 K371 A376 K377 A412 L416	A369-L373 PolarHBondContact O-N 2.94Å; E370-L373 PolarHBondContact O-N 3.42Å; K371-L373 VanDerWaalsContact C-N 3.34Å; K371-L373 PolarHBondContact O-N 3.21Å; L373-A376 PolarHBondContact O-N 3.23Å; L373-K377 VanDerWaalsContact O-CB 3.26Å; L373-K377 WeakPolarHBondContact O-CB 3.38Å; L373-K377 PolarHBondContact O-N 3.22Å; L373-A412 HydrophobicContact CB-CB 4.5Å; L373-L416 HydrophobicContact CB-CD1 4.2Å; L373-L416 HydrophobicContact CD1-CD1 4Å; L373-L416 HydrophobicContact CD2-CD1 3.98Å; L373-L416 HydrophobicContact CG-CD1 4.27Å
374	L	96.4	Very high	93	Very high	95 Å²	95	74.1 Å²	74.1	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-49	177.5	-175.8	62	0	0	0	111.4	E370 K371 Q372 A376 K377 E378	E370-L374 PolarHBondContact O-N 3.06Å; K371-L374 PolarHBondContact O-N 3.41Å; Q372-L374 VanDerWaalsContact C-N 3.35Å; Q372-L374 PolarHBondContact O-N 2.98Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 2.95Å; L374-K377 WeakPolarHBondContact O-CB 3.28Å; L374-K377 PolarHBondContact O-N 2.95Å; L374-E378 PolarHBondContact O-N 2.98Å
375	V	94.9	Very high	92.4	Very high	79 Å²	79	77.1 Å²	77.1	48%	0.479	37%	0.372	S	S	.	.	H	α-helix	trans	-60.3	-41.3	176.8	172.6	0	0	0	0	111.7	K371 Q372 E378 G379	K371-V375 WeakPolarHBondContact O-CG2 3.28Å; K371-V375 PolarHBondContact O-N 3.39Å; Q372-V375 PolarHBondContact O-N 3.13Å; V375-E378 PolarHBondContact O-N 3.43Å; V375-G379 PolarHBondContact O-N 2.86Å
376	A	95.3	Very high	91.4	Very high	4 Å²	4	78.3 Å²	78.3	3%	0.033	38%	0.377	C	S	.	.	H	α-helix	trans	-65.7	-41.8	175.6	0	0	0	0	0	112.5	Q372 L373 L374 G379 A380 K408 I409 A412	Q372-A376 WeakPolarHBondContact O-CB 3.47Å; Q372-A376 PolarHBondContact O-N 3.28Å; L373-A376 PolarHBondContact O-N 3.23Å; L374-A376 VanDerWaalsContact C-N 3.33Å; L374-A376 PolarHBondContact O-N 2.95Å; A376-G379 PolarHBondContact O-N 3.08Å; A376-A380 PolarHBondContact O-N 3.46Å; A376-K408 HydrophobicContact CB-CB 4.41Å; A376-I409 HydrophobicContact CB-CG1 3.95Å; A376-A412 HydrophobicContact CB-CB 4.09Å
377	K	94.4	Very high	90	Very high	135 Å²	135	82.3 Å²	82.3	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-63.4	-42.7	175.8	-178.5	-174.4	177.6	-171.6	0	111.6	L373 L374 A380 E381	L373-K377 VanDerWaalsContact O-CB 3.26Å; L373-K377 WeakPolarHBondContact O-CB 3.38Å; L373-K377 PolarHBondContact O-N 3.22Å; L374-K377 WeakPolarHBondContact O-CB 3.28Å; L374-K377 PolarHBondContact O-N 2.95Å; K377-A380 PolarHBondContact O-N 3.49Å; K377-E381 PolarHBondContact O-N 2.95Å
378	E	94.8	Very high	88.6	Confident	81 Å²	81	83.7 Å²	83.7	38%	0.379	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-44.6	172.7	-80.6	-176.1	-132.2	0	0	112.3	L374 V375 A380 E381 K382	L374-E378 PolarHBondContact O-N 2.98Å; V375-E378 PolarHBondContact O-N 3.43Å; E378-A380 VanDerWaalsContact C-N 3.33Å; E378-A380 PolarHBondContact O-N 3.09Å; E378-E381 PolarHBondContact O-N 2.8Å; E378-K382 HydrophobicContact CB-CD 4.47Å; E378-K382 VanDerWaalsContact O-CB 3.28Å; E378-K382 WeakPolarHBondContact O-CB 3.22Å; E378-K382 WeakPolarHBondContact O-CD 3.43Å; E378-K382 WeakPolarHBondContact O-CG 3.13Å; E378-K382 PolarHBondContact O-N 3.24Å; E378-K382 IonicContact OE2-NZ 3.2Å; E378-K382 PolarHBondContact OE2-NZ 2.93Å
379	G	90.4	Very high	87.4	Confident	12 Å²	12	84.4 Å²	84.4	12%	0.124	41%	0.407	C	S	.	.	H	α-helix	trans	-56.7	-47.8	175.2	0	0	0	0	0	111.8	V375 A376 K382 I383	V375-G379 PolarHBondContact O-N 2.86Å; A376-G379 PolarHBondContact O-N 3.08Å; G379-K382 PolarHBondContact O-N 3.43Å; G379-I383 PolarHBondContact O-N 3.43Å
380	A	89.3	Confident	85.2	Confident	39 Å²	39	92.7 Å²	92.7	32%	0.322	45%	0.45	S	S	.	.	H	α-helix	trans	-61.8	-44.4	176.4	0	0	0	0	0	112.6	A376 K377 E378 I383 K384 I409	A376-A380 PolarHBondContact O-N 3.46Å; K377-A380 PolarHBondContact O-N 3.49Å; E378-A380 VanDerWaalsContact C-N 3.33Å; E378-A380 PolarHBondContact O-N 3.09Å; A380-I383 PolarHBondContact O-N 2.99Å; A380-K384 VanDerWaalsContact O-CB 3.27Å; A380-K384 WeakPolarHBondContact O-CB 3.38Å; A380-K384 PolarHBondContact O-N 3.25Å; A380-I409 HydrophobicContact CB-CD1 4.37Å
381	E	90.6	Very high	83.2	Confident	71 Å²	71	97 Å²	97	33%	0.332	47%	0.468	S	S	.	.	H	α-helix	trans	-67.4	-34.5	175.9	-75.4	-63	151.8	0	0	112.6	K377 E378 K384 K385	K377-E381 PolarHBondContact O-N 2.95Å; E378-E381 PolarHBondContact O-N 2.8Å; E381-K384 PolarHBondContact O-N 3.19Å; E381-K384 IonicContact OE1-NZ 3.7Å; E381-K384 PolarHBondContact OE1-NZ 2.75Å; E381-K384 IonicContact OE2-NZ 3.39Å; E381-K384 PolarHBondContact OE2-NZ 3.46Å; E381-K385 WeakPolarHBondContact O-CB 3.38Å; E381-K385 VanDerWaalsContact O-CG 3.32Å; E381-K385 WeakPolarHBondContact O-CG 3.37Å; E381-K385 PolarHBondContact O-N 2.83Å
382	K	85.8	Confident	81.2	Confident	117 Å²	117	91.8 Å²	91.8	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-64.3	-41	173.4	-74.3	159.7	-178.1	166.7	0	110.8	E378 G379 K386	E378-K382 HydrophobicContact CB-CD 4.47Å; E378-K382 VanDerWaalsContact O-CB 3.28Å; E378-K382 WeakPolarHBondContact O-CB 3.22Å; E378-K382 WeakPolarHBondContact O-CD 3.43Å; E378-K382 WeakPolarHBondContact O-CG 3.13Å; E378-K382 PolarHBondContact O-N 3.24Å; E378-K382 IonicContact OE2-NZ 3.2Å; E378-K382 PolarHBondContact OE2-NZ 2.93Å; G379-K382 PolarHBondContact O-N 3.43Å; K382-K386 WeakPolarHBondContact O-CB 3.28Å; K382-K386 VanDerWaalsContact O-CG 3.31Å; K382-K386 WeakPolarHBondContact O-CG 3.29Å; K382-K386 PolarHBondContact O-N 3.01Å; K382-K386 VanDerWaalsContact O-N 3.08Å
383	I	80.6	Confident	79.4	Confident	31 Å²	31	93.3 Å²	93.3	16%	0.159	46%	0.462	C	S	.	.	H	α-helix	trans	-67.6	-45.4	172.1	-67.1	177.1	0	0	0	111.5	G379 A380 K385 K386 R387 V396 L402 V405	G379-I383 PolarHBondContact O-N 3.43Å; A380-I383 PolarHBondContact O-N 2.99Å; I383-K385 PolarHBondContact O-N 3.5Å; I383-K386 CarbonylContact O-C 3.56Å; I383-K386 WeakPolarHBondContact O-CB 3.37Å; I383-K386 PolarHBondContact O-N 3.4Å; I383-K386 VanDerWaalsContact O-N 3.16Å; I383-R387 PolarHBondContact O-N 3.2Å; I383-V396 HydrophobicContact CG2-CG1 4.18Å; I383-L402 HydrophobicContact CD1-CB 4.45Å; I383-V405 HydrophobicContact CD1-CB 3.75Å; I383-V405 HydrophobicContact CD1-CG1 3.86Å; I383-V405 HydrophobicContact CD1-CG2 3.91Å
384	K	82.3	Confident	77.3	Confident	104 Å²	104	97.5 Å²	97.5	45%	0.452	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-42.9	178.9	172.8	171.9	158.3	-116.9	0	112.4	A380 E381 R387 N388	A380-K384 VanDerWaalsContact O-CB 3.27Å; A380-K384 WeakPolarHBondContact O-CB 3.38Å; A380-K384 PolarHBondContact O-N 3.25Å; E381-K384 PolarHBondContact O-N 3.19Å; E381-K384 IonicContact OE1-NZ 3.7Å; E381-K384 PolarHBondContact OE1-NZ 2.75Å; E381-K384 IonicContact OE2-NZ 3.39Å; E381-K384 PolarHBondContact OE2-NZ 3.46Å; K384-R387 PolarHBondContact O-N 2.91Å; K384-N388 PolarHBondContact O-N 3.15Å; K384-N388 PolarHBondContact O-OD1 3.06Å
385	K	82	Confident	75.2	Confident	152 Å²	152	100.3 Å²	100.3	66%	0.661	49%	0.488	S	S	*	.	H	α-helix	trans	-62	-47.7	171.2	-74.1	178.7	179.1	-174.7	0	111.3	E381 I383 R387 N388	E381-K385 WeakPolarHBondContact O-CB 3.38Å; E381-K385 VanDerWaalsContact O-CG 3.32Å; E381-K385 WeakPolarHBondContact O-CG 3.37Å; E381-K385 PolarHBondContact O-N 2.83Å; I383-K385 PolarHBondContact O-N 3.5Å; K385-R387 VanDerWaalsContact C-N 3.27Å; K385-R387 PolarHBondContact O-N 2.9Å; K385-N388 PolarHBondContact O-N 2.94Å
386	K	72.6	Confident	73.5	Confident	117 Å²	117	97.7 Å²	97.7	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-59.3	-32.5	175	-77.5	177.7	178.7	-176.3	0	113.4	K382 I383 T389 G392 V396	K382-K386 WeakPolarHBondContact O-CB 3.28Å; K382-K386 VanDerWaalsContact O-CG 3.31Å; K382-K386 WeakPolarHBondContact O-CG 3.29Å; K382-K386 PolarHBondContact O-N 3.01Å; K382-K386 VanDerWaalsContact O-N 3.08Å; I383-K386 CarbonylContact O-C 3.56Å; I383-K386 WeakPolarHBondContact O-CB 3.37Å; I383-K386 PolarHBondContact O-N 3.4Å; I383-K386 VanDerWaalsContact O-N 3.16Å; K386-T389 PolarHBondContact O-OG1 3.39Å; K386-G392 WeakPolarHBondContact O-CA 3.49Å; K386-V396 HydrophobicContact CB-CG2 4.32Å
387	R	68.1	Low	71.6	Confident	163 Å²	163	101.1 Å²	101.1	62%	0.615	50%	0.5	S	S	*	.	H	α-helix	trans	-74.8	-23.9	178.7	-157.6	-168	74.4	156.7	5.6	113.3	I383 K384 K385	I383-R387 PolarHBondContact O-N 3.2Å; K384-R387 PolarHBondContact O-N 2.91Å; K385-R387 VanDerWaalsContact C-N 3.27Å; K385-R387 PolarHBondContact O-N 2.9Å
388	N	66.8	Low	69.7	Low	115 Å²	115	103.2 Å²	103.2	62%	0.615	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.2	-175.2	-72.5	10.4	0	0	0	113.7	K384 K385	K384-N388 PolarHBondContact O-N 3.15Å; K384-N388 PolarHBondContact O-OD1 3.06Å; K385-N388 PolarHBondContact O-N 2.94Å
389	T	69.9	Low	68.1	Low	89 Å²	89	101.1 Å²	101.1	55%	0.546	51%	0.506	S	S	.	.	S	Bend	trans	-87.1	152.1	170	57.6	0	0	0	0	111	K386 F391 G392	K386-T389 PolarHBondContact O-OG1 3.39Å; T389-F391 PolarHBondContact O-N 3.45Å; T389-G392 PolarHBondContact O-N 3.46Å
390	L	52.3	Low	67	Low	176 Å²	176	105.2 Å²	105.2	92%	0.921	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-12.6	-166.1	-70.3	167.4	0	0	0	116.4
391	F	53.3	Low	66.4	Low	178 Å²	178	105.3 Å²	105.3	78%	0.781	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	8.1	173.9	-74.2	-85.6	0	0	0	113.5	T389 T393	T389-F391 PolarHBondContact O-N 3.45Å; F391-T393 PolarHBondContact O-N 3.43Å
392	G	54.6	Low	66	Low	6 Å²	6	105.3 Å²	105.3	6%	0.062	53%	0.533	C	S	.	.	H	α-helix	trans	-61.6	-44.2	-170	0	0	0	0	0	115.5	K386 T389 F394 H395 V396	K386-G392 WeakPolarHBondContact O-CA 3.49Å; T389-G392 PolarHBondContact O-N 3.46Å; G392-F394 PolarHBondContact O-N 3.25Å; G392-F394 VanDerWaalsContact O-N 3.11Å; G392-H395 PolarHBondContact O-N 3.46Å; G392-V396 WeakPolarHBondContact O-CG2 3.39Å; G392-V396 PolarHBondContact O-N 3.3Å
393	T	57.2	Low	66.1	Low	114 Å²	114	104.9 Å²	104.9	70%	0.699	54%	0.536	S	S	*	.	H	α-helix	trans	-57.9	-30	-172.1	-39.9	0	0	0	0	113.4	F391	F391-T393 PolarHBondContact O-N 3.43Å
394	F	50.8	Low	66.6	Low	170 Å²	170	106.9 Å²	106.9	75%	0.746	55%	0.547	S	S	*	.	H	α-helix	trans	-79.4	-35.5	-176.9	-163.8	-100.3	0	0	0	113.2	G392	G392-F394 PolarHBondContact O-N 3.25Å; G392-F394 VanDerWaalsContact O-N 3.11Å
395	H	54.1	Low	67.1	Low	153 Å²	153	102.6 Å²	102.6	71%	0.708	53%	0.53	S	S	*	.	H	α-helix	trans	-82.8	-30	-179.6	-97	118.7	0	0	0	113.6	G392 A397 S399	G392-H395 PolarHBondContact O-N 3.46Å; H395-A397 VanDerWaalsContact C-N 3.34Å; H395-A397 PolarHBondContact O-N 3.46Å; H395-S399 PolarHBondContact O-N 3.46Å
396	V	57.7	Low	67.6	Low	24 Å²	24	99.2 Å²	99.2	15%	0.145	52%	0.519	C	S	.	.	H	α-helix	trans	-67.5	-33.7	-176.9	172.9	0	0	0	0	112.2	I383 K386 G392 H398 L402	I383-V396 HydrophobicContact CG2-CG1 4.18Å; K386-V396 HydrophobicContact CB-CG2 4.32Å; G392-V396 WeakPolarHBondContact O-CG2 3.39Å; G392-V396 PolarHBondContact O-N 3.3Å; V396-H398 VanDerWaalsContact C-N 3.32Å; V396-H398 PolarHBondContact O-N 3.42Å; V396-L402 HydrophobicContact CG1-CD1 3.99Å
397	A	55.2	Low	68.7	Low	77 Å²	77	99.6 Å²	99.6	64%	0.636	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-16.2	-174.1	0	0	0	0	0	115.7	H395	H395-A397 VanDerWaalsContact C-N 3.34Å; H395-A397 PolarHBondContact O-N 3.46Å
398	H	54.6	Low	70	Confident	178 Å²	178	95.6 Å²	95.6	82%	0.824	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	8.8	-179.1	-71.8	-65	0	0	0	113.6	V396	V396-H398 VanDerWaalsContact C-N 3.32Å; V396-H398 PolarHBondContact O-N 3.42Å
399	S	61.3	Low	71.4	Confident	37 Å²	37	92.1 Å²	92.1	26%	0.259	49%	0.49	S	S	.	.			trans	-90.9	124.6	177.7	79.9	0	0	0	0	111.4	H395 S401 L402	H395-S399 PolarHBondContact O-N 3.46Å; S399-S401 PolarHBondContact O-N 3.05Å; S399-S401 PolarHBondContact OG-OG 3.24Å; S399-L402 PolarHBondContact O-N 3.11Å
400	S	68.7	Low	72.7	Confident	98 Å²	98	92.2 Å²	92.2	69%	0.685	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-12.7	169.7	51.3	0	0	0	0	113.9	L402 D403 D404	S400-L402 PolarHBondContact O-N 3.36Å; S400-D403 PolarHBondContact O-N 2.7Å; S400-D404 PolarHBondContact O-N 3.4Å
401	S	75.7	Confident	74.8	Confident	41 Å²	41	86.5 Å²	86.5	29%	0.287	46%	0.46	S	S	.	.	H	α-helix	trans	-66.2	-14.4	171.4	75.3	0	0	0	0	114.4	S399 V405	S399-S401 PolarHBondContact O-N 3.05Å; S399-S401 PolarHBondContact OG-OG 3.24Å; S401-V405 VanDerWaalsContact O-CG2 3.24Å; S401-V405 WeakPolarHBondContact O-CG2 3.28Å; S401-V405 PolarHBondContact O-N 2.92Å
402	L	83.1	Confident	76.9	Confident	71 Å²	71	78.1 Å²	78.1	37%	0.372	42%	0.423	S	S	.	.	H	α-helix	trans	-76	-48.4	171.7	-172.3	148	0	0	0	110.9	I383 V396 S399 S400 V405 D406	I383-L402 HydrophobicContact CD1-CB 4.45Å; V396-L402 HydrophobicContact CG1-CD1 3.99Å; S399-L402 PolarHBondContact O-N 3.11Å; S400-L402 PolarHBondContact O-N 3.36Å; L402-V405 PolarHBondContact O-N 3.11Å; L402-D406 PolarHBondContact O-N 3.28Å
403	D	88.1	Confident	78.9	Confident	109 Å²	109	83.9 Å²	83.9	58%	0.583	45%	0.447	S	S	*	.	H	α-helix	trans	-66.6	-38.8	-178.4	-50.2	-51.1	0	0	0	111.8	S400 V405 D406 H407	S400-D403 PolarHBondContact O-N 2.7Å; D403-V405 VanDerWaalsContact C-N 3.34Å; D403-V405 PolarHBondContact O-N 2.96Å; D403-D406 PolarHBondContact O-N 2.93Å; D403-H407 WeakPolarHBondContact O-CB 3.32Å; D403-H407 PolarHBondContact O-N 3.36Å
404	D	89.8	Confident	80.8	Confident	72 Å²	72	83.5 Å²	83.5	39%	0.385	44%	0.437	S	S	.	.	H	α-helix	trans	-59.3	-42	171.9	170.4	61.9	0	0	0	112.2	S400 K408	S400-D404 PolarHBondContact O-N 3.4Å; D404-K408 WeakPolarHBondContact O-CB 3.46Å; D404-K408 WeakPolarHBondContact O-CD 3.31Å; D404-K408 VanDerWaalsContact O-CG 3.29Å; D404-K408 WeakPolarHBondContact O-CG 3.44Å; D404-K408 PolarHBondContact O-N 2.92Å; D404-K408 WeakPolarHBondContact OD1-CE 3.36Å; D404-K408 IonicContact OD1-NZ 3.93Å; D404-K408 PolarHBondContact OD1-NZ 3.26Å; D404-K408 IonicContact OD2-NZ 3.24Å; D404-K408 PolarHBondContact OD2-NZ 3.48Å
405	V	92.3	Very high	83	Confident	15 Å²	15	76.1 Å²	76.1	9%	0.091	41%	0.407	C	S	.	.	H	α-helix	trans	-71.7	-39.5	177.6	168.7	0	0	0	0	111.6	I383 S401 L402 D403 K408 I409	I383-V405 HydrophobicContact CD1-CB 3.75Å; I383-V405 HydrophobicContact CD1-CG1 3.86Å; I383-V405 HydrophobicContact CD1-CG2 3.91Å; S401-V405 VanDerWaalsContact O-CG2 3.24Å; S401-V405 WeakPolarHBondContact O-CG2 3.28Å; S401-V405 PolarHBondContact O-N 2.92Å; L402-V405 PolarHBondContact O-N 3.11Å; D403-V405 VanDerWaalsContact C-N 3.34Å; D403-V405 PolarHBondContact O-N 2.96Å; V405-K408 PolarHBondContact O-N 3.46Å; V405-I409 HydrophobicContact CG1-CD1 3.86Å; V405-I409 HydrophobicContact CG1-CG1 4.46Å; V405-I409 VanDerWaalsContact O-CG1 3.26Å; V405-I409 WeakPolarHBondContact O-CG1 3.29Å; V405-I409 PolarHBondContact O-N 2.87Å
406	D	93.1	Very high	85.1	Confident	80 Å²	80	71.2 Å²	71.2	43%	0.428	39%	0.386	S	S	.	.	H	α-helix	trans	-66.9	-40.8	175.8	-165.4	58.3	0	0	0	111.7	L402 D403 K408 I409 L410	L402-D406 PolarHBondContact O-N 3.28Å; D403-D406 PolarHBondContact O-N 2.93Å; D406-K408 VanDerWaalsContact C-N 3.31Å; D406-K408 PolarHBondContact O-N 3.47Å; D406-I409 CarbonylContact O-C 3.48Å; D406-I409 WeakPolarHBondContact O-CA 3.48Å; D406-I409 WeakPolarHBondContact O-CB 3.41Å; D406-I409 PolarHBondContact O-N 2.83Å; D406-I409 VanDerWaalsContact O-N 3.08Å; D406-L410 WeakPolarHBondContact O-CG 3.45Å; D406-L410 PolarHBondContact O-N 2.74Å
407	H	96.5	Very high	86.9	Confident	125 Å²	125	72.9 Å²	72.9	58%	0.579	40%	0.398	S	S	*	.	H	α-helix	trans	-60.1	-39.4	172.8	-174.7	62.4	0	0	0	112.3	D403 L410 T411	D403-H407 WeakPolarHBondContact O-CB 3.32Å; D403-H407 PolarHBondContact O-N 3.36Å; H407-L410 PolarHBondContact O-N 3.26Å; H407-T411 WeakPolarHBondContact O-CB 3.38Å; H407-T411 PolarHBondContact O-N 3.08Å; H407-T411 PolarHBondContact O-OG1 3.15Å
408	K	95.8	Very high	88.9	Confident	80 Å²	80	72.7 Å²	72.7	35%	0.348	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-38.9	172.1	-76.5	162.7	178.3	160	0	112.5	A376 D404 V405 D406 T411 A412	A376-K408 HydrophobicContact CB-CB 4.41Å; D404-K408 WeakPolarHBondContact O-CB 3.46Å; D404-K408 WeakPolarHBondContact O-CD 3.31Å; D404-K408 VanDerWaalsContact O-CG 3.29Å; D404-K408 WeakPolarHBondContact O-CG 3.44Å; D404-K408 PolarHBondContact O-N 2.92Å; D404-K408 WeakPolarHBondContact OD1-CE 3.36Å; D404-K408 IonicContact OD1-NZ 3.93Å; D404-K408 PolarHBondContact OD1-NZ 3.26Å; D404-K408 IonicContact OD2-NZ 3.24Å; D404-K408 PolarHBondContact OD2-NZ 3.48Å; V405-K408 PolarHBondContact O-N 3.46Å; D406-K408 VanDerWaalsContact C-N 3.31Å; D406-K408 PolarHBondContact O-N 3.47Å; K408-T411 PolarHBondContact O-N 3Å; K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 3.2Å
409	I	95.6	Very high	90.9	Very high	42 Å²	42	64.7 Å²	64.7	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-64.7	-43.7	174.4	-71.2	164.1	0	0	0	111.2	A376 A380 V405 D406 K413	A376-I409 HydrophobicContact CB-CG1 3.95Å; A380-I409 HydrophobicContact CB-CD1 4.37Å; V405-I409 HydrophobicContact CG1-CD1 3.86Å; V405-I409 HydrophobicContact CG1-CG1 4.46Å; V405-I409 VanDerWaalsContact O-CG1 3.26Å; V405-I409 WeakPolarHBondContact O-CG1 3.29Å; V405-I409 PolarHBondContact O-N 2.87Å; D406-I409 CarbonylContact O-C 3.48Å; D406-I409 WeakPolarHBondContact O-CA 3.48Å; D406-I409 WeakPolarHBondContact O-CB 3.41Å; D406-I409 PolarHBondContact O-N 2.83Å; D406-I409 VanDerWaalsContact O-N 3.08Å; I409-K413 HydrophobicContact CG2-CD 4.06Å; I409-K413 VanDerWaalsContact CG2-CE 3.49Å; I409-K413 WeakPolarHBondContact O-CB 3.49Å; I409-K413 VanDerWaalsContact O-CG 3.24Å; I409-K413 WeakPolarHBondContact O-CG 3.36Å; I409-K413 PolarHBondContact O-N 3.31Å
410	L	97	Very high	92.6	Very high	91 Å²	91	65.8 Å²	65.8	48%	0.476	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-45.1	176.2	-68.9	171.8	0	0	0	111.3	D406 H407 K413 Q414	D406-L410 WeakPolarHBondContact O-CG 3.45Å; D406-L410 PolarHBondContact O-N 2.74Å; H407-L410 PolarHBondContact O-N 3.26Å; L410-K413 PolarHBondContact O-N 3.25Å; L410-Q414 PolarHBondContact O-N 3.2Å
411	T	96.8	Very high	94	Very high	56 Å²	56	63.7 Å²	63.7	34%	0.344	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-47	177.2	-56.8	0	0	0	0	111.6	H407 K408 K413 Q414 A415	H407-T411 WeakPolarHBondContact O-CB 3.38Å; H407-T411 PolarHBondContact O-N 3.08Å; H407-T411 PolarHBondContact O-OG1 3.15Å; K408-T411 PolarHBondContact O-N 3Å; T411-K413 PolarHBondContact O-N 3.16Å; T411-Q414 PolarHBondContact O-N 2.86Å; T411-A415 PolarHBondContact O-N 3.23Å
412	A	97.3	Very high	94.9	Very high	2 Å²	2	63.4 Å²	63.4	2%	0.017	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-40.8	176.9	0	0	0	0	0	112.5	Q372 L373 A376 K408 Q414 A415 L416	Q372-A412 HydrophobicContact CB-CB 4.1Å; L373-A412 HydrophobicContact CB-CB 4.5Å; A376-A412 HydrophobicContact CB-CB 4.09Å; K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 3.2Å; A412-Q414 PolarHBondContact O-N 3.05Å; A412-A415 PolarHBondContact O-N 2.76Å; A412-L416 WeakPolarHBondContact O-CB 3.39Å; A412-L416 WeakPolarHBondContact O-CD1 3.34Å; A412-L416 VanDerWaalsContact O-CG 3.24Å; A412-L416 WeakPolarHBondContact O-CG 3.47Å; A412-L416 PolarHBondContact O-N 3.45Å
413	K	96.6	Very high	95.5	Very high	127 Å²	127	62.7 Å²	62.7	55%	0.552	34%	0.338	S	S	*	.	H	α-helix	trans	-59.8	-44.3	173.5	-76.4	166.9	-179.8	168.7	0	111.7	I409 L410 T411 L416 S417	I409-K413 HydrophobicContact CG2-CD 4.06Å; I409-K413 VanDerWaalsContact CG2-CE 3.49Å; I409-K413 WeakPolarHBondContact O-CB 3.49Å; I409-K413 VanDerWaalsContact O-CG 3.24Å; I409-K413 WeakPolarHBondContact O-CG 3.36Å; I409-K413 PolarHBondContact O-N 3.31Å; L410-K413 PolarHBondContact O-N 3.25Å; T411-K413 PolarHBondContact O-N 3.16Å; K413-L416 PolarHBondContact O-N 3.47Å; K413-S417 WeakPolarHBondContact O-CB 3.37Å; K413-S417 PolarHBondContact O-N 3.04Å
414	Q	97.8	Very high	95.9	Very high	105 Å²	105	65.7 Å²	65.7	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-62.1	-50.7	177.6	176.5	57.6	24.6	0	0	111.1	L410 T411 A412 L416 S417 E418	L410-Q414 PolarHBondContact O-N 3.2Å; T411-Q414 PolarHBondContact O-N 2.86Å; A412-Q414 PolarHBondContact O-N 3.05Å; Q414-L416 VanDerWaalsContact C-N 3.32Å; Q414-L416 PolarHBondContact O-N 3.46Å; Q414-S417 WeakPolarHBondContact O-CB 3.47Å; Q414-S417 PolarHBondContact O-N 3.03Å; Q414-S417 PolarHBondContact O-OG 2.92Å; Q414-E418 PolarHBondContact NE2-OE1 3.33Å; Q414-E418 PolarHBondContact O-N 2.96Å
415	A	96.3	Very high	96.2	Very high	15 Å²	15	66.7 Å²	66.7	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-40.4	179.1	0	0	0	0	0	112.9	A369 Q372 T411 A412 E418 V419	A369-A415 HydrophobicContact CB-CB 3.83Å; Q372-A415 VanDerWaalsContact OE1-CB 3.22Å; T411-A415 PolarHBondContact O-N 3.23Å; A412-A415 PolarHBondContact O-N 2.76Å; A415-E418 PolarHBondContact O-N 2.87Å; A415-V419 WeakPolarHBondContact O-CG2 3.28Å; A415-V419 PolarHBondContact O-N 3.22Å
416	L	97.1	Very high	96.4	Very high	51 Å²	51	67.1 Å²	67.1	27%	0.267	34%	0.344	S	S	.	.	H	α-helix	trans	-67.4	-37.4	174.2	-69	167.2	0	0	0	112.7	A369 L373 A412 K413 Q414 E418 V419 T420	A369-L416 HydrophobicContact CB-CD2 4.02Å; A369-L416 HydrophobicContact CB-CG 4.37Å; L373-L416 HydrophobicContact CB-CD1 4.2Å; L373-L416 HydrophobicContact CD1-CD1 4Å; L373-L416 HydrophobicContact CD2-CD1 3.98Å; L373-L416 HydrophobicContact CG-CD1 4.27Å; A412-L416 WeakPolarHBondContact O-CB 3.39Å; A412-L416 WeakPolarHBondContact O-CD1 3.34Å; A412-L416 VanDerWaalsContact O-CG 3.24Å; A412-L416 WeakPolarHBondContact O-CG 3.47Å; A412-L416 PolarHBondContact O-N 3.45Å; K413-L416 PolarHBondContact O-N 3.47Å; Q414-L416 VanDerWaalsContact C-N 3.32Å; Q414-L416 PolarHBondContact O-N 3.46Å; L416-E418 VanDerWaalsContact C-N 3.35Å; L416-V419 PolarHBondContact O-N 3.37Å; L416-T420 WeakPolarHBondContact O-CB 3.47Å; L416-T420 PolarHBondContact O-N 3.42Å; L416-T420 PolarHBondContact O-OG1 3.22Å
417	S	96.9	Very high	96.5	Very high	58 Å²	58	67.8 Å²	67.8	41%	0.406	35%	0.347	S	S	.	.	H	α-helix	trans	-63.7	-41.6	175.7	82.8	0	0	0	0	111.5	K413 Q414 T420 A421	K413-S417 WeakPolarHBondContact O-CB 3.37Å; K413-S417 PolarHBondContact O-N 3.04Å; Q414-S417 WeakPolarHBondContact O-CB 3.47Å; Q414-S417 PolarHBondContact O-N 3.03Å; Q414-S417 PolarHBondContact O-OG 2.92Å; S417-T420 PolarHBondContact O-N 2.83Å; S417-A421 WeakPolarHBondContact O-CB 3.32Å; S417-A421 PolarHBondContact O-N 3.45Å
418	E	96.6	Very high	96.6	Very high	74 Å²	74	67.1 Å²	67.1	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-66.5	-43.5	176.4	-72.4	177.4	-149.9	0	0	112.5	K365 Q414 A415 L416 T420 A421 A422	K365-E418 WeakPolarHBondContact CE-OE2 3.39Å; K365-E418 IonicContact NZ-OE2 3.36Å; K365-E418 PolarHBondContact NZ-OE2 2.79Å; Q414-E418 PolarHBondContact NE2-OE1 3.33Å; Q414-E418 PolarHBondContact O-N 2.96Å; A415-E418 PolarHBondContact O-N 2.87Å; L416-E418 VanDerWaalsContact C-N 3.35Å; E418-T420 VanDerWaalsContact C-N 3.28Å; E418-T420 PolarHBondContact O-N 3.11Å; E418-A421 PolarHBondContact O-N 2.84Å; E418-A422 VanDerWaalsContact O-CB 3.29Å; E418-A422 WeakPolarHBondContact O-CB 3.4Å; E418-A422 PolarHBondContact O-N 3.42Å
419	V	97.6	Very high	96.7	Very high	9 Å²	9	66.8 Å²	66.8	6%	0.055	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-40.7	174.7	169	0	0	0	0	110.3	Y362 K365 K366 A369 A415 L416 L423	Y362-V419 HydrophobicContact CE2-CG1 3.79Å; K365-V419 HydrophobicContact CB-CG2 4.47Å; K365-V419 HydrophobicContact CD-CG2 4.32Å; K365-V419 HydrophobicContact CG-CG2 3.9Å; K366-V419 HydrophobicContact CB-CG1 3.98Å; K366-V419 HydrophobicContact CG-CG1 4.16Å; A369-V419 HydrophobicContact CB-CG2 3.99Å; A415-V419 WeakPolarHBondContact O-CG2 3.28Å; A415-V419 PolarHBondContact O-N 3.22Å; L416-V419 PolarHBondContact O-N 3.37Å; V419-L423 WeakPolarHBondContact O-CB 3.25Å; V419-L423 PolarHBondContact O-N 2.86Å
420	T	96.6	Very high	96.8	Very high	60 Å²	60	65 Å²	65	37%	0.368	33%	0.331	S	S	.	.	H	α-helix	trans	-68.3	-37.4	177.2	-50.2	0	0	0	0	112.2	L416 S417 E418 R424	L416-T420 WeakPolarHBondContact O-CB 3.47Å; L416-T420 PolarHBondContact O-N 3.42Å; L416-T420 PolarHBondContact O-OG1 3.22Å; S417-T420 PolarHBondContact O-N 2.83Å; E418-T420 VanDerWaalsContact C-N 3.28Å; E418-T420 PolarHBondContact O-N 3.11Å; T420-R424 PolarHBondContact O-N 3.13Å
421	A	96.9	Very high	96.8	Very high	55 Å²	55	65.9 Å²	65.9	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-67.1	-48.3	175	0	0	0	0	0	111.5	S417 E418 L423 R424 E425	S417-A421 WeakPolarHBondContact O-CB 3.32Å; S417-A421 PolarHBondContact O-N 3.45Å; E418-A421 PolarHBondContact O-N 2.84Å; A421-L423 VanDerWaalsContact C-N 3.31Å; A421-L423 PolarHBondContact O-N 3.44Å; A421-R424 PolarHBondContact O-N 3.35Å; A421-R424 VanDerWaalsContact O-N 3.15Å; A421-E425 WeakPolarHBondContact O-CB 3.38Å; A421-E425 PolarHBondContact O-N 2.98Å
422	A	94.7	Very high	96.8	Very high	35 Å²	35	67 Å²	67	29%	0.289	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-37.4	176.9	0	0	0	0	0	112.3	E418 R426	E418-A422 VanDerWaalsContact O-CB 3.29Å; E418-A422 WeakPolarHBondContact O-CB 3.4Å; E418-A422 PolarHBondContact O-N 3.42Å; A422-R426 WeakPolarHBondContact O-CB 3.43Å; A422-R426 PolarHBondContact O-N 3.43Å
423	L	95.9	Very high	96.7	Very high	55 Å²	55	69 Å²	69	29%	0.288	34%	0.344	S	S	.	.	H	α-helix	trans	-61.4	-45.1	174.4	-179.1	60.3	0	0	0	112.1	Y362 V419 A421 L427	Y362-L423 HydrophobicContact CE1-CD1 4.46Å; Y362-L423 HydrophobicContact CE2-CB 3.8Å; Y362-L423 HydrophobicContact CE2-CD1 4.3Å; V419-L423 WeakPolarHBondContact O-CB 3.25Å; V419-L423 PolarHBondContact O-N 2.86Å; A421-L423 VanDerWaalsContact C-N 3.31Å; A421-L423 PolarHBondContact O-N 3.44Å; L423-L427 HydrophobicContact CD1-CD1 3.89Å; L423-L427 HydrophobicContact CD1-CG 4.15Å; L423-L427 HydrophobicContact CG-CD1 3.97Å; L423-L427 WeakPolarHBondContact O-CB 3.48Å; L423-L427 VanDerWaalsContact O-CG 3.24Å; L423-L427 WeakPolarHBondContact O-CG 3.21Å; L423-L427 PolarHBondContact O-N 3.26Å
424	R	96.8	Very high	96.6	Very high	172 Å²	172	65 Å²	65	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-67.6	-45.1	179.5	-69.4	-176.2	-172.2	116.1	1.1	111.9	T420 A421 H428	T420-R424 PolarHBondContact O-N 3.13Å; A421-R424 PolarHBondContact O-N 3.35Å; A421-R424 VanDerWaalsContact O-N 3.15Å; R424-H428 WeakPolarHBondContact O-CB 3.26Å; R424-H428 PolarHBondContact O-N 3.36Å
425	E	97	Very high	96.4	Very high	94 Å²	94	65.3 Å²	65.3	44%	0.439	33%	0.331	S	S	.	.	H	α-helix	trans	-57.6	-53.4	176.8	-173.8	-73.5	139.5	0	0	110.3	A421 L427 H428 R429	A421-E425 WeakPolarHBondContact O-CB 3.38Å; A421-E425 PolarHBondContact O-N 2.98Å; E425-L427 PolarHBondContact O-N 2.88Å; E425-H428 PolarHBondContact O-N 3.47Å; E425-R429 WeakPolarHBondContact O-CB 3.48Å; E425-R429 PolarHBondContact O-N 3.42Å; E425-R429 IonicContact OE1-CZ 3.66Å; E425-R429 IonicContact OE1-NE 3.42Å; E425-R429 PolarHBondContact OE1-NE 3.13Å; E425-R429 IonicContact OE1-NH2 3.38Å; E425-R429 IonicContact OE2-CZ 3.97Å; E425-R429 IonicContact OE2-NE 3.05Å; E425-R429 IonicContact OE2-NH2 3.95Å; E425-R429 PolarHBondContact OE2-NH2 3.4Å
426	R	96.1	Very high	96.2	Very high	23 Å²	23	70.7 Å²	70.7	9%	0.087	36%	0.357	C	S	.	.	H	α-helix	trans	-58.5	-48.8	179.9	-179.2	-177.7	74.6	177	3.6	112.6	E358 A422 H428 R429 W430	E358-R426 WeakPolarHBondContact OE1-CD 3.4Å; E358-R426 WeakPolarHBondContact OE1-CG 3.41Å; A422-R426 WeakPolarHBondContact O-CB 3.43Å; A422-R426 PolarHBondContact O-N 3.43Å; R426-H428 VanDerWaalsContact C-N 3.33Å; R426-H428 PolarHBondContact O-N 2.89Å; R426-R429 PolarHBondContact O-N 3.3Å; R426-W430 VanDerWaalsContact CG-CD1 3.46Å; R426-W430 VanDerWaalsContact O-CD1 3.22Å; R426-W430 PolarHBondContact O-N 3.24Å
427	L	95.5	Very high	95.9	Very high	95 Å²	95	69.1 Å²	69.1	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-44.4	179.2	-74.6	171.2	0	0	0	111.3	L423 E425 Q431	L423-L427 HydrophobicContact CD1-CD1 3.89Å; L423-L427 HydrophobicContact CD1-CG 4.15Å; L423-L427 HydrophobicContact CG-CD1 3.97Å; L423-L427 WeakPolarHBondContact O-CB 3.48Å; L423-L427 VanDerWaalsContact O-CG 3.24Å; L423-L427 WeakPolarHBondContact O-CG 3.21Å; L423-L427 PolarHBondContact O-N 3.26Å; E425-L427 PolarHBondContact O-N 2.88Å; L427-Q431 VanDerWaalsContact O-CB 3.3Å; L427-Q431 WeakPolarHBondContact O-CB 3.45Å; L427-Q431 PolarHBondContact O-N 3.24Å; L427-Q431 VanDerWaalsContact O-N 3.09Å
428	H	97.3	Very high	95.6	Very high	111 Å²	111	68.8 Å²	68.8	51%	0.514	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-49.1	177.1	179	-96.6	0	0	0	112.1	R424 E425 R426 W430 Q431 Q432	R424-H428 WeakPolarHBondContact O-CB 3.26Å; R424-H428 PolarHBondContact O-N 3.36Å; E425-H428 PolarHBondContact O-N 3.47Å; R426-H428 VanDerWaalsContact C-N 3.33Å; R426-H428 PolarHBondContact O-N 2.89Å; H428-W430 PolarHBondContact O-N 3.46Å; H428-Q431 PolarHBondContact O-N 2.91Å; H428-Q432 WeakPolarHBondContact O-CG 3.48Å; H428-Q432 PolarHBondContact O-N 2.87Å
429	R	98.2	Very high	95.5	Very high	72 Å²	72	66.5 Å²	66.5	27%	0.272	35%	0.345	S	S	.	.	H	α-helix	trans	-59.8	-48.3	-179.7	169.3	167.7	44.3	80.8	6.3	111.8	E358 E425 R426 Q431 Q432 I433	E358-R429 IonicContact OE1-CZ 2.86Å; E358-R429 IonicContact OE1-NH1 2.66Å; E358-R429 IonicContact OE1-NH2 2.71Å; E358-R429 PolarHBondContact OE1-NH2 2.99Å; E358-R429 IonicContact OE2-CZ 3.55Å; E358-R429 IonicContact OE2-NH1 2.72Å; E358-R429 PolarHBondContact OE2-NH1 2.8Å; E358-R429 IonicContact OE2-NH2 3.32Å; E358-R429 PolarHBondContact OE2-NH2 3.26Å; E425-R429 WeakPolarHBondContact O-CB 3.48Å; E425-R429 PolarHBondContact O-N 3.42Å; E425-R429 IonicContact OE1-CZ 3.66Å; E425-R429 IonicContact OE1-NE 3.42Å; E425-R429 PolarHBondContact OE1-NE 3.13Å; E425-R429 IonicContact OE1-NH2 3.38Å; E425-R429 IonicContact OE2-CZ 3.97Å; E425-R429 IonicContact OE2-NE 3.05Å; E425-R429 IonicContact OE2-NH2 3.95Å; E425-R429 PolarHBondContact OE2-NH2 3.4Å; R426-R429 PolarHBondContact O-N 3.3Å; R429-Q431 PolarHBondContact O-N 3.41Å; R429-Q432 PolarHBondContact O-N 2.85Å; R429-I433 HydrophobicContact CG-CD1 3.68Å; R429-I433 HydrophobicContact CG-CG1 4.43Å; R429-I433 VanDerWaalsContact O-CG1 3.28Å; R429-I433 WeakPolarHBondContact O-CG1 3.36Å; R429-I433 PolarHBondContact O-N 2.88Å
430	W	97.6	Very high	95.3	Very high	6 Å²	6	71.5 Å²	71.5	2%	0.023	37%	0.368	C	S	.	.	H	α-helix	trans	-66.6	-37.2	179	-74.3	109.7	0	0	0	112.4	L351 T354 H355 E358 R426 H428 Q432 I433 E434 I441 V442	L351-W430 HydrophobicContact CB-CZ3 4.13Å; L351-W430 HydrophobicContact CD2-CH2 4.19Å; L351-W430 HydrophobicContact CD2-CZ3 4.04Å; T354-W430 HydrophobicContact CG2-CH2 4.07Å; T354-W430 HydrophobicContact CG2-CZ2 4.12Å; H355-W430 HydrophobicContact CB-CD2 4.11Å; H355-W430 HydrophobicContact CB-CE3 4.38Å; H355-W430 HydrophobicContact CB-CH2 4.07Å; H355-W430 HydrophobicContact CB-CZ2 3.78Å; H355-W430 HydrophobicContact CB-CZ3 4.36Å; H355-W430 AromaticContact CD2-CD1 3.72Å; H355-W430 AromaticContact CD2-CG 3.85Å; H355-W430 AromaticContact CD2-NE1 3.81Å; E358-W430 PolarHBondContact OE2-NE1 3.44Å; R426-W430 VanDerWaalsContact CG-CD1 3.46Å; R426-W430 VanDerWaalsContact O-CD1 3.22Å; R426-W430 PolarHBondContact O-N 3.24Å; H428-W430 PolarHBondContact O-N 3.46Å; W430-Q432 VanDerWaalsContact C-N 3.34Å; W430-Q432 PolarHBondContact O-N 3.28Å; W430-I433 HydrophobicContact CD2-CD1 4.33Å; W430-I433 HydrophobicContact CE3-CB 4.25Å; W430-I433 HydrophobicContact CE3-CD1 3.82Å; W430-I433 HydrophobicContact CE3-CG2 4.31Å; W430-I433 HydrophobicContact CZ3-CD1 3.92Å; W430-I433 HydrophobicContact CZ3-CG2 4.25Å; W430-I433 PolarHBondContact O-N 3.01Å; W430-E434 WeakPolarHBondContact O-CG 3.32Å; W430-E434 PolarHBondContact O-N 3.14Å; W430-I441 HydrophobicContact CE3-CB 4.42Å; W430-I441 HydrophobicContact CE3-CD1 4.17Å; W430-I441 HydrophobicContact CE3-CG2 3.7Å; W430-I441 HydrophobicContact CZ3-CD1 4.22Å; W430-I441 HydrophobicContact CZ3-CG2 3.71Å; W430-V442 HydrophobicContact CB-CG2 3.81Å
431	Q	96.7	Very high	95.2	Very high	109 Å²	109	68.6 Å²	68.6	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-43.4	171.7	-175.2	-178.5	15	0	0	112.1	L427 H428 R429 E434 I435	L427-Q431 VanDerWaalsContact O-CB 3.3Å; L427-Q431 WeakPolarHBondContact O-CB 3.45Å; L427-Q431 PolarHBondContact O-N 3.24Å; L427-Q431 VanDerWaalsContact O-N 3.09Å; H428-Q431 PolarHBondContact O-N 2.91Å; R429-Q431 PolarHBondContact O-N 3.41Å; Q431-E434 PolarHBondContact O-N 3.4Å; Q431-I435 HydrophobicContact CG-CD1 4.16Å; Q431-I435 WeakPolarHBondContact O-CD1 3.37Å; Q431-I435 VanDerWaalsContact O-CG1 3.27Å; Q431-I435 WeakPolarHBondContact O-CG1 3.22Å; Q431-I435 PolarHBondContact O-N 3.3Å; Q431-I435 VanDerWaalsContact O-N 3.08Å
432	Q	97	Very high	95.1	Very high	80 Å²	80	69 Å²	69	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-66.5	-38.2	176.2	-64.7	-56.9	-37.7	0	0	112.3	H428 R429 W430 I435 L436	H428-Q432 WeakPolarHBondContact O-CG 3.48Å; H428-Q432 PolarHBondContact O-N 2.87Å; R429-Q432 PolarHBondContact O-N 2.85Å; W430-Q432 VanDerWaalsContact C-N 3.34Å; W430-Q432 PolarHBondContact O-N 3.28Å; Q432-I435 PolarHBondContact O-N 3Å; Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 VanDerWaalsContact O-CG 3.28Å; Q432-L436 WeakPolarHBondContact O-CG 3.5Å; Q432-L436 PolarHBondContact O-N 3.37Å
433	I	95.8	Very high	95.1	Very high	42 Å²	42	72.7 Å²	72.7	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-66.9	-41.1	176.4	-63.5	164.4	0	0	0	110.8	L351 R429 W430 I435 L436 C437 I441	L351-I433 HydrophobicContact CD1-CG2 4Å; R429-I433 HydrophobicContact CG-CD1 3.68Å; R429-I433 HydrophobicContact CG-CG1 4.43Å; R429-I433 VanDerWaalsContact O-CG1 3.28Å; R429-I433 WeakPolarHBondContact O-CG1 3.36Å; R429-I433 PolarHBondContact O-N 2.88Å; W430-I433 HydrophobicContact CD2-CD1 4.33Å; W430-I433 HydrophobicContact CE3-CB 4.25Å; W430-I433 HydrophobicContact CE3-CD1 3.82Å; W430-I433 HydrophobicContact CE3-CG2 4.31Å; W430-I433 HydrophobicContact CZ3-CD1 3.92Å; W430-I433 HydrophobicContact CZ3-CG2 4.25Å; W430-I433 PolarHBondContact O-N 3.01Å; I433-I435 VanDerWaalsContact C-N 3.34Å; I433-I435 PolarHBondContact O-N 2.6Å; I433-L436 PolarHBondContact O-N 2.92Å; I433-C437 VanDerWaalsContact O-CB 3.32Å; I433-C437 WeakPolarHBondContact O-CB 3.46Å; I433-C437 PolarHBondContact O-N 2.87Å; I433-C437 PolarHBondContact O-SG 2.86Å; I433-I441 HydrophobicContact CB-CD1 4.36Å; I433-I441 HydrophobicContact CG2-CD1 3.58Å
434	E	95	Very high	94.9	Very high	45 Å²	45	71.7 Å²	71.7	21%	0.21	36%	0.356	C	S	.	.	H	α-helix	trans	-60.8	-41.3	174.4	-72.7	-177.9	142.5	0	0	111.9	W430 Q431 G438 I441 V442	W430-E434 WeakPolarHBondContact O-CG 3.32Å; W430-E434 PolarHBondContact O-N 3.14Å; Q431-E434 PolarHBondContact O-N 3.4Å; E434-G438 PolarHBondContact O-N 2.99Å; E434-I441 HydrophobicContact CG-CB 3.86Å; E434-I441 HydrophobicContact CG-CD1 3.88Å; E434-I441 HydrophobicContact CG-CG1 3.87Å; E434-I441 PolarHBondContact OE1-N 3.22Å; E434-V442 PolarHBondContact OE1-N 2.81Å
435	I	93.4	Very high	94.7	Very high	111 Å²	111	67.7 Å²	67.7	57%	0.569	35%	0.353	S	S	*	.	H	α-helix	trans	-63.5	-43.9	175.1	-69.3	164.3	0	0	0	111.4	Q431 Q432 I433	Q431-I435 HydrophobicContact CG-CD1 4.16Å; Q431-I435 WeakPolarHBondContact O-CD1 3.37Å; Q431-I435 VanDerWaalsContact O-CG1 3.27Å; Q431-I435 WeakPolarHBondContact O-CG1 3.22Å; Q431-I435 PolarHBondContact O-N 3.3Å; Q431-I435 VanDerWaalsContact O-N 3.08Å; Q432-I435 PolarHBondContact O-N 3Å; I433-I435 VanDerWaalsContact C-N 3.34Å; I433-I435 PolarHBondContact O-N 2.6Å
436	L	91.8	Very high	94.4	Very high	128 Å²	128	64.2 Å²	64.2	67%	0.67	34%	0.342	S	S	*	.	H	α-helix	trans	-73.8	-29	-179	-70.3	170	0	0	0	113.6	Q432 I433	Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 VanDerWaalsContact O-CG 3.28Å; Q432-L436 WeakPolarHBondContact O-CG 3.5Å; Q432-L436 PolarHBondContact O-N 3.37Å; I433-L436 PolarHBondContact O-N 2.92Å
437	C	91.6	Very high	94.1	Very high	17 Å²	17	64.3 Å²	64.3	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-95	-15.4	-179.8	-67.7	0	0	0	0	114.3	A343 I433 F439	A343-C437 HydrophobicContact CB-CB 3.9Å; I433-C437 VanDerWaalsContact O-CB 3.32Å; I433-C437 WeakPolarHBondContact O-CB 3.46Å; I433-C437 PolarHBondContact O-N 2.87Å; I433-C437 PolarHBondContact O-SG 2.86Å; C437-F439 VanDerWaalsContact C-N 3.29Å; C437-F439 HydrophobicContact CB-CD1 4.25Å; C437-F439 HydrophobicContact CB-CD2 3.99Å; C437-F439 HydrophobicContact CB-CE1 3.91Å; C437-F439 HydrophobicContact CB-CE2 3.59Å; C437-F439 HydrophobicContact CB-CG 4.3Å; C437-F439 HydrophobicContact CB-CZ 3.55Å; C437-F439 WeakPolarHBondContact O-CD1 3.28Å; C437-F439 PolarHBondContact O-N 2.91Å
438	G	90.7	Very high	93.9	Very high	52 Å²	52	67.5 Å²	67.5	54%	0.536	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	14.4	178	0	0	0	0	0	115.1	E434	E434-G438 PolarHBondContact O-N 2.99Å
439	F	92.9	Very high	93.6	Very high	26 Å²	26	65.2 Å²	65.2	11%	0.114	35%	0.353	C	S	.	.	S	Bend	trans	-139.7	158.7	-179.4	54.6	-126.4	0	0	0	113.1	A343 Q348 L351 C437 I441	A343-F439 HydrophobicContact CB-CD1 4.22Å; A343-F439 HydrophobicContact CB-CE1 3.4Å; A343-F439 VanDerWaalsContact CB-CE1 3.4Å; A343-F439 HydrophobicContact CB-CZ 3.97Å; Q348-F439 HydrophobicContact CB-CD1 3.98Å; Q348-F439 HydrophobicContact CB-CD2 3.9Å; Q348-F439 HydrophobicContact CB-CE1 3.69Å; Q348-F439 HydrophobicContact CB-CE2 3.65Å; Q348-F439 HydrophobicContact CB-CG 4.09Å; Q348-F439 HydrophobicContact CB-CZ 3.54Å; Q348-F439 HydrophobicContact CG-CB 4.47Å; Q348-F439 HydrophobicContact CG-CD1 4.27Å; Q348-F439 HydrophobicContact CG-CD2 3.56Å; Q348-F439 HydrophobicContact CG-CE1 4.38Å; Q348-F439 HydrophobicContact CG-CE2 3.74Å; Q348-F439 HydrophobicContact CG-CG 3.87Å; Q348-F439 HydrophobicContact CG-CZ 4.16Å; L351-F439 HydrophobicContact CD1-CE2 4.08Å; L351-F439 HydrophobicContact CD1-CZ 4.16Å; C437-F439 VanDerWaalsContact C-N 3.29Å; C437-F439 HydrophobicContact CB-CD1 4.25Å; C437-F439 HydrophobicContact CB-CD2 3.99Å; C437-F439 HydrophobicContact CB-CE1 3.91Å; C437-F439 HydrophobicContact CB-CE2 3.59Å; C437-F439 HydrophobicContact CB-CG 4.3Å; C437-F439 HydrophobicContact CB-CZ 3.55Å; C437-F439 WeakPolarHBondContact O-CD1 3.28Å; C437-F439 PolarHBondContact O-N 2.91Å; F439-I441 HydrophobicContact CD2-CD1 4.18Å; F439-I441 HydrophobicContact CD2-CG1 3.75Å; F439-I441 HydrophobicContact CE2-CD1 3.84Å; F439-I441 HydrophobicContact CE2-CG1 3.74Å
440	Q	93.8	Very high	93.3	Very high	113 Å²	113	61.9 Å²	61.9	53%	0.528	34%	0.34	S	S	.	.			trans	-76.8	137.6	177.2	-71.6	176.2	55.2	0	0	111.9	Q348 Q352 N443	Q348-Q440 PolarHBondContact NE2-O 2.8Å; Q352-Q440 PolarHBondContact NE2-O 3.02Å; Q440-N443 PolarHBondContact OE1-ND2 2.86Å
441	I	95.5	Very high	93	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-127.7	-44.9	-177.9	-56.7	169.9	0	0	0	110.5	L351 Q352 H355 W430 I433 E434 F439 N444	L351-I441 HydrophobicContact CB-CD1 4.13Å; L351-I441 HydrophobicContact CB-CG1 4.43Å; L351-I441 HydrophobicContact CB-CG2 4.15Å; L351-I441 HydrophobicContact CD1-CD1 4Å; Q352-I441 HydrophobicContact CG-CB 4.46Å; Q352-I441 HydrophobicContact CG-CG2 4.17Å; H355-I441 HydrophobicContact CB-CG2 3.91Å; W430-I441 HydrophobicContact CE3-CB 4.42Å; W430-I441 HydrophobicContact CE3-CD1 4.17Å; W430-I441 HydrophobicContact CE3-CG2 3.7Å; W430-I441 HydrophobicContact CZ3-CD1 4.22Å; W430-I441 HydrophobicContact CZ3-CG2 3.71Å; I433-I441 HydrophobicContact CB-CD1 4.36Å; I433-I441 HydrophobicContact CG2-CD1 3.58Å; E434-I441 HydrophobicContact CG-CB 3.86Å; E434-I441 HydrophobicContact CG-CD1 3.88Å; E434-I441 HydrophobicContact CG-CG1 3.87Å; E434-I441 PolarHBondContact OE1-N 3.22Å; F439-I441 HydrophobicContact CD2-CD1 4.18Å; F439-I441 HydrophobicContact CD2-CG1 3.75Å; F439-I441 HydrophobicContact CE2-CD1 3.84Å; F439-I441 HydrophobicContact CE2-CG1 3.74Å; I441-N444 PolarHBondContact O-ND2 3.46Å
442	V	94.2	Very high	92.6	Very high	62 Å²	62	60.4 Å²	60.4	38%	0.376	35%	0.346	S	S	.	.	S	Bend	trans	-68.2	-41	-178.4	178.1	0	0	0	0	110.5	W430 E434 N444	W430-V442 HydrophobicContact CB-CG2 3.81Å; E434-V442 PolarHBondContact OE1-N 2.81Å; V442-N444 PolarHBondContact O-ND2 3.3Å
443	N	93.5	Very high	92.2	Very high	114 Å²	114	59.5 Å²	59.5	61%	0.61	35%	0.353	S	S	*	.	S	Bend	trans	-89.9	104.8	170.9	-178.9	36.1	0	0	0	109.5	Q440	Q440-N443 PolarHBondContact OE1-ND2 2.86Å
444	N	93.6	Very high	92	Very high	33 Å²	33	59 Å²	59	18%	0.176	35%	0.35	C	S	.	.			trans	-146.8	167	-171.8	73.1	69	0	0	0	110.7	Q352 H355 I441 V442 G446	Q352-N444 HydrophobicContact CB-CB 4.06Å; Q352-N444 HydrophobicContact CG-CB 3.77Å; H355-N444 PolarHBondContact ND1-ND2 3.3Å; I441-N444 PolarHBondContact O-ND2 3.46Å; V442-N444 PolarHBondContact O-ND2 3.3Å; N444-G446 PolarHBondContact O-N 3.24Å; N444-G446 WeakPolarHBondContact OD1-CA 3.39Å; N444-G446 PolarHBondContact OD1-N 2.87Å
445	P	92.2	Very high	91.7	Very high	89 Å²	89	64.2 Å²	64.2	58%	0.578	38%	0.379	S	S	*	.	S	Bend	trans	-76.4	1.5	-174.8	31.4	-36.1	0	0	0	115.2	L450	P445-L450 HydrophobicContact CG-CD2 4.16Å; P445-L450 HydrophobicContact CG-CG 4.28Å
446	G	89.9	Confident	91.3	Very high	21 Å²	21	60 Å²	60	22%	0.216	36%	0.358	C	S	.	.			trans	89.3	163.7	178.2	0	0	0	0	0	114.6	N444 H448 S449 L450	N444-G446 PolarHBondContact O-N 3.24Å; N444-G446 WeakPolarHBondContact OD1-CA 3.39Å; N444-G446 PolarHBondContact OD1-N 2.87Å; G446-H448 PolarHBondContact O-N 3.36Å; G446-S449 PolarHBondContact O-N 2.88Å; G446-L450 WeakPolarHBondContact O-CG 3.27Å; G446-L450 PolarHBondContact O-N 3.39Å
447	I	91.1	Very high	90.7	Very high	25 Å²	25	57.5 Å²	57.5	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-56.6	-43.8	-163	-153.5	167.6	0	0	0	113.8	L353 E356 V357 S449 L450 V451 M461	L353-I447 HydrophobicContact CD1-CD1 4.46Å; L353-I447 HydrophobicContact CD1-CG1 3.78Å; E356-I447 HydrophobicContact CG-CB 3.57Å; E356-I447 HydrophobicContact CG-CD1 4.19Å; E356-I447 HydrophobicContact CG-CG1 3.97Å; V357-I447 HydrophobicContact CG2-CD1 4.08Å; I447-S449 PolarHBondContact O-N 3.29Å; I447-L450 PolarHBondContact O-N 3.1Å; I447-V451 HydrophobicContact CG1-CG2 4.36Å; I447-V451 WeakPolarHBondContact O-CB 3.42Å; I447-V451 VanDerWaalsContact O-CG2 3.27Å; I447-V451 WeakPolarHBondContact O-CG2 3.43Å; I447-V451 PolarHBondContact O-N 3.14Å; I447-M461 HydrophobicContact CD1-SD 3.54Å; I447-M461 VanDerWaalsContact CD1-SD 3.54Å; I447-M461 HydrophobicContact CG1-SD 3.84Å
448	H	89.4	Confident	89.7	Confident	161 Å²	161	61 Å²	61	75%	0.745	37%	0.367	S	S	*	.	H	α-helix	trans	-67.6	-38.4	-174.6	-57.6	-62.7	0	0	0	112.4	G446 A452	G446-H448 PolarHBondContact O-N 3.36Å; H448-A452 WeakPolarHBondContact O-CB 3.23Å; H448-A452 PolarHBondContact O-N 3.46Å; H448-A452 VanDerWaalsContact O-N 3.12Å
449	S	91.8	Very high	88.6	Confident	63 Å²	63	62.3 Å²	62.3	44%	0.441	37%	0.369	S	S	.	.	H	α-helix	trans	-68.8	-36.9	175.3	-61.9	0	0	0	0	111.9	G446 I447 A453	G446-S449 PolarHBondContact O-N 2.88Å; I447-S449 PolarHBondContact O-N 3.29Å; S449-A453 VanDerWaalsContact O-CB 3.25Å; S449-A453 WeakPolarHBondContact O-CB 3.44Å; S449-A453 PolarHBondContact O-N 3.43Å
450	L	91.8	Very high	87.3	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.016	40%	0.4	C	S	.	.	H	α-helix	trans	-70.7	-42.5	177.6	-66.2	165.5	0	0	0	112.2	Q352 L353 P445 G446 I447 A452 A453 L454	Q352-L450 HydrophobicContact CB-CD1 3.81Å; Q352-L450 HydrophobicContact CB-CD2 3.73Å; Q352-L450 HydrophobicContact CB-CG 4.44Å; L353-L450 HydrophobicContact CB-CB 4.39Å; L353-L450 HydrophobicContact CD1-CB 4.37Å; P445-L450 HydrophobicContact CG-CD2 4.16Å; P445-L450 HydrophobicContact CG-CG 4.28Å; G446-L450 WeakPolarHBondContact O-CG 3.27Å; G446-L450 PolarHBondContact O-N 3.39Å; I447-L450 PolarHBondContact O-N 3.1Å; L450-A452 VanDerWaalsContact C-N 3.34Å; L450-A452 PolarHBondContact O-N 3.24Å; L450-A453 PolarHBondContact O-N 3.38Å; L450-L454 WeakPolarHBondContact O-CB 3.39Å; L450-L454 WeakPolarHBondContact O-CG 3.37Å; L450-L454 PolarHBondContact O-N 3.07Å
451	V	90.8	Very high	85.9	Confident	17 Å²	17	69 Å²	69	10%	0.103	39%	0.392	C	S	.	.	H	α-helix	trans	-59.3	-44.5	174.3	165.5	0	0	0	0	111.3	L353 I447 L454 N455 I456 M461	L353-V451 HydrophobicContact CD1-CG2 4.04Å; I447-V451 HydrophobicContact CG1-CG2 4.36Å; I447-V451 WeakPolarHBondContact O-CB 3.42Å; I447-V451 VanDerWaalsContact O-CG2 3.27Å; I447-V451 WeakPolarHBondContact O-CG2 3.43Å; I447-V451 PolarHBondContact O-N 3.14Å; V451-L454 PolarHBondContact O-N 3.3Å; V451-N455 PolarHBondContact O-N 3.33Å; V451-N455 VanDerWaalsContact O-N 3.12Å; V451-I456 HydrophobicContact CG1-CB 4.25Å; V451-I456 WeakPolarHBondContact CG1-O 3.25Å; V451-I456 PolarHBondContact O-N 2.8Å; V451-M461 HydrophobicContact CG2-CE 3.46Å; V451-M461 VanDerWaalsContact CG2-CE 3.46Å; V451-M461 HydrophobicContact CG2-SD 3.61Å
452	A	89.2	Confident	84	Confident	66 Å²	66	72.1 Å²	72.1	55%	0.545	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-46.7	174.8	0	0	0	0	0	112	H448 L450 L454 N455	H448-A452 WeakPolarHBondContact O-CB 3.23Å; H448-A452 PolarHBondContact O-N 3.46Å; H448-A452 VanDerWaalsContact O-N 3.12Å; L450-A452 VanDerWaalsContact C-N 3.34Å; L450-A452 PolarHBondContact O-N 3.24Å; A452-L454 PolarHBondContact O-N 3.48Å; A452-N455 PolarHBondContact O-N 3.43Å; A452-N455 VanDerWaalsContact O-N 3.1Å
453	A	89.3	Confident	81.7	Confident	62 Å²	62	74 Å²	74	51%	0.512	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-20.5	179.8	0	0	0	0	0	114.2	S449 L450	S449-A453 VanDerWaalsContact O-CB 3.25Å; S449-A453 WeakPolarHBondContact O-CB 3.44Å; S449-A453 PolarHBondContact O-N 3.43Å; L450-A453 PolarHBondContact O-N 3.38Å
454	L	89.8	Confident	79.3	Confident	32 Å²	32	74.6 Å²	74.6	17%	0.168	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-0.6	175.3	-69.3	169.9	0	0	0	113.6	K349 W350 L353 L450 V451 A452 I456	K349-L454 HydrophobicContact CB-CD1 4.41Å; K349-L454 HydrophobicContact CB-CD2 3.77Å; K349-L454 HydrophobicContact CB-CG 4.17Å; W350-L454 HydrophobicContact CD2-CD1 4Å; W350-L454 HydrophobicContact CD2-CD2 4.19Å; W350-L454 HydrophobicContact CE3-CD1 4.02Å; W350-L454 HydrophobicContact CG-CD1 4.44Å; W350-L454 HydrophobicContact CG-CD2 4.3Å; W350-L454 HydrophobicContact CZ2-CD2 4.33Å; W350-L454 HydrophobicContact CZ3-CD1 4.36Å; L353-L454 HydrophobicContact CB-CD1 4.15Å; L353-L454 HydrophobicContact CD2-CD1 3.79Å; L450-L454 WeakPolarHBondContact O-CB 3.39Å; L450-L454 WeakPolarHBondContact O-CG 3.37Å; L450-L454 PolarHBondContact O-N 3.07Å; V451-L454 PolarHBondContact O-N 3.3Å; A452-L454 PolarHBondContact O-N 3.48Å; L454-I456 VanDerWaalsContact C-N 3.27Å; L454-I456 HydrophobicContact CB-CD1 3.64Å; L454-I456 HydrophobicContact CB-CG1 3.8Å; L454-I456 HydrophobicContact CD1-CD1 3.88Å; L454-I456 HydrophobicContact CG-CD1 4.42Å; L454-I456 PolarHBondContact O-N 3.49Å
455	N	88.8	Confident	76.6	Confident	153 Å²	153	84.3 Å²	84.3	82%	0.818	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	39.1	-175	-62.3	-69.9	0	0	0	114.1	V451 A452	V451-N455 PolarHBondContact O-N 3.33Å; V451-N455 VanDerWaalsContact O-N 3.12Å; A452-N455 PolarHBondContact O-N 3.43Å; A452-N455 VanDerWaalsContact O-N 3.1Å
456	I	84.8	Confident	74.2	Confident	23 Å²	23	86 Å²	86	12%	0.118	49%	0.494	C	S	.	.			trans	-83.1	134.5	-179	-65	166.5	0	0	0	110.1	W350 L353 V451 L454 P458 W460	W350-I456 HydrophobicContact CH2-CD1 3.61Å; W350-I456 HydrophobicContact CH2-CG1 4.03Å; W350-I456 HydrophobicContact CZ3-CD1 3.61Å; W350-I456 HydrophobicContact CZ3-CG1 4.5Å; L353-I456 HydrophobicContact CD2-CD1 3.26Å; V451-I456 HydrophobicContact CG1-CB 4.25Å; V451-I456 WeakPolarHBondContact CG1-O 3.25Å; V451-I456 PolarHBondContact O-N 2.8Å; L454-I456 VanDerWaalsContact C-N 3.27Å; L454-I456 HydrophobicContact CB-CD1 3.64Å; L454-I456 HydrophobicContact CB-CG1 3.8Å; L454-I456 HydrophobicContact CD1-CD1 3.88Å; L454-I456 HydrophobicContact CG-CD1 4.42Å; L454-I456 PolarHBondContact O-N 3.49Å; I456-P458 WeakPolarHBondContact O-CD 3.27Å; I456-W460 HydrophobicContact CG2-CE3 4.45Å
457	D	80.4	Confident	71.4	Confident	75 Å²	75	92.2 Å²	92.2	40%	0.401	52%	0.522	S	S	.	.			trans	-61.5	120.1	175.3	177.8	4.2	0	0	0	111	S459 W460	D457-S459 PolarHBondContact O-N 3.48Å; D457-S459 VanDerWaalsContact OD1-CB 3.32Å; D457-S459 WeakPolarHBondContact OD1-CB 3.42Å; D457-S459 PolarHBondContact OD1-N 3.08Å; D457-S459 PolarHBondContact OD1-OG 2.71Å; D457-S459 WeakPolarHBondContact OD2-CB 3.45Å; D457-S459 PolarHBondContact OD2-OG 3.04Å; D457-W460 HydrophobicContact CB-CG 4.44Å; D457-W460 PolarHBondContact O-N 3.14Å
458	P	69.6	Low	69	Low	90 Å²	90	96.4 Å²	96.4	58%	0.584	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-55.5	-21.9	175.8	-26.6	36	0	0	0	114.5	I456 W460 M461	I456-P458 WeakPolarHBondContact O-CD 3.27Å; P458-W460 PolarHBondContact O-N 3.13Å; P458-M461 PolarHBondContact O-N 3.23Å
459	S	68.9	Low	66.6	Low	81 Å²	81	92.8 Å²	92.8	57%	0.566	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-63.1	-26.1	177.2	87.7	0	0	0	0	113.2	D457 M461	D457-S459 PolarHBondContact O-N 3.48Å; D457-S459 VanDerWaalsContact OD1-CB 3.32Å; D457-S459 WeakPolarHBondContact OD1-CB 3.42Å; D457-S459 PolarHBondContact OD1-N 3.08Å; D457-S459 PolarHBondContact OD1-OG 2.71Å; D457-S459 WeakPolarHBondContact OD2-CB 3.45Å; D457-S459 PolarHBondContact OD2-OG 3.04Å; S459-M461 VanDerWaalsContact C-N 3.3Å; S459-M461 PolarHBondContact O-N 2.86Å
460	W	65.3	Low	63.9	Low	203 Å²	203	97.6 Å²	97.6	77%	0.769	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-77.2	-17	-179.6	-62.9	8.4	0	0	0	112.7	I456 D457 P458 G462	I456-W460 HydrophobicContact CG2-CE3 4.45Å; D457-W460 HydrophobicContact CB-CG 4.44Å; D457-W460 PolarHBondContact O-N 3.14Å; P458-W460 PolarHBondContact O-N 3.13Å; W460-G462 VanDerWaalsContact C-N 3.32Å; W460-G462 PolarHBondContact O-N 3.49Å
461	M	63	Low	61	Low	75 Å²	75	106.9 Å²	106.9	37%	0.369	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-93.1	17.3	-173.9	-150.1	148.7	-68.3	0	0	113.8	L353 I447 V451 P458 S459 S463	L353-M461 HydrophobicContact CD1-CE 4.27Å; I447-M461 HydrophobicContact CD1-SD 3.54Å; I447-M461 VanDerWaalsContact CD1-SD 3.54Å; I447-M461 HydrophobicContact CG1-SD 3.84Å; V451-M461 HydrophobicContact CG2-CE 3.46Å; V451-M461 VanDerWaalsContact CG2-CE 3.46Å; V451-M461 HydrophobicContact CG2-SD 3.61Å; P458-M461 PolarHBondContact O-N 3.23Å; S459-M461 VanDerWaalsContact C-N 3.3Å; S459-M461 PolarHBondContact O-N 2.86Å; M461-S463 VanDerWaalsContact C-N 3.32Å; M461-S463 PolarHBondContact O-N 3.1Å
462	G	56.8	Low	58.9	Low	66 Å²	66	111.8 Å²	111.8	68%	0.68	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.6	12.7	170.8	0	0	0	0	0	115.9	W460 T464	W460-G462 VanDerWaalsContact C-N 3.32Å; W460-G462 PolarHBondContact O-N 3.49Å; G462-T464 PolarHBondContact O-N 3.36Å
463	S	45.3	Very low	56.4	Low	101 Å²	101	117.3 Å²	117.3	71%	0.706	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-65.3	117.3	179.4	-167.8	0	0	0	0	111.5	M461	M461-S463 VanDerWaalsContact C-N 3.32Å; M461-S463 PolarHBondContact O-N 3.1Å
464	T	44.2	Very low	54	Low	128 Å²	128	118.9 Å²	118.9	79%	0.785	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-67	133.6	176.6	47.7	0	0	0	0	110.8	G462	G462-T464 PolarHBondContact O-N 3.36Å
465	R	36.1	Very low	51.5	Low	237 Å²	237	123.6 Å²	123.6	89%	0.894	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-51.3	137.2	-178.7	-67.9	-178.4	175.7	-170.5	-2.2	112.4	N467	R465-N467 PolarHBondContact O-N 3.26Å
466	P	41.9	Very low	49.4	Very low	125 Å²	125	123.2 Å²	123.2	81%	0.812	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-65.4	132.7	161.8	29.5	-32.9	0	0	0	109.4
467	N	31.3	Very low	47.5	Very low	151 Å²	151	129.3 Å²	129.3	81%	0.807	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-85.1	135.1	173.5	-167.8	41.7	0	0	0	109.6	R465	R465-N467 PolarHBondContact O-N 3.26Å
468	P	40.8	Very low	46.2	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-60.6	154.3	171.7	-22.3	34.5	0	0	0	112.3
469	A	38.9	Very low	45.2	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-90.3	172.6	-161.8	0	0	0	0	0	115.7
470	H	35	Very low	44.3	Very low	164 Å²	164	140.4 Å²	140.4	76%	0.759	76%	0.756	S	S	*	*			trans	69.3	112.5	167.6	-61.4	-80.2	0	0	0	119
471	F	30.8	Very low	43.7	Very low	198 Å²	198	137.7 Å²	137.7	87%	0.868	76%	0.756	S	S	*	*				-143.3	157	96.8	-146.8	-101.1	0	0	0	110.7
472	I	46.6	Very low	43	Very low	121 Å²	121	143 Å²	143	62%	0.621	78%	0.78	S	S	*	*			trans	-113.6	138.3	176.8	-64.4	172.1	0	0	0	108.2	T474	I472-T474 HydrophobicContact CG2-CG2 4.24Å
473	M	36.3	Very low	42.4	Very low	181 Å²	181	148 Å²	148	89%	0.892	79%	0.786	S	S	*	*			trans	-143.2	139.5	153.5	-120.3	168.1	70.6	0	0	108.5
474	T	39.6	Very low	42.4	Very low	96 Å²	96	150.6 Å²	150.6	59%	0.589	79%	0.79	S	S	*	*			trans	-103.3	172.4	-174.6	52.5	0	0	0	0	111.2	I472	I472-T474 HydrophobicContact CG2-CG2 4.24Å
475	D	37.7	Very low	42.2	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	78%	0.776	S	S	*	*			trans	69.1	135.7	163.5	-39.6	-34.6	0	0	0	115
476	D	43.6	Very low	42.6	Very low	145 Å²	145	140.1 Å²	140.1	78%	0.775	76%	0.755	S	S	*	*			cis	-154.8	130.5	-3.2	-103	-30.5	0	0	0	109
477	V	45.8	Very low	42.8	Very low	150 Å²	150	139.3 Å²	139.3	91%	0.909	75%	0.75	S	S	*	*			trans	-179.2	130.5	137.1	-95	0	0	0	0	110.8
478	D	52.1	Low	43.2	Very low	169 Å²	169	138.3 Å²	138.3	90%	0.904	74%	0.743	S	S	*	*			trans	-78.3	126.5	162	-67.9	-62.1	0	0	0	110.5
479	D	49.6	Very low	43.3	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	73%	0.728	S	S	*	*			trans	-155.7	146	146.2	-150.4	-5.5	0	0	0	111.4
480	M	49.3	Very low	43.8	Very low	155 Å²	155	136 Å²	136	76%	0.764	72%	0.716	S	S	*	*			trans	-40.2	133.2	-156.6	-70.9	171.1	45	0	0	120.7
481	D	53.7	Low	44.1	Very low	146 Å²	146	134 Å²	134	78%	0.781	71%	0.707	S	S	*	*			trans	-32.8	121.4	157.1	26.8	-71.6	0	0	0	118.7
482	E	47.9	Very low	44.3	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	70%	0.696	S	S	*	*			trans	-141.9	100.3	143.8	-90.9	-71.8	-174.6	0	0	106.9	I484	E482-I484 PolarHBondContact O-N 3.23Å
483	E	43.8	Very low	44.1	Very low	171 Å²	171	129 Å²	129	80%	0.799	69%	0.687	S	S	*	*			trans	-70.4	129.1	-163.1	-165.9	-172.9	160.9	0	0	113.4	V485	E483-V485 PolarHBondContact O-N 3.19Å
484	I	45.2	Very low	44.5	Very low	155 Å²	155	123.8 Å²	123.8	80%	0.795	67%	0.673	S	S	*	*			trans	-71.1	92.4	174.2	-59.3	175.3	0	0	0	109.4	E482 S486	E482-I484 PolarHBondContact O-N 3.23Å; I484-S486 VanDerWaalsContact C-N 3.3Å; I484-S486 PolarHBondContact O-N 3.46Å
485	V	40.9	Very low	45	Very low	80 Å²	80	128.3 Å²	128.3	49%	0.485	68%	0.679	S	S	.	*			trans	-63.7	89.7	172.8	-173.2	0	0	0	0	110	E483 S489 M490	E483-V485 PolarHBondContact O-N 3.19Å; V485-S489 WeakPolarHBondContact CG1-OG 3.48Å; V485-M490 HydrophobicContact CB-CE 4.37Å; V485-M490 HydrophobicContact CG1-CE 3.92Å; V485-M490 HydrophobicContact CG1-CG 3.86Å; V485-M490 HydrophobicContact CG1-SD 4.49Å
486	S	42.8	Very low	45.2	Very low	66 Å²	66	127.3 Å²	127.3	46%	0.462	67%	0.674	S	S	.	*			trans	-52.6	138.7	176.9	179.4	0	0	0	0	110.8	I484 L488 S489	I484-S486 VanDerWaalsContact C-N 3.3Å; I484-S486 PolarHBondContact O-N 3.46Å; S486-L488 PolarHBondContact O-N 3.22Å; S486-S489 PolarHBondContact O-N 2.97Å; S486-S489 PolarHBondContact O-OG 3.47Å
487	P	46	Very low	45.5	Very low	108 Å²	108	128.5 Å²	128.5	70%	0.701	68%	0.676	S	S	*	*	H	α-helix	trans	-52.4	-24.7	-174.8	-29.9	36	0	0	0	115.5
488	L	40	Very low	45.2	Very low	129 Å²	129	124.3 Å²	124.3	68%	0.675	66%	0.663	S	S	*	*	H	α-helix	trans	-69.6	-34.5	-179.4	-154.9	70	0	0	0	113.4	S486 Q491 Y492	S486-L488 PolarHBondContact O-N 3.22Å; L488-Q491 PolarHBondContact O-N 3.48Å; L488-Y492 PolarHBondContact O-N 2.88Å
489	S	43.8	Very low	44.9	Very low	60 Å²	60	127.2 Å²	127.2	42%	0.42	66%	0.662	S	S	.	*	H	α-helix	trans	-75.8	-35.5	-177.8	60.4	0	0	0	0	112.4	V485 S486 Q491 Y492 A493	V485-S489 WeakPolarHBondContact CG1-OG 3.48Å; S486-S489 PolarHBondContact O-N 2.97Å; S486-S489 PolarHBondContact O-OG 3.47Å; S489-Q491 VanDerWaalsContact C-N 3.27Å; S489-Q491 PolarHBondContact O-N 3.12Å; S489-Y492 PolarHBondContact O-N 3.23Å; S489-A493 PolarHBondContact O-N 3.3Å
490	M	48.8	Very low	44.1	Very low	89 Å²	89	131.3 Å²	131.3	44%	0.438	67%	0.666	S	S	.	*	H	α-helix	trans	-60.1	-35.7	171.1	-85.3	-176.9	-86.3	0	0	112.6	V485 A494	V485-M490 HydrophobicContact CB-CE 4.37Å; V485-M490 HydrophobicContact CG1-CE 3.92Å; V485-M490 HydrophobicContact CG1-CG 3.86Å; V485-M490 HydrophobicContact CG1-SD 4.49Å; M490-A494 WeakPolarHBondContact O-CB 3.34Å; M490-A494 PolarHBondContact O-N 3.06Å; M490-A494 VanDerWaalsContact O-N 3.08Å
491	Q	41.2	Very low	43.1	Very low	121 Å²	121	134 Å²	134	57%	0.565	67%	0.673	S	S	*	*	H	α-helix	trans	-68.4	-36.7	178	-159.7	168.5	45.1	0	0	111.7	L488 S489 W495	L488-Q491 PolarHBondContact O-N 3.48Å; S489-Q491 VanDerWaalsContact C-N 3.27Å; S489-Q491 PolarHBondContact O-N 3.12Å; Q491-W495 PolarHBondContact O-N 3.12Å
492	Y	36.3	Very low	42	Very low	161 Å²	161	133.3 Å²	133.3	63%	0.631	68%	0.68	S	S	*	*	H	α-helix	trans	-70.3	-40.6	175.6	-135.4	-95.5	0	0	0	112.7	L488 S489 W495 L496	L488-Y492 PolarHBondContact O-N 2.88Å; S489-Y492 PolarHBondContact O-N 3.23Å; Y492-W495 WeakPolarHBondContact O-CB 3.32Å; Y492-W495 PolarHBondContact O-N 2.87Å; Y492-L496 HydrophobicContact CD1-CD1 4.13Å; Y492-L496 PolarHBondContact O-N 3.03Å; Y492-L496 VanDerWaalsContact O-N 3.11Å
493	A	42.1	Very low	41.1	Very low	54 Å²	54	131.8 Å²	131.8	45%	0.446	68%	0.678	S	S	.	*	H	α-helix	trans	-64.1	-39.4	175.9	0	0	0	0	0	112.5	S489 W495 L496 M497	S489-A493 PolarHBondContact O-N 3.3Å; A493-W495 VanDerWaalsContact C-N 3.31Å; A493-W495 PolarHBondContact O-N 2.93Å; A493-L496 PolarHBondContact O-N 3.34Å; A493-M497 WeakPolarHBondContact O-CG 3.46Å; A493-M497 PolarHBondContact O-N 3.31Å
494	A	45.3	Very low	40.4	Very low	71 Å²	71	133.8 Å²	133.8	59%	0.587	68%	0.678	S	S	*	*	H	α-helix	trans	-64	-34.9	174.8	0	0	0	0	0	112.7	M490	M490-A494 WeakPolarHBondContact O-CB 3.34Å; M490-A494 PolarHBondContact O-N 3.06Å; M490-A494 VanDerWaalsContact O-N 3.08Å
495	W	48.8	Very low	39.4	Very low	191 Å²	191	132 Å²	132	72%	0.723	68%	0.68	S	S	*	*	H	α-helix	trans	-68.5	-45.9	176.6	-171.5	85.7	0	0	0	112.1	Q491 Y492 A493 M497 G498	Q491-W495 PolarHBondContact O-N 3.12Å; Y492-W495 WeakPolarHBondContact O-CB 3.32Å; Y492-W495 PolarHBondContact O-N 2.87Å; A493-W495 VanDerWaalsContact C-N 3.31Å; A493-W495 PolarHBondContact O-N 2.93Å; W495-M497 PolarHBondContact O-N 2.6Å; W495-G498 PolarHBondContact O-N 3.36Å
496	L	42.9	Very low	38.8	Very low	111 Å²	111	134.9 Å²	134.9	58%	0.581	69%	0.692	S	S	*	*	H	α-helix	trans	-63.2	-37.4	-179.7	-82.4	162.5	0	0	0	113.7	Y492 A493 G498	Y492-L496 HydrophobicContact CD1-CD1 4.13Å; Y492-L496 PolarHBondContact O-N 3.03Å; Y492-L496 VanDerWaalsContact O-N 3.11Å; A493-L496 PolarHBondContact O-N 3.34Å; L496-G498 VanDerWaalsContact C-N 3.3Å; L496-G498 PolarHBondContact O-N 3.1Å
497	M	48.3	Very low	38.1	Very low	169 Å²	169	136.8 Å²	136.8	83%	0.833	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-6.8	-178.4	-64	-63.1	-75.2	0	0	113.7	A493 W495	A493-M497 WeakPolarHBondContact O-CG 3.46Å; A493-M497 PolarHBondContact O-N 3.31Å; W495-M497 PolarHBondContact O-N 2.6Å
498	G	40.8	Very low	37.2	Very low	62 Å²	62	137.6 Å²	137.6	64%	0.639	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-7.8	-175.5	0	0	0	0	0	116.4	W495 L496	W495-G498 PolarHBondContact O-N 3.36Å; L496-G498 VanDerWaalsContact C-N 3.3Å; L496-G498 PolarHBondContact O-N 3.1Å
499	R	44.8	Very low	36.8	Very low	231 Å²	231	138 Å²	138	87%	0.872	72%	0.719	S	S	*	*			trans	-129.8	90.8	-175.9	-77.7	-169	174.6	-135.7	1.5	114.3
500	R	33.8	Very low	36	Very low	241 Å²	241	141.1 Å²	141.1	91%	0.909	74%	0.742	S	S	*	*			trans	-150.6	88.5	147.6	-75.8	-157.7	-174.9	-159.7	3.5	111.9
501	F	28.3	Very low	35.3	Very low	212 Å²	212	141.9 Å²	141.9	93%	0.93	76%	0.762	S	S	*	*	S	Bend	trans	-179.8	91.5	131	-109.1	-70.2	0	0	0	111.3
502	S	30.6	Very low	34.6	Very low	131 Å²	131	139.9 Å²	139.9	92%	0.916	77%	0.774	S	S	*	*			trans	178.8	115.4	153.5	-81.2	0	0	0	0	106.3
503	D	28.1	Very low	34.1	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	78%	0.782	S	S	*	*			trans	-129.6	154.5	-179.8	-162.3	-5.6	0	0	0	109.3
504	R	29.6	Very low	33.6	Very low	212 Å²	212	142 Å²	142	80%	0.8	80%	0.798	S	S	*	*			trans	59.7	107.7	-178.9	-73.4	-179	161.4	-149.1	-6.9	118.3
505	S	23.5	Very low	32.8	Very low	119 Å²	119	145 Å²	145	83%	0.832	80%	0.803	S	S	*	*				-142.8	157.6	110.1	-164.5	0	0	0	0	111
506	L	29.3	Very low	31.9	Very low	140 Å²	140	143.3 Å²	143.3	73%	0.733	80%	0.804	S	S	*	*			trans	-152.2	149.7	-167	-71.8	175.6	0	0	0	109.7
507	C	28.3	Very low	31.5	Very low	106 Å²	106	142 Å²	142	72%	0.716	80%	0.804	S	S	*	*			cis	-169.6	153.7	-17.2	-174.6	0	0	0	0	107.3
508	S	26.4	Very low	30.6	Very low	124 Å²	124	139.6 Å²	139.6	87%	0.867	79%	0.794	S	S	*	*			trans	-159.3	152.4	164.6	-83.7	0	0	0	0	114.9
509	T	31.2	Very low	30.1	Very low	137 Å²	137	146.7 Å²	146.7	84%	0.84	80%	0.802	S	S	*	*			trans	-111.2	147.5	-178.1	50.3	0	0	0	0	112.2
510	S	27.9	Very low	29.2	Very low	127 Å²	127	144 Å²	144	89%	0.888	80%	0.796	S	S	*	*			trans	-161.3	157.7	145.8	52.7	0	0	0	0	110.8
511	A	33.2	Very low	29	Very low	105 Å²	105	142.8 Å²	142.8	87%	0.868	79%	0.793	S	S	*	*			trans	-136	167.2	-179.9	0	0	0	0	0	111.2
512	G	26.8	Very low	29.7	Very low	78 Å²	78	138.7 Å²	138.7	80%	0.804	79%	0.787	S	S	*	*			trans	95.1	157	-173.2	0	0	0	0	0	112.4
513	S	26.9	Very low	29.7	Very low	115 Å²	115	136.2 Å²	136.2	80%	0.804	78%	0.775	S	S	*	*			cis	-154.6	164.7	-7.3	-162	0	0	0	0	109
514	D	31	Very low	30.5	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	77%	0.771	S	S	*	*			trans	-58.5	147.1	175.5	-47.2	-96.2	0	0	0	112.8
515	D	28.2	Very low	30.4	Very low	133 Å²	133	129.1 Å²	129.1	71%	0.711	77%	0.767	S	S	*	*				-165.8	153.2	105.2	-122.6	-23.3	0	0	0	117.2
516	Q	30.8	Very low	30.7	Very low	157 Å²	157	130.2 Å²	130.2	73%	0.734	76%	0.763	S	S	*	*			trans	5.8	151.9	150.6	-72.6	168.8	83.7	0	0	122.6
517	S	33.4	Very low	30.6	Very low	83 Å²	83	131.8 Å²	131.8	58%	0.58	77%	0.767	S	S	*	*			cis	-177.5	162.9	-10.3	59.4	0	0	0	0	113.4
518	L	30.9	Very low	30.5	Very low	119 Å²	119	132.8 Å²	132.8	62%	0.623	78%	0.775	S	S	*	*			trans	62.3	147.5	153	-65	156	0	0	0	117.8
519	W	30.2	Very low	30.7	Very low	211 Å²	211	131.7 Å²	131.7	80%	0.799	77%	0.767	S	S	*	*			cis	-147.7	171.3	21.1	-49.8	83.4	0	0	0	108.5
520	K	25.3	Very low	30.6	Very low	175 Å²	175	131.1 Å²	131.1	76%	0.761	76%	0.763	S	S	*	*			cis	-176.1	129.8	-28.2	177.8	166.9	178	176.3	0	106.8
521	Y	30	Very low	30.7	Very low	215 Å²	215	135.8 Å²	135.8	84%	0.843	76%	0.761	S	S	*	*			trans	-66.4	159	-178.8	-94.2	-70.4	0	0	0	113.2
522	P	41.4	Very low	30.4	Very low	125 Å²	125	137 Å²	137	81%	0.812	75%	0.749	S	S	*	*				-145.5	170.9	59.6	40.8	-21.3	0	0	0	119
523	A	31.6	Very low	30.5	Very low	79 Å²	79	143.6 Å²	143.6	65%	0.653	75%	0.75	S	S	*	*			trans	-98.8	164.4	166.6	0	0	0	0	0	111.7
524	P	44.8	Very low	30.4	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	75%	0.748	S	S	*	*				-126.4	155	97.6	2.4	20.4	0	0	0	112.7
525	S	28.2	Very low	30.3	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	75%	0.746	S	S	*	*				69.3	138	66.9	105.9	0	0	0	0	113.2
526	L	29.5	Very low	30.1	Very low	142 Å²	142	144.6 Å²	144.6	74%	0.743	75%	0.745	S	S	*	*			cis	-150.3	163.7	18.7	-95.2	169.4	0	0	0	113.5
527	Q	26.7	Very low	30.4	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	75%	0.745	S	S	*	*			trans	57.9	128.4	145.7	-71.3	170.7	14.2	0	0	123.8
528	S	26.3	Very low	30.2	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	75%	0.749	S	S	*	*				-157.3	161.7	121.8	-170.2	0	0	0	0	110.5
529	S	29.6	Very low	30.1	Very low	100 Å²	100	148 Å²	148	70%	0.699	76%	0.758	S	S	*	*			trans	-150.9	128.9	-172.9	-171.5	0	0	0	0	114.9
530	V	29.6	Very low	30	Very low	126 Å²	126	142 Å²	142	76%	0.764	76%	0.761	S	S	*	*			trans	34.4	120.3	144.2	-175.9	0	0	0	0	120
531	R	29.4	Very low	30.2	Very low	225 Å²	225	142.7 Å²	142.7	85%	0.849	77%	0.772	S	S	*	*				-166.4	-179.2	111.7	-151.1	140.5	-174.4	-176.6	-0.8	114.9
532	Q	27.6	Very low	30	Very low	129 Å²	129	135.8 Å²	135.8	60%	0.603	77%	0.767	S	S	*	*			trans	-115.9	156.8	-151.2	-54.5	156.6	-64.5	0	0	114.7
533	R	28.3	Very low	29.5	Very low	218 Å²	218	135.1 Å²	135.1	82%	0.823	77%	0.765	S	S	*	*			trans	65.1	133.5	143.6	-74.5	175.8	-177.1	-175.6	2.1	122.1
534	L	25.4	Very low	29.3	Very low	148 Å²	148	137.6 Å²	137.6	78%	0.775	76%	0.763	S	S	*	*				135.3	124.7	110.5	-146.8	65.9	0	0	0	116.5
535	T	29	Very low	29	Very low	117 Å²	117	141.3 Å²	141.3	72%	0.718	76%	0.762	S	S	*	*			trans	46.8	124.9	153.6	51.3	0	0	0	0	124.1
536	E	24.7	Very low	29	Very low	148 Å²	148	142.3 Å²	142.3	69%	0.692	76%	0.759	S	S	*	*				28	134.6	113.2	-144.6	53.4	-128.6	0	0	118.2
537	P	36.8	Very low	29.2	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	76%	0.758	S	S	*	*			cis	-155.5	157	48.8	43	-21.6	0	0	0	122
538	Q	28.6	Very low	29.4	Very low	144 Å²	144	139.7 Å²	139.7	67%	0.673	76%	0.756	S	S	*	*			trans	42.2	143.2	137.3	-71.5	-69.1	1.5	0	0	127.4
539	H	29.7	Very low	29.6	Very low	175 Å²	175	141.5 Å²	141.5	81%	0.81	75%	0.75	S	S	*	*			trans	76	133	151.3	-74.8	21.9	0	0	0	122.3
540	G	27.5	Very low	29.7	Very low	84 Å²	84	140.7 Å²	140.7	87%	0.866	74%	0.744	S	S	*	*			trans	161	94.1	164.9	0	0	0	0	0	118.2
541	L	30.4	Very low	29.8	Very low	189 Å²	189	141.4 Å²	141.4	99%	0.99	74%	0.744	S	S	*	*			trans	-61.9	154.6	-174.3	-67	156.4	0	0	0	119.3
542	G	25.5	Very low	30	Very low	71 Å²	71	136.5 Å²	136.5	73%	0.732	74%	0.744	S	S	*	*			trans	133.8	99.9	156.5	0	0	0	0	0	115.1
543	S	29.9	Very low	30.1	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	76%	0.756	S	S	*	*				57.9	130.5	77.7	-138.6	0	0	0	0	113.4
544	Q	27.9	Very low	30.2	Very low	131 Å²	131	133.6 Å²	133.6	61%	0.612	75%	0.75	S	S	*	*			cis	-175.3	139	41.8	-176.4	153.8	105.5	0	0	113.5
545	R	37.8	Very low	30.4	Very low	193 Å²	193	131.6 Å²	131.6	73%	0.728	75%	0.749	S	S	*	*			trans	66.4	156.5	164	-68.5	-176.5	-165.6	103	14.7	118.2
546	D	29.6	Very low	30.4	Very low	123 Å²	123	133.8 Å²	133.8	66%	0.658	76%	0.755	S	S	*	*			cis	-172.7	164.8	-13.4	-96	-9.2	0	0	0	107.2
547	L	32.1	Very low	30.7	Very low	138 Å²	138	134 Å²	134	72%	0.723	76%	0.756	S	S	*	*			cis	-163.2	173.6	-10.1	-117.3	170	0	0	0	109.9
548	T	32.2	Very low	30.2	Very low	123 Å²	123	137.1 Å²	137.1	76%	0.755	76%	0.763	S	S	*	*			trans	67	144.3	174.8	70.4	0	0	0	0	116.7
549	H	30.1	Very low	30.4	Very low	166 Å²	166	134.9 Å²	134.9	77%	0.769	76%	0.763	S	S	*	*			cis	-154.2	142.2	5.9	-147	-68	0	0	0	110.7
550	S	32.7	Very low	30.5	Very low	83 Å²	83	133.6 Å²	133.6	58%	0.58	76%	0.763	S	S	*	*			trans	50.3	151.1	155.8	-68.4	0	0	0	0	122.4
551	D	30.8	Very low	30.7	Very low	141 Å²	141	138.7 Å²	138.7	75%	0.754	76%	0.755	S	S	*	*			cis	-168.7	166.9	-16.7	-103.4	-40.7	0	0	0	111.3
552	S	33.7	Very low	30.8	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	74%	0.737	S	S	*	*			trans	98.2	133.7	159	-47	0	0	0	0	120.6
553	E	29.7	Very low	31	Very low	186 Å²	186	142 Å²	142	87%	0.869	74%	0.739	S	S	*	*			trans	-128.7	137.9	179.2	-75.9	-169.6	101.7	0	0	114.2
554	S	29.9	Very low	31	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	74%	0.741	S	S	*	*				36.8	97.3	115.4	-47.8	0	0	0	0	123.7
555	S	31.1	Very low	31.2	Very low	107 Å²	107	141 Å²	141	75%	0.748	75%	0.745	S	S	*	*				42.4	145.6	117.5	66	0	0	0	0	125.5
556	L	28.6	Very low	31.4	Very low	162 Å²	162	138.3 Å²	138.3	85%	0.848	75%	0.752	S	S	*	*			trans	93.8	101.5	155.4	-55.1	-173.6	0	0	0	121.9
557	H	30.1	Very low	31.3	Very low	153 Å²	153	141.8 Å²	141.8	71%	0.708	76%	0.761	S	S	*	*				43.8	119.3	118.3	-146.6	-63.1	0	0	0	121.5
558	M	26.6	Very low	32.7	Very low	178 Å²	178	140.1 Å²	140.1	88%	0.877	76%	0.759	S	S	*	*			trans	-158.1	170.8	153.3	-100.3	-50.1	107.4	0	0	112.4
559	S	32.3	Very low	33.4	Very low	97 Å²	97	140 Å²	140	68%	0.678	76%	0.76	S	S	*	*			trans	-126.6	160.6	-171.2	-60.6	0	0	0	0	115
560	D	31.6	Very low	33.4	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	76%	0.764	S	S	*	*			trans	80	117.9	146	-130.6	-30	0	0	0	120.9
561	R	33.3	Very low	33.2	Very low	190 Å²	190	145.1 Å²	145.1	72%	0.717	78%	0.777	S	S	*	*				140.3	121.4	103.1	-166	168	169.3	154.2	0.7	118.6
562	Q	32.2	Very low	33.1	Very low	130 Å²	130	143.1 Å²	143.1	61%	0.607	77%	0.774	S	S	*	*			trans	67.4	155.1	154.9	-78	-176.3	-55.9	0	0	119.2
563	R	30.1	Very low	33.1	Very low	201 Å²	201	149 Å²	149	76%	0.758	78%	0.778	S	S	*	*			cis	-155.2	163	5.4	-166.9	176.6	-72.8	169.7	0.3	111.8
564	V	28.7	Very low	33	Very low	137 Å²	137	144 Å²	144	83%	0.83	77%	0.769	S	S	*	*			trans	128.1	146.3	148.5	175.8	0	0	0	0	113.8
565	A	31.5	Very low	33.1	Very low	84 Å²	84	142.5 Å²	142.5	69%	0.694	76%	0.762	S	S	*	*			trans	-137.4	165.7	-177.1	0	0	0	0	0	111.3
566	P	43.7	Very low	33	Very low	136 Å²	136	144.2 Å²	144.2	88%	0.883	76%	0.763	S	S	*	*				-144.5	-157.9	98.3	38.5	-20.8	0	0	0	115.3
567	K	26.8	Very low	33.1	Very low	195 Å²	195	145.7 Å²	145.7	85%	0.848	77%	0.766	S	S	*	*			trans	-147.1	-177.6	-164.9	-138.1	-161.3	-178.7	-179.6	0	108.9
568	P	60.4	Low	33.3	Very low	103 Å²	103	142.7 Å²	142.7	67%	0.669	77%	0.767	S	S	*	*			cis	-109.5	-155.5	-43.6	45.6	-30.9	0	0	0	109.6
569	P	48	Very low	33.3	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	77%	0.765	S	S	*	*			cis	-127.3	-163.2	45.2	19.9	6.2	0	0	0	112.8
570	Q	29.3	Very low	33.2	Very low	182 Å²	182	143.7 Å²	143.7	85%	0.85	77%	0.768	S	S	*	*			cis	163.8	117.2	-48.2	-166.4	-173.4	26.6	0	0	109
571	M	29	Very low	33	Very low	175 Å²	175	141 Å²	141	86%	0.862	77%	0.766	S	S	*	*			trans	-176.6	130.2	156.3	-98.5	173.8	75.8	0	0	105.5
572	S	28.9	Very low	32.8	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	77%	0.771	S	S	*	*			cis	66.2	123.7	42.1	77.3	0	0	0	0	113.7
573	R	32.7	Very low	32.6	Very low	244 Å²	244	139.9 Å²	139.9	92%	0.921	78%	0.78	S	S	*	*			cis	-141	-172.7	2.7	-126	-177.7	168.7	124.2	-5.5	107.6
574	A	28.9	Very low	32.5	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	78%	0.775	S	S	*	*			cis	-136.4	-169.3	12.4	0	0	0	0	0	109.6
575	A	31.2	Very low	32.6	Very low	68 Å²	68	135.9 Å²	135.9	56%	0.562	78%	0.777	S	S	*	*			cis	74.2	135.9	21.5	0	0	0	0	0	115.6
576	D	30.3	Very low	32.4	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	78%	0.777	S	S	*	*			cis	-147.2	151.9	1.5	-86.7	-46	0	0	0	114.5
577	E	30.3	Very low	31.7	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	78%	0.776	S	S	*	*			trans	46.7	171.8	144.4	-59.6	-163.1	120.7	0	0	124.4
578	A	33.3	Very low	31.9	Very low	90 Å²	90	133.3 Å²	133.3	74%	0.744	77%	0.773	S	S	*	*			trans	-138.2	161	-174.3	0	0	0	0	0	111.2
579	L	27.9	Very low	30.6	Very low	160 Å²	160	138.9 Å²	138.9	84%	0.838	78%	0.781	S	S	*	*			trans	-157.2	134.6	157	-139	80	0	0	0	115.9
580	N	28.8	Very low	29.6	Very low	137 Å²	137	140 Å²	140	73%	0.733	78%	0.78	S	S	*	*			trans	10.9	115.7	145.8	-56.4	-21.6	0	0	0	122.1
581	A	27.3	Very low	29.6	Very low	92 Å²	92	137.6 Å²	137.6	76%	0.76	77%	0.771	S	S	*	*				63.5	157.7	103.8	0	0	0	0	0	124.4
582	M	30.4	Very low	29.5	Very low	164 Å²	164	138.2 Å²	138.2	81%	0.808	77%	0.772	S	S	*	*			trans	94.8	116.3	149.3	-74.9	167.2	70.1	0	0	122.6
583	T	27.2	Very low	29.3	Very low	132 Å²	132	136.5 Å²	136.5	81%	0.81	77%	0.77	S	S	*	*			trans	72.7	161.5	152.5	70.4	0	0	0	0	117.8
584	S	28	Very low	29	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	77%	0.768	S	S	*	*			cis	-153.9	150.2	9.4	-153.7	0	0	0	0	115.1
585	N	31.5	Very low	29	Very low	163 Å²	163	136.4 Å²	136.4	87%	0.872	78%	0.775	S	S	*	*			trans	34.3	146.9	146.1	-65.8	-9.7	0	0	0	125.5
586	G	26.9	Very low	29.4	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.787	S	S	*	*			trans	122.5	106.6	158.1	0	0	0	0	0	112.9
587	S	29.2	Very low	29.3	Very low	124 Å²	124	136 Å²	136	87%	0.867	79%	0.789	S	S	*	*				55.7	129.2	55.5	-56.8	0	0	0	0	112.6
588	H	29.5	Very low	29	Very low	169 Å²	169	132.4 Å²	132.4	78%	0.782	79%	0.785	S	S	*	*			cis	-146.5	177.7	27	-166	-98.4	0	0	0	113.7
589	R	33.6	Very low	28.7	Very low	219 Å²	219	135.2 Å²	135.2	83%	0.826	79%	0.786	S	S	*	*			trans	-90.1	179	174.1	-75.1	179.6	166.8	-174.2	-3.8	112.9
590	L	28	Very low	28.7	Very low	144 Å²	144	134.7 Å²	134.7	75%	0.754	78%	0.782	S	S	*	*			trans	94.9	147.7	162	-55.6	167.1	0	0	0	115.4
591	I	29.2	Very low	28.6	Very low	131 Å²	131	134.2 Å²	134.2	67%	0.672	78%	0.775	S	S	*	*			cis	-162.9	163.9	-33.9	-144.6	173.4	0	0	0	108
592	E	25.4	Very low	28.5	Very low	188 Å²	188	137.8 Å²	137.8	88%	0.879	77%	0.773	S	S	*	*			trans	61.2	161.1	173.4	-73.5	165.5	130.6	0	0	116.8
593	G	25.5	Very low	28.3	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	77%	0.773	S	S	*	*			cis	169.5	155.2	-11.4	0	0	0	0	0	113.4
594	V	26.4	Very low	29.3	Very low	146 Å²	146	136 Å²	136	89%	0.885	77%	0.767	S	S	*	*			trans	67.6	114.3	159.6	-173.9	0	0	0	0	118.9
595	H	29.6	Very low	29.2	Very low	179 Å²	179	138.6 Å²	138.6	83%	0.829	77%	0.774	S	S	*	*			trans	-81.6	153.5	152.4	-73.6	-88.1	0	0	0	110.2
596	P	39.5	Very low	29	Very low	125 Å²	125	135.8 Å²	135.8	81%	0.812	77%	0.767	S	S	*	*				-139.1	164.8	100.4	34.6	-20.6	0	0	0	113.8
597	G	27.3	Very low	30.2	Very low	78 Å²	78	138.4 Å²	138.4	80%	0.804	77%	0.772	S	S	*	*			trans	-123.3	-179.2	-178.4	0	0	0	0	0	114
598	S	25.3	Very low	30.4	Very low	117 Å²	117	137 Å²	137	82%	0.818	77%	0.767	S	S	*	*			trans	-163.1	163.6	174.6	-164.5	0	0	0	0	113.6
599	L	26.9	Very low	30.7	Very low	148 Å²	148	135.9 Å²	135.9	78%	0.775	77%	0.766	S	S	*	*			trans	81.4	82.9	146.7	-134.9	142	0	0	0	121.6
600	M	27.2	Very low	30.8	Very low	149 Å²	149	129.3 Å²	129.3	73%	0.734	76%	0.759	S	S	*	*				62.7	125	104.7	-164.7	169	165.8	0	0	122.8
601	E	25.8	Very low	31.1	Very low	127 Å²	127	131.6 Å²	131.6	59%	0.593	76%	0.763	S	S	*	*			trans	82.3	127.5	146	-83.4	-161.4	142.1	0	0	126.2
602	K	25.7	Very low	31.3	Very low	167 Å²	167	129.2 Å²	129.2	73%	0.726	76%	0.762	S	S	*	*			trans	88.6	111.3	130.4	-85.1	173.8	178.1	139.1	0	124.1
603	L	26.7	Very low	31.4	Very low	155 Å²	155	127.9 Å²	127.9	81%	0.812	76%	0.76	S	S	*	*			trans	-51.1	166.6	137.4	-117.4	73.5	0	0	0	112.5
604	P	48.9	Very low	31.9	Very low	105 Å²	105	131.8 Å²	131.8	68%	0.682	77%	0.766	S	S	*	*				-136.9	-168	50.6	42.8	-22.4	0	0	0	113.1
605	D	25.6	Very low	32.4	Very low	146 Å²	146	128.6 Å²	128.6	78%	0.781	76%	0.755	S	S	*	*			cis	-153.7	177.5	23.4	-133.3	-38.5	0	0	0	115.5
606	S	27.9	Very low	32.7	Very low	104 Å²	104	127 Å²	127	73%	0.727	75%	0.751	S	S	*	*			trans	-115.4	-166.7	-176.5	-93.9	0	0	0	0	110.6
607	P	52	Low	32.6	Very low	123 Å²	123	126.6 Å²	126.6	80%	0.799	74%	0.742	S	S	*	*			cis	-147	175.6	15.3	44.3	-23.1	0	0	0	120.8
608	A	31.7	Very low	32.8	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	74%	0.742	S	S	*	*			trans	-33.9	169.3	165.3	0	0	0	0	0	121.3
609	L	36.7	Very low	33.1	Very low	147 Å²	147	128.7 Å²	128.7	77%	0.77	74%	0.736	S	S	*	*				-171.6	110.8	102.3	-163.3	137.6	0	0	0	115.6
610	A	35.5	Very low	33.6	Very low	81 Å²	81	129.1 Å²	129.1	67%	0.669	74%	0.738	S	S	*	*			trans	25.1	149.2	137.3	0	0	0	0	0	123
611	K	33.6	Very low	33.9	Very low	192 Å²	192	127.1 Å²	127.1	84%	0.835	73%	0.73	S	S	*	*				-175.8	165.7	71.1	-83.2	176.4	-176.1	173.7	0	110.5
612	A	33.6	Very low	34.2	Very low	80 Å²	80	128.7 Å²	128.7	66%	0.661	74%	0.735	S	S	*	*			cis	-174.6	-174.8	-17.7	0	0	0	0	0	110.8
613	L	28.8	Very low	34.5	Very low	160 Å²	160	124.5 Å²	124.5	84%	0.838	73%	0.732	S	S	*	*			trans	84.8	136.6	171.8	-48.9	177.7	0	0	0	116.2
614	L	35.3	Very low	34.4	Very low	146 Å²	146	124.7 Å²	124.7	76%	0.764	73%	0.728	S	S	*	*			cis	-160.4	140.5	-3.3	-113.1	167.7	0	0	0	113.3
615	A	37.3	Very low	33.4	Very low	79 Å²	79	124.2 Å²	124.2	65%	0.653	73%	0.727	S	S	*	*			trans	55.7	151.6	136.7	0	0	0	0	0	123.2
616	L	35.9	Very low	33.6	Very low	145 Å²	145	124.3 Å²	124.3	76%	0.759	73%	0.727	S	S	*	*			cis	-161.1	151.4	-4.6	-144	76.4	0	0	0	112.6
617	N	36.6	Very low	33.7	Very low	116 Å²	116	126.2 Å²	126.2	62%	0.62	73%	0.726	S	S	*	*			trans	35.3	157.8	143.6	-68.2	-0.9	0	0	0	123.3
618	H	32.4	Very low	32.6	Very low	174 Å²	174	127.8 Å²	127.8	81%	0.806	72%	0.723	S	S	*	*			cis	-158.8	169.1	-8.2	-96.1	-43.9	0	0	0	104.8
619	G	30.4	Very low	32.4	Very low	66 Å²	66	131.2 Å²	131.2	68%	0.68	73%	0.727	S	S	*	*			cis	151.6	130.1	7.3	0	0	0	0	0	109.7
620	L	38	Very low	32	Very low	157 Å²	157	129.8 Å²	129.8	82%	0.822	73%	0.73	S	S	*	*			trans	44	150.1	146.6	-108.9	62.3	0	0	0	121.6
621	D	32.7	Very low	32.9	Very low	107 Å²	107	132.1 Å²	132.1	57%	0.572	74%	0.738	S	S	*	*			cis	-162.8	-173.7	22.7	-141.3	-15.9	0	0	0	106.9
622	K	33.1	Very low	32.6	Very low	159 Å²	159	128.9 Å²	128.9	69%	0.691	74%	0.739	S	S	*	*			cis	-172.7	153.3	-8	-148.8	162.7	-148.1	73.6	0	104.6
623	A	31.5	Very low	32.4	Very low	79 Å²	79	129.7 Å²	129.7	65%	0.653	75%	0.747	S	S	*	*			cis	-159.9	-140.7	-18.9	0	0	0	0	0	105.3
624	H	25.7	Very low	33.8	Very low	159 Å²	159	127.7 Å²	127.7	74%	0.736	74%	0.743	S	S	*	*			cis	-165	144.1	4.9	-128.7	-58.1	0	0	0	110.4
625	S	28.2	Very low	34.3	Very low	96 Å²	96	127 Å²	127	67%	0.671	75%	0.747	S	S	*	*			trans	54.8	151.5	146.6	-61.8	0	0	0	0	123.3
626	L	28.9	Very low	33.9	Very low	148 Å²	148	127.2 Å²	127.2	78%	0.775	76%	0.757	S	S	*	*			cis	-175.7	152.5	-30.5	-133.6	167.9	0	0	0	109.5
627	M	28.7	Very low	33.5	Very low	143 Å²	143	124.4 Å²	124.4	70%	0.704	76%	0.763	S	S	*	*			trans	67.3	127	163.6	-119.4	133.4	-177.5	0	0	117.4
628	E	29	Very low	33.3	Very low	157 Å²	157	124.4 Å²	124.4	73%	0.734	77%	0.773	S	S	*	*				54	134.4	79.5	-53.3	-175.6	125.6	0	0	114.1
629	L	28.5	Very low	34.2	Very low	164 Å²	164	121.3 Å²	121.3	86%	0.859	77%	0.768	S	S	*	*				-147.3	178.1	56.5	-78.3	163.9	0	0	0	115.1
630	S	28	Very low	34.1	Very low	117 Å²	117	125.7 Å²	125.7	82%	0.818	77%	0.77	S	S	*	*			trans	-98	172.1	-174.9	-56.4	0	0	0	0	114.7
631	P	53.8	Low	33.9	Very low	130 Å²	130	124.4 Å²	124.4	84%	0.844	76%	0.764	S	S	*	*			trans	-107.6	169.7	-161.4	41	-35.6	0	0	0	116.6
632	S	27.4	Very low	33.7	Very low	124 Å²	124	125.3 Å²	125.3	87%	0.867	77%	0.768	S	S	*	*			trans	-151.2	158	165	58.5	0	0	0	0	111.7
633	A	30.6	Very low	33.6	Very low	98 Å²	98	122.4 Å²	122.4	81%	0.81	77%	0.768	S	S	*	*			trans	-118.5	-153.7	-163.4	0	0	0	0	0	114.3
634	P	56.9	Low	33.6	Very low	117 Å²	117	123 Å²	123	76%	0.76	77%	0.768	S	S	*	*			trans	-96.5	-176.9	-139.4	45.3	-41.2	0	0	0	115.1
635	P	47.8	Very low	33.9	Very low	131 Å²	131	125.6 Å²	125.6	85%	0.851	77%	0.771	S	S	*	*				-139.1	-177.3	91.9	38.2	-23.7	0	0	0	113.9
636	G	29	Very low	34.1	Very low	84 Å²	84	125 Å²	125	87%	0.866	77%	0.767	S	S	*	*			trans	-123.4	176.1	-175.7	0	0	0	0	0	115.6
637	G	26.2	Very low	34.1	Very low	86 Å²	86	125.5 Å²	125.5	89%	0.887	77%	0.765	S	S	*	*			trans	173.8	152.6	178.1	0	0	0	0	0	111.8
638	S	31.9	Very low	34.4	Very low	117 Å²	117	124 Å²	124	82%	0.818	77%	0.769	S	S	*	*			trans	-117.6	-171.8	-178.9	64.9	0	0	0	0	110.1
639	P	51.3	Low	35.3	Very low	109 Å²	109	122 Å²	122	71%	0.708	77%	0.769	S	S	*	*			cis	-136.8	-169.1	-1.5	43.8	-26.2	0	0	0	114.4
640	H	28.7	Very low	35.3	Very low	157 Å²	157	119 Å²	119	73%	0.727	76%	0.762	S	S	*	*				164.4	119.1	115.5	-169.1	-90.3	0	0	0	114.4
641	L	34.8	Very low	35.4	Very low	131 Å²	131	119 Å²	119	69%	0.686	76%	0.762	S	S	*	*			trans	30.7	155.9	153.5	-50.5	-171.9	0	0	0	122.4
642	D	27.3	Very low	35.2	Very low	126 Å²	126	118.4 Å²	118.4	67%	0.674	76%	0.758	S	S	*	*			cis	-157.7	157.5	29.4	-145.1	-37.5	0	0	0	115.6
643	S	32.3	Very low	35.5	Very low	97 Å²	97	119.5 Å²	119.5	68%	0.678	75%	0.754	S	S	*	*			trans	50	146.1	148.5	-81.8	0	0	0	0	123.9
644	S	31.3	Very low	36.3	Very low	93 Å²	93	119.9 Å²	119.9	65%	0.65	75%	0.749	S	S	*	*			cis	-162.3	149.7	-0.7	-118.5	0	0	0	0	114.1
645	R	31.6	Very low	35	Very low	212 Å²	212	121.8 Å²	121.8	80%	0.8	75%	0.752	S	S	*	*			trans	44.3	127.1	151.5	-62.3	-171.1	173.7	-165.5	-4.1	121
646	S	32.5	Very low	34.4	Very low	85 Å²	85	121.3 Å²	121.3	59%	0.594	75%	0.747	S	S	*	*				72.9	140.8	53.1	74.8	0	0	0	0	114.3
647	H	28.4	Very low	35.1	Very low	157 Å²	157	123.1 Å²	123.1	73%	0.727	74%	0.744	S	S	*	*			cis	-150.6	173.1	38.8	-64.2	-100	0	0	0	115.8
648	S	34.6	Very low	35.5	Very low	113 Å²	113	124 Å²	124	79%	0.79	74%	0.736	S	S	*	*			trans	-106.7	-165.5	162.4	-41.5	0	0	0	0	109.3
649	P	48.8	Very low	36.3	Very low	114 Å²	114	124 Å²	124	74%	0.74	73%	0.733	S	S	*	*			cis	-148.2	-162.7	12.9	42.6	-18.3	0	0	0	118
650	S	28.4	Very low	35.1	Very low	101 Å²	101	125.8 Å²	125.8	71%	0.706	74%	0.742	S	S	*	*			trans	74.8	118.8	142.3	63.5	0	0	0	0	125.6
651	S	30.9	Very low	35.2	Very low	118 Å²	118	121.9 Å²	121.9	83%	0.825	74%	0.744	S	S	*	*			trans	47.2	162.7	131.3	-84.8	0	0	0	0	124.1
652	P	49.6	Very low	34.9	Very low	116 Å²	116	122.6 Å²	122.6	75%	0.753	75%	0.749	S	S	*	*			cis	-130.9	-161.6	-15.6	37	-15.9	0	0	0	113.8
653	D	33.3	Very low	35.1	Very low	148 Å²	148	119.7 Å²	119.7	79%	0.791	74%	0.738	S	S	*	*			trans	-59.5	173.2	168.9	-53	-83.6	0	0	0	114
654	P	47.4	Very low	35.1	Very low	106 Å²	106	126.4 Å²	126.4	69%	0.688	75%	0.749	S	S	*	*			cis	-149.2	-163.9	22.8	45.5	-23.3	0	0	0	118.9
655	D	28.2	Very low	35	Very low	156 Å²	156	125.8 Å²	125.8	83%	0.834	75%	0.749	S	S	*	*			trans	84.4	152.7	152	-73.4	-31.2	0	0	0	123.7
656	T	36	Very low	35	Very low	122 Å²	122	122.7 Å²	122.7	75%	0.748	75%	0.748	S	S	*	*			trans	-114.6	154.8	-177.5	-25.6	0	0	0	0	110.1
657	P	42.7	Very low	34.9	Very low	122 Å²	122	127 Å²	127	79%	0.792	76%	0.758	S	S	*	*				-150	165.9	98.3	38.9	-22.1	0	0	0	115.8
658	S	34.7	Very low	35	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	76%	0.759	S	S	*	*			trans	-85	176.5	161.3	-37.8	0	0	0	0	110.3
659	P	48.5	Very low	34.7	Very low	118 Å²	118	124.2 Å²	124.2	77%	0.766	76%	0.762	S	S	*	*				-161.3	-171.6	68.3	39.7	-14.6	0	0	0	118.6
660	V	28.1	Very low	34	Very low	146 Å²	146	129 Å²	129	89%	0.885	77%	0.765	S	S	*	*			trans	78.8	132.5	159.6	-174.1	0	0	0	0	119.7
661	G	29.1	Very low	34.1	Very low	75 Å²	75	131.5 Å²	131.5	77%	0.773	77%	0.771	S	S	*	*			trans	126.7	96	155.1	0	0	0	0	0	117.2
662	D	29.1	Very low	34	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	76%	0.764	S	S	*	*			cis	176.1	167.1	-25.9	171	42.8	0	0	0	106
663	S	30.9	Very low	33	Very low	66 Å²	66	136.5 Å²	136.5	46%	0.462	77%	0.769	S	S	.	*			trans	75.7	102.4	157.7	-80.7	0	0	0	0	121.7
664	R	32.5	Very low	32.9	Very low	238 Å²	238	136.5 Å²	136.5	90%	0.898	77%	0.767	S	S	*	*				78.6	142.1	129.9	-66	168.9	-179.5	161.6	2.4	119.1
665	A	29.6	Very low	32.7	Very low	79 Å²	79	137.2 Å²	137.2	65%	0.653	77%	0.772	S	S	*	*			cis	-163.6	153.1	-7.5	0	0	0	0	0	113
666	L	31.2	Very low	32.8	Very low	147 Å²	147	137.3 Å²	137.3	77%	0.77	77%	0.767	S	S	*	*			trans	38.4	142.3	136.4	-51.1	173.4	0	0	0	120.4
667	Q	30.8	Very low	32.5	Very low	175 Å²	175	139.3 Å²	139.3	82%	0.818	77%	0.773	S	S	*	*			cis	-160.1	167.7	4.6	-132.9	168.6	8.5	0	0	114.1
668	A	29.9	Very low	32.1	Very low	90 Å²	90	138 Å²	138	74%	0.744	77%	0.772	S	S	*	*			trans	-50.9	159.1	-179.3	0	0	0	0	0	119.4
669	S	29.6	Very low	31.8	Very low	122 Å²	122	136.8 Å²	136.8	85%	0.853	78%	0.776	S	S	*	*				161	164.8	102	-161.1	0	0	0	0	114.1
670	R	33.4	Very low	31.2	Very low	215 Å²	215	141 Å²	141	81%	0.811	78%	0.782	S	S	*	*			trans	-107.5	157.8	175.4	-71.1	171.8	166.4	164.5	-6.2	111.3
671	N	30.1	Very low	31.4	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	78%	0.782	S	S	*	*			trans	173.8	118.2	137.3	-85.5	-12.3	0	0	0	107.4
672	T	28.7	Very low	31.4	Very low	111 Å²	111	143.9 Å²	143.9	68%	0.681	78%	0.776	S	S	*	*			cis	82.5	128.9	48.6	65.9	0	0	0	0	116.5
673	R	30.1	Very low	31.4	Very low	228 Å²	228	143.6 Å²	143.6	86%	0.86	78%	0.78	S	S	*	*			trans	85.6	97.6	152.9	-165.3	179	-71.7	173.4	-3.7	117.5
674	I	30.6	Very low	31.4	Very low	147 Å²	147	144.7 Å²	144.7	75%	0.754	79%	0.793	S	S	*	*				51.5	116.2	82.1	-62.8	178	0	0	0	112.7	H676	I674-H676 HydrophobicContact CG2-CB 4.37Å
675	P	43.3	Very low	31.5	Very low	122 Å²	122	142 Å²	142	79%	0.792	79%	0.79	S	S	*	*				-133.2	155.7	78.8	14.7	9.1	0	0	0	114.2
676	H	29.9	Very low	31.5	Very low	157 Å²	157	146.9 Å²	146.9	73%	0.727	80%	0.799	S	S	*	*			cis	93.1	119.4	31.1	-175.3	-79	0	0	0	114.5	I674	I674-H676 HydrophobicContact CG2-CB 4.37Å
677	L	30.8	Very low	31.6	Very low	165 Å²	165	146.8 Å²	146.8	86%	0.864	80%	0.8	S	S	*	*			trans	-169.4	163.6	143.3	-108	170.1	0	0	0	112.2
678	A	33.6	Very low	31.6	Very low	93 Å²	93	145 Å²	145	77%	0.769	80%	0.796	S	S	*	*			trans	-141.1	158.7	-180	0	0	0	0	0	110.8
679	G	29.2	Very low	31.5	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	80%	0.799	S	S	*	*			trans	-172.1	153.9	178.5	0	0	0	0	0	112.1
680	K	35.2	Very low	31.6	Very low	208 Å²	208	144.7 Å²	144.7	90%	0.904	80%	0.8	S	S	*	*			trans	-157.3	128.5	-170	-159.4	177.3	-175.4	176.2	0	113.6
681	K	31.9	Very low	31.5	Very low	201 Å²	201	142.3 Å²	142.3	87%	0.874	80%	0.802	S	S	*	*			trans	83.7	136.1	153.8	-141.4	-169.2	-178.8	-169.1	0	119.9
682	A	30	Very low	31.6	Very low	80 Å²	80	138 Å²	138	66%	0.661	79%	0.793	S	S	*	*			trans	102.4	105.4	138	0	0	0	0	0	122.5
683	V	28.8	Very low	31.8	Very low	140 Å²	140	141.1 Å²	141.1	85%	0.848	80%	0.8	S	S	*	*				77.9	139	122.8	175.3	0	0	0	0	121.3
684	A	31	Very low	31.9	Very low	89 Å²	89	138.2 Å²	138.2	74%	0.736	80%	0.796	S	S	*	*			trans	67.8	163	168.5	0	0	0	0	0	117.8
685	E	33.5	Very low	32.1	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	80%	0.799	S	S	*	*			cis	-166.4	176.9	-45.3	-162.8	154.3	-157.9	0	0	106.6
686	E	30	Very low	31.5	Very low	181 Å²	181	138 Å²	138	85%	0.846	80%	0.795	S	S	*	*			trans	64.1	94.5	168	-53.9	-157.8	121.3	0	0	120.7
687	D	32.5	Very low	31.7	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	80%	0.8	S	S	*	*				39.9	158.2	114.8	-150.5	19.3	0	0	0	125.1
688	N	31.9	Very low	31.7	Very low	139 Å²	139	133.3 Å²	133.3	74%	0.743	79%	0.794	S	S	*	*			trans	79.3	115.8	160.9	-72.2	-67.9	0	0	0	123.7
689	G	28.3	Very low	32.5	Very low	78 Å²	78	135.3 Å²	135.3	80%	0.804	80%	0.799	S	S	*	*			trans	75.8	173	137.6	0	0	0	0	0	119.3
690	S	30.5	Very low	32.5	Very low	126 Å²	126	135.1 Å²	135.1	88%	0.881	80%	0.797	S	S	*	*			cis	-160.1	-179.9	-22.6	-161.6	0	0	0	0	110.8
691	I	31.5	Very low	32.5	Very low	166 Å²	166	135.7 Å²	135.7	85%	0.851	79%	0.793	S	S	*	*			trans	-70.6	148.8	-171.2	-73.1	165.4	0	0	0	115.7
692	G	31.8	Very low	32.6	Very low	62 Å²	62	134 Å²	134	64%	0.639	79%	0.786	S	S	*	*			trans	162.6	132.2	166.8	0	0	0	0	0	108.2
693	E	33.3	Very low	32.9	Very low	177 Å²	177	139.5 Å²	139.5	83%	0.827	80%	0.795	S	S	*	*			cis	56.1	132	38.4	-87.6	-176.9	125.1	0	0	112.9
694	E	31.5	Very low	33.1	Very low	167 Å²	167	142.1 Å²	142.1	78%	0.78	80%	0.795	S	S	*	*			cis	-155	-178.3	17.2	52.6	-141.8	76.7	0	0	115.9
695	T	35	Very low	34	Very low	130 Å²	130	143.9 Å²	143.9	80%	0.798	80%	0.799	S	S	*	*			trans	-27.8	168.2	172	46.9	0	0	0	0	120.7
696	D	30.7	Very low	34	Very low	134 Å²	134	142 Å²	142	72%	0.717	79%	0.794	S	S	*	*			cis	-176.4	158.7	-15.8	170	36.4	0	0	0	107.3
697	S	33.9	Very low	34.2	Very low	119 Å²	119	143.5 Å²	143.5	83%	0.832	80%	0.798	S	S	*	*			trans	179.5	101.5	148.8	-85.5	0	0	0	0	113.3
698	S	31.1	Very low	34.5	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	79%	0.793	S	S	*	*			trans	-97.7	162.8	160.1	-66.4	0	0	0	0	111.4
699	P	50.4	Low	34.6	Very low	135 Å²	135	145.5 Å²	145.5	88%	0.877	80%	0.798	S	S	*	*				-149.1	138.8	105.4	35	-18.3	0	0	0	115.6
700	G	30.7	Very low	35.2	Very low	73 Å²	73	150.2 Å²	150.2	75%	0.753	80%	0.797	S	S	*	*			trans	-140.6	-28.8	-173	0	0	0	0	0	120.5
701	R	33.9	Very low	35.5	Very low	220 Å²	220	153.7 Å²	153.7	83%	0.83	80%	0.796	S	S	*	*			trans	41.1	114.7	169.7	-85.1	177.3	163.2	-178.2	-2.3	117.3
702	K	34.3	Very low	36.6	Very low	166 Å²	166	151 Å²	151	72%	0.722	79%	0.789	S	S	*	*				175	153	62.2	-110.1	154.2	-177.9	173.2	0	113.3
703	K	36.3	Very low	36.8	Very low	195 Å²	195	154.7 Å²	154.7	85%	0.848	79%	0.794	S	S	*	*			trans	73.8	113.6	153	-66.9	175	176.9	-174.2	0	120.7
704	F	32.2	Very low	37	Very low	196 Å²	196	154.7 Å²	154.7	86%	0.86	79%	0.791	S	S	*	*			trans	-82.2	175.9	148.6	-69.9	-92.9	0	0	0	110.8
705	P	51.4	Low	37.7	Very low	126 Å²	126	159.8 Å²	159.8	82%	0.818	81%	0.811	S	S	*	*				-135.6	164	88.9	38.4	-27.3	0	0	0	115.1
706	L	33.1	Very low	37.8	Very low	141 Å²	141	161.3 Å²	161.3	74%	0.738	81%	0.811	S	S	*	*			trans	-74.3	160.6	179.7	-52.1	105.6	0	0	0	113.3
707	K	34.3	Very low	38.2	Very low	213 Å²	213	162.7 Å²	162.7	93%	0.926	82%	0.816	S	S	*	*			trans	-150.5	137	135	-115.2	164.2	-172.4	176.8	0	112.7
708	I	38.1	Very low	38.4	Very low	130 Å²	130	165.2 Å²	165.2	67%	0.667	82%	0.815	S	S	*	*			trans	-108.5	142.8	177.7	-63.9	156.8	0	0	0	106.6
709	F	34.2	Very low	38.8	Very low	195 Å²	195	168.6 Å²	168.6	86%	0.855	82%	0.82	S	S	*	*				-174.8	169.7	125.7	-115	-88.1	0	0	0	113.4
710	K	40.5	Very low	38.1	Very low	178 Å²	178	170.8 Å²	170.8	77%	0.774	82%	0.816	S	S	*	*			trans	-97.6	153.5	-172.7	-60.8	169.5	179.9	172.6	0	111.7
711	K	37.4	Very low	38.6	Very low	198 Å²	198	177.3 Å²	177.3	86%	0.861	82%	0.82	S	S	*	*			trans	6.4	159.8	132	-67.2	-175.7	179.3	-176	0	118.8
712	P	55.3	Low	38.9	Very low	110 Å²	110	174.2 Å²	174.2	71%	0.714	82%	0.82	S	S	*	*			cis	-144	-158.2	-21.9	33.8	-9.8	0	0	0	113.4
713	L	35.6	Very low	39.3	Very low	140 Å²	140	174.8 Å²	174.8	73%	0.733	83%	0.827	S	S	*	*			trans	105.7	113.5	132.7	-145.4	71.7	0	0	0	120
714	K	37.3	Very low	39.5	Very low	177 Å²	177	173.2 Å²	173.2	77%	0.77	83%	0.826	S	S	*	*			trans	37.3	132.3	141.9	-58.9	-178.7	178.6	-170.5	0	121
715	K	45.1	Very low	40.2	Very low	274 Å²	274	171.1 Å²	171.1	100%	1.191	82%	0.822	S	S	*	*				-100.9	0	94	-82.3	-174.5	173	-179.6	0	108.7

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