A0A077ZMY3_TRITR Loading...

Cation efflux domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZMY3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 319 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	43	Very low	232 Å²	232	137.8 Å²	137.8	100%	1.143	72%	0.715	S	S	*	*				0	25.7	0	-82.1	171	72.2	0	0	114.8
2	S	45.6	Very low	42.4	Very low	93 Å²	93	138.3 Å²	138.3	65%	0.65	72%	0.717	S	S	*	*			trans	-132.3	28.3	-170.9	-158.6	0	0	0	0	117.2
3	V	47.3	Very low	41.5	Very low	120 Å²	120	137.2 Å²	137.2	73%	0.727	73%	0.726	S	S	*	*	S	Bend	trans	-108.5	-38	170	-177.4	0	0	0	0	111.5	R5	V3-R5 PolarHBondContact O-N 3.32Å
4	R	46	Very low	41.1	Very low	230 Å²	230	136.1 Å²	136.1	87%	0.868	73%	0.731	S	S	*	*	H	α-helix	trans	-65.7	-33.9	-180	-77.8	-174.6	174.5	-176.1	-2.3	114.2
5	R	42.2	Very low	40.8	Very low	199 Å²	199	134.6 Å²	134.6	75%	0.751	74%	0.735	S	S	*	*	H	α-helix	trans	-73.7	-31.8	-177.5	-81.2	-172.5	177	-176.3	-0.7	113.9	V3	V3-R5 PolarHBondContact O-N 3.32Å
6	L	46.4	Very low	40.3	Very low	85 Å²	85	141 Å²	141	45%	0.445	75%	0.745	S	S	.	*	H	α-helix	trans	-74.5	-31.4	-179.4	-103.7	109.9	0	0	0	113	M35	L6-M35 HydrophobicContact CD2-CE 4.03Å
7	V	47.6	Very low	40	Very low	97 Å²	97	137.1 Å²	137.1	59%	0.588	73%	0.732	S	S	*	*	H	α-helix	trans	-70.3	-34.4	178.7	-178.8	0	0	0	0	111.4	I9 S11	V7-I9 PolarHBondContact O-N 3.15Å; V7-S11 PolarHBondContact O-OG 3.01Å
8	C	38.3	Very low	40	Very low	88 Å²	88	138.9 Å²	138.9	60%	0.595	74%	0.738	S	S	*	*	H	α-helix	trans	-69	-29.7	178.6	-88.8	0	0	0	0	114.4	L10 S11	C8-L10 PolarHBondContact O-N 2.74Å; C8-S11 PolarHBondContact O-N 3.49Å
9	I	40.8	Very low	39.9	Very low	138 Å²	138	139.1 Å²	139.1	71%	0.708	74%	0.744	S	S	*	*	H	α-helix	trans	-71.1	-23.8	-176.3	-64.1	170.9	0	0	0	111.4	V7 S11	V7-I9 PolarHBondContact O-N 3.15Å; I9-S11 VanDerWaalsContact C-N 3.35Å; I9-S11 PolarHBondContact O-N 3Å
10	L	40.7	Very low	39.8	Very low	140 Å²	140	138.6 Å²	138.6	73%	0.733	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-5.1	-179.2	-74.8	164.1	0	0	0	114.2	C8	C8-L10 PolarHBondContact O-N 2.74Å
11	S	42.9	Very low	40.2	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-2.3	-174.3	-42.8	0	0	0	0	114.7	V7 C8 I9	V7-S11 PolarHBondContact O-OG 3.01Å; C8-S11 PolarHBondContact O-N 3.49Å; I9-S11 VanDerWaalsContact C-N 3.35Å; I9-S11 PolarHBondContact O-N 3Å
12	I	35.6	Very low	41	Very low	143 Å²	143	131 Å²	131	73%	0.733	70%	0.703	S	S	*	*	S	Bend	trans	-125.1	78.7	-170.9	-49.8	172.3	0	0	0	109.7
13	C	30.8	Very low	41.4	Very low	124 Å²	124	130.7 Å²	130.7	84%	0.838	70%	0.696	S	S	*	*			trans	175.7	112	144.3	-112.2	0	0	0	0	110.7
14	P	36.7	Very low	41.7	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	69%	0.687	S	S	*	*			trans	-91.3	148.8	164	34.3	-26.4	0	0	0	110.6
15	S	35.6	Very low	42.5	Very low	114 Å²	114	122 Å²	122	80%	0.797	67%	0.668	S	S	*	*	S	Bend	trans	91.8	125.5	165.8	-156.6	0	0	0	0	118.4
16	R	33.1	Very low	43.7	Very low	237 Å²	237	119.7 Å²	119.7	89%	0.894	66%	0.66	S	S	*	*	S	Bend	trans	74.5	82.2	169.4	-71.1	-179.3	171.1	-179	-2.7	119
17	S	35.1	Very low	45	Very low	75 Å²	75	120 Å²	120	52%	0.524	66%	0.662	S	S	.	*			trans	171.8	81.9	130.9	45.2	0	0	0	0	112.2	V19 K20	S17-V19 PolarHBondContact O-N 3.49Å; S17-V19 VanDerWaalsContact O-N 3.15Å; S17-K20 PolarHBondContact O-N 2.77Å
18	M	39.8	Very low	46.1	Very low	170 Å²	170	118 Å²	118	84%	0.837	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-65.1	-14.9	179.3	-133.5	172.9	-174.1	0	0	113.7	T21	M18-T21 WeakPolarHBondContact O-CG2 3.32Å; M18-T21 PolarHBondContact O-OG1 3.46Å
19	V	39.3	Very low	47.6	Very low	141 Å²	141	118.2 Å²	118.2	86%	0.855	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-82.8	-13.7	-179.7	-174.9	0	0	0	0	113.2	S17	S17-V19 PolarHBondContact O-N 3.49Å; S17-V19 VanDerWaalsContact O-N 3.15Å
20	K	38	Very low	49.3	Very low	129 Å²	129	118.9 Å²	118.9	56%	0.561	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-88.3	-2	175.5	-71.6	-176.1	175.6	177.5	0	114	S17 N22 T23 L24	S17-K20 PolarHBondContact O-N 2.77Å; K20-N22 PolarHBondContact O-N 2.81Å; K20-T23 PolarHBondContact O-N 2.83Å; K20-T23 PolarHBondContact O-OG1 3.45Å; K20-L24 HydrophobicContact CB-CD1 3.93Å; K20-L24 WeakPolarHBondContact O-CB 3.03Å; K20-L24 PolarHBondContact O-N 2.78Å
21	T	46.9	Very low	51.1	Low	76 Å²	76	115.9 Å²	115.9	47%	0.466	62%	0.618	S	S	.	*	H	α-helix	trans	-63.4	-41.4	-172.6	49.2	0	0	0	0	113.2	M18 L24 S25	M18-T21 WeakPolarHBondContact O-CG2 3.32Å; M18-T21 PolarHBondContact O-OG1 3.46Å; T21-L24 PolarHBondContact O-N 3.4Å; T21-S25 WeakPolarHBondContact O-CA 3.44Å; T21-S25 WeakPolarHBondContact O-CB 3.38Å; T21-S25 PolarHBondContact O-N 3.42Å
22	N	51.7	Low	52.5	Low	137 Å²	137	115.3 Å²	115.3	73%	0.733	61%	0.606	S	S	*	*	H	α-helix	trans	-67.1	-41	-180	-92.3	-13.8	0	0	0	112.9	K20 Y26	K20-N22 PolarHBondContact O-N 2.81Å; N22-Y26 WeakPolarHBondContact O-CB 3.34Å; N22-Y26 PolarHBondContact O-N 3.43Å
23	T	54.1	Low	54.4	Low	85 Å²	85	114.3 Å²	114.3	52%	0.521	59%	0.593	S	S	.	*	H	α-helix	trans	-71.6	-41.3	176.6	46.3	0	0	0	0	112.3	K20 Y26 I27	K20-T23 PolarHBondContact O-N 2.83Å; K20-T23 PolarHBondContact O-OG1 3.45Å; T23-Y26 PolarHBondContact O-N 2.84Å; T23-I27 WeakPolarHBondContact O-CB 3.13Å; T23-I27 WeakPolarHBondContact O-CD1 3.32Å; T23-I27 WeakPolarHBondContact O-CG1 3.17Å; T23-I27 PolarHBondContact O-N 3.5Å
24	L	54.4	Low	56.8	Low	103 Å²	103	112.5 Å²	112.5	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-67.7	-40.7	176.9	-92.8	150	0	0	0	111.6	K20 T21 S28	K20-L24 HydrophobicContact CB-CD1 3.93Å; K20-L24 WeakPolarHBondContact O-CB 3.03Å; K20-L24 PolarHBondContact O-N 2.78Å; T21-L24 PolarHBondContact O-N 3.4Å; L24-S28 WeakPolarHBondContact O-CB 3.47Å; L24-S28 PolarHBondContact O-N 3.41Å
25	S	62.9	Low	58.9	Low	66 Å²	66	110.9 Å²	110.9	46%	0.462	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-45.6	173.2	-176.7	0	0	0	0	110.6	T21 S28 Y29	T21-S25 WeakPolarHBondContact O-CA 3.44Å; T21-S25 WeakPolarHBondContact O-CB 3.38Å; T21-S25 PolarHBondContact O-N 3.42Å; S25-S28 PolarHBondContact O-N 3.36Å; S25-Y29 WeakPolarHBondContact O-CB 3.16Å; S25-Y29 PolarHBondContact O-N 2.91Å
26	Y	67.1	Low	60.9	Low	150 Å²	150	106.9 Å²	106.9	59%	0.588	53%	0.529	S	S	*	.	H	α-helix	trans	-63.9	-44.6	177	-175.8	-94.9	0	0	0	113.1	N22 T23 Y29 R30	N22-Y26 WeakPolarHBondContact O-CB 3.34Å; N22-Y26 PolarHBondContact O-N 3.43Å; T23-Y26 PolarHBondContact O-N 2.84Å; Y26-Y29 PolarHBondContact O-N 2.79Å; Y26-R30 WeakPolarHBondContact O-CB 3.32Å; Y26-R30 PolarHBondContact O-N 3.01Å
27	I	73.4	Confident	63.3	Low	92 Å²	92	101.4 Å²	101.4	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-46.4	176.8	-69.3	164.7	0	0	0	110.1	T23 Y29 R30 I31	T23-I27 WeakPolarHBondContact O-CB 3.13Å; T23-I27 WeakPolarHBondContact O-CD1 3.32Å; T23-I27 WeakPolarHBondContact O-CG1 3.17Å; T23-I27 PolarHBondContact O-N 3.5Å; I27-Y29 VanDerWaalsContact C-N 3.33Å; I27-Y29 PolarHBondContact O-N 3.2Å; I27-R30 PolarHBondContact O-N 3.01Å; I27-I31 HydrophobicContact CG2-CD1 3.7Å; I27-I31 HydrophobicContact CG2-CG1 4.34Å; I27-I31 WeakPolarHBondContact O-CB 3.35Å; I27-I31 VanDerWaalsContact O-CG1 3.25Å; I27-I31 WeakPolarHBondContact O-CG1 3.25Å; I27-I31 PolarHBondContact O-N 2.82Å
28	S	70.1	Confident	65.6	Low	55 Å²	55	104.1 Å²	104.1	39%	0.385	52%	0.516	S	S	.	.	H	α-helix	trans	-59.2	-45	176.5	-173.3	0	0	0	0	111.1	L24 S25 I31 M32	L24-S28 WeakPolarHBondContact O-CB 3.47Å; L24-S28 PolarHBondContact O-N 3.41Å; S25-S28 PolarHBondContact O-N 3.36Å; S28-I31 PolarHBondContact O-N 3.41Å; S28-M32 VanDerWaalsContact O-CB 3.28Å; S28-M32 WeakPolarHBondContact O-CB 3.06Å; S28-M32 PolarHBondContact O-N 2.78Å
29	Y	70	Confident	67.5	Low	92 Å²	92	98.5 Å²	98.5	36%	0.361	49%	0.493	S	S	.	.	H	α-helix	trans	-61.8	-43.7	174.3	176.5	-103.2	0	0	0	112.3	S25 Y26 I27 M32 R33	S25-Y29 WeakPolarHBondContact O-CB 3.16Å; S25-Y29 PolarHBondContact O-N 2.91Å; Y26-Y29 PolarHBondContact O-N 2.79Å; I27-Y29 VanDerWaalsContact C-N 3.33Å; I27-Y29 PolarHBondContact O-N 3.2Å; Y29-M32 PolarHBondContact O-N 3.36Å; Y29-R33 WeakPolarHBondContact O-CB 3.1Å; Y29-R33 PolarHBondContact O-N 2.85Å; Y29-R33 PolarHBondContact OH-NE 2.94Å; Y29-R33 PolarHBondContact OH-NH2 3.16Å
30	R	76.4	Confident	69.4	Low	152 Å²	152	96.8 Å²	96.8	57%	0.574	47%	0.471	S	S	*	.	H	α-helix	trans	-64.3	-41.7	177.2	-172.7	176	-180	-179.4	-0.1	111.7	Y26 I27 N34	Y26-R30 WeakPolarHBondContact O-CB 3.32Å; Y26-R30 PolarHBondContact O-N 3.01Å; I27-R30 PolarHBondContact O-N 3.01Å; R30-N34 WeakPolarHBondContact O-CB 3.4Å; R30-N34 VanDerWaalsContact O-CG 3.31Å; R30-N34 PolarHBondContact O-N 3.19Å
31	I	79.3	Confident	71.6	Confident	77 Å²	77	98.2 Å²	98.2	40%	0.395	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-49.9	175.2	-70	169.5	0	0	0	110	I27 S28 R33 N34 M35	I27-I31 HydrophobicContact CG2-CD1 3.7Å; I27-I31 HydrophobicContact CG2-CG1 4.34Å; I27-I31 WeakPolarHBondContact O-CB 3.35Å; I27-I31 VanDerWaalsContact O-CG1 3.25Å; I27-I31 WeakPolarHBondContact O-CG1 3.25Å; I27-I31 PolarHBondContact O-N 2.82Å; S28-I31 PolarHBondContact O-N 3.41Å; I31-R33 VanDerWaalsContact C-N 3.33Å; I31-R33 PolarHBondContact O-N 3.45Å; I31-N34 PolarHBondContact O-N 3.09Å; I31-N34 VanDerWaalsContact O-N 3.13Å; I31-M35 HydrophobicContact CG2-CE 3.32Å; I31-M35 HydrophobicContact CG2-CG 4.43Å; I31-M35 HydrophobicContact CG2-SD 4.16Å; I31-M35 WeakPolarHBondContact O-CG 3.44Å; I31-M35 PolarHBondContact O-N 3.12Å
32	M	72	Confident	73.2	Confident	81 Å²	81	99.8 Å²	99.8	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-58.3	-45.7	177.8	-172	-166.7	-65.1	0	0	111	S28 Y29 N34 M35 V36	S28-M32 VanDerWaalsContact O-CB 3.28Å; S28-M32 WeakPolarHBondContact O-CB 3.06Å; S28-M32 PolarHBondContact O-N 2.78Å; Y29-M32 PolarHBondContact O-N 3.36Å; M32-N34 VanDerWaalsContact C-N 3.32Å; M32-N34 PolarHBondContact O-N 3.29Å; M32-M35 PolarHBondContact O-N 3.4Å; M32-V36 WeakPolarHBondContact O-CB 3.45Å; M32-V36 VanDerWaalsContact O-CG2 3.29Å; M32-V36 WeakPolarHBondContact O-CG2 3.28Å; M32-V36 PolarHBondContact O-N 2.82Å
33	R	76.8	Confident	74.6	Confident	123 Å²	123	96.7 Å²	96.7	46%	0.464	46%	0.463	S	S	.	.	H	α-helix	trans	-58.7	-42.5	176.1	-175.4	-168.9	-80	-162.8	-10	111.6	Y29 I31 V36 K37	Y29-R33 WeakPolarHBondContact O-CB 3.1Å; Y29-R33 PolarHBondContact O-N 2.85Å; Y29-R33 PolarHBondContact OH-NE 2.94Å; Y29-R33 PolarHBondContact OH-NH2 3.16Å; I31-R33 VanDerWaalsContact C-N 3.33Å; I31-R33 PolarHBondContact O-N 3.45Å; R33-V36 PolarHBondContact O-N 3.3Å; R33-K37 WeakPolarHBondContact O-CG 3.28Å; R33-K37 PolarHBondContact O-N 3Å
34	N	81.2	Confident	76	Confident	86 Å²	86	98.2 Å²	98.2	46%	0.46	46%	0.464	S	S	.	.	H	α-helix	trans	-68.2	-42.3	177.2	-74.9	-14.5	0	0	0	112.1	R30 I31 M32 V36 K37 Q38	R30-N34 WeakPolarHBondContact O-CB 3.4Å; R30-N34 VanDerWaalsContact O-CG 3.31Å; R30-N34 PolarHBondContact O-N 3.19Å; I31-N34 PolarHBondContact O-N 3.09Å; I31-N34 VanDerWaalsContact O-N 3.13Å; M32-N34 VanDerWaalsContact C-N 3.32Å; M32-N34 PolarHBondContact O-N 3.29Å; N34-V36 VanDerWaalsContact C-N 3.34Å; N34-V36 PolarHBondContact O-N 3.29Å; N34-K37 PolarHBondContact O-N 3.26Å; N34-Q38 WeakPolarHBondContact O-CB 3.38Å; N34-Q38 PolarHBondContact O-N 3.25Å
35	M	79.6	Confident	77.4	Confident	88 Å²	88	96.2 Å²	96.2	43%	0.433	46%	0.459	S	S	.	.	H	α-helix	trans	-59.8	-44.1	173.3	-70.3	178.9	-174.3	0	0	111.3	L6 I31 M32 Q38 S39	L6-M35 HydrophobicContact CD2-CE 4.03Å; I31-M35 HydrophobicContact CG2-CE 3.32Å; I31-M35 HydrophobicContact CG2-CG 4.43Å; I31-M35 HydrophobicContact CG2-SD 4.16Å; I31-M35 WeakPolarHBondContact O-CG 3.44Å; I31-M35 PolarHBondContact O-N 3.12Å; M32-M35 PolarHBondContact O-N 3.4Å; M35-Q38 PolarHBondContact O-N 2.97Å; M35-S39 WeakPolarHBondContact O-CB 3.23Å; M35-S39 PolarHBondContact O-N 2.8Å; M35-S39 PolarHBondContact O-OG 3.4Å; M35-S39 VanDerWaalsContact O-OG 3.06Å
36	V	78.6	Confident	78.2	Confident	30 Å²	30	98 Å²	98	18%	0.182	46%	0.463	C	S	.	.	H	α-helix	trans	-62.4	-44.3	176.6	170.3	0	0	0	0	111.2	M32 R33 N34 Q38 S39 R40	M32-V36 WeakPolarHBondContact O-CB 3.45Å; M32-V36 VanDerWaalsContact O-CG2 3.29Å; M32-V36 WeakPolarHBondContact O-CG2 3.28Å; M32-V36 PolarHBondContact O-N 2.82Å; R33-V36 PolarHBondContact O-N 3.3Å; N34-V36 VanDerWaalsContact C-N 3.34Å; N34-V36 PolarHBondContact O-N 3.29Å; V36-Q38 VanDerWaalsContact C-N 3.32Å; V36-Q38 PolarHBondContact O-N 3.47Å; V36-S39 PolarHBondContact O-N 3.03Å; V36-R40 WeakPolarHBondContact O-CG 3.4Å; V36-R40 PolarHBondContact O-N 2.97Å
37	K	82	Confident	78.9	Confident	122 Å²	122	98.1 Å²	98.1	53%	0.53	47%	0.466	S	S	.	.	H	α-helix	trans	-60.3	-41.3	175	-76.3	179.4	178.4	-174	0	111.9	R33 N34 R40 K41	R33-K37 WeakPolarHBondContact O-CG 3.28Å; R33-K37 PolarHBondContact O-N 3Å; N34-K37 PolarHBondContact O-N 3.26Å; K37-R40 PolarHBondContact O-N 3.47Å; K37-K41 PolarHBondContact O-N 3.42Å; K37-K41 VanDerWaalsContact O-N 3.11Å
38	Q	84	Confident	79.4	Confident	132 Å²	132	100.7 Å²	100.7	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-65.9	-45.3	176.6	-174.8	171.8	-5	0	0	111.5	N34 M35 V36 R40 K41 Q42	N34-Q38 WeakPolarHBondContact O-CB 3.38Å; N34-Q38 PolarHBondContact O-N 3.25Å; M35-Q38 PolarHBondContact O-N 2.97Å; V36-Q38 VanDerWaalsContact C-N 3.32Å; V36-Q38 PolarHBondContact O-N 3.47Å; Q38-R40 VanDerWaalsContact C-N 3.31Å; Q38-R40 PolarHBondContact O-N 3.49Å; Q38-K41 PolarHBondContact O-N 3.37Å; Q38-Q42 WeakPolarHBondContact O-CB 3.48Å; Q38-Q42 PolarHBondContact O-N 3.39Å
39	S	79	Confident	79.9	Confident	52 Å²	52	100.6 Å²	100.6	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-60.1	-38	174.6	-64.4	0	0	0	0	112.3	M35 V36 Q42 N43	M35-S39 WeakPolarHBondContact O-CB 3.23Å; M35-S39 PolarHBondContact O-N 2.8Å; M35-S39 PolarHBondContact O-OG 3.4Å; M35-S39 VanDerWaalsContact O-OG 3.06Å; V36-S39 PolarHBondContact O-N 3.03Å; S39-Q42 PolarHBondContact O-N 2.9Å; S39-N43 WeakPolarHBondContact O-CB 3.4Å; S39-N43 VanDerWaalsContact O-CG 3.28Å; S39-N43 PolarHBondContact O-N 3.33Å
40	R	79.7	Confident	80.4	Confident	105 Å²	105	98 Å²	98	40%	0.396	47%	0.474	S	S	.	.	H	α-helix	trans	-63.1	-48.3	173.6	-76	-177.4	-179.1	-164.6	-0.6	112.1	V36 K37 Q38 Q42 N43 E44 H293	V36-R40 WeakPolarHBondContact O-CG 3.4Å; V36-R40 PolarHBondContact O-N 2.97Å; K37-R40 PolarHBondContact O-N 3.47Å; Q38-R40 VanDerWaalsContact C-N 3.31Å; Q38-R40 PolarHBondContact O-N 3.49Å; R40-Q42 VanDerWaalsContact C-N 3.27Å; R40-Q42 PolarHBondContact O-N 3Å; R40-N43 PolarHBondContact O-N 3.31Å; R40-E44 PolarHBondContact O-N 2.95Å; R40-H293 PolarHBondContact NH2-O 2.99Å
41	K	83.5	Confident	80.8	Confident	158 Å²	158	94 Å²	94	69%	0.687	47%	0.467	S	S	*	.	H	α-helix	trans	-58.9	-40.8	176	-71.7	-178	178.4	-174.3	0	111.7	K37 Q38 E44 S45	K37-K41 PolarHBondContact O-N 3.42Å; K37-K41 VanDerWaalsContact O-N 3.11Å; Q38-K41 PolarHBondContact O-N 3.37Å; K41-E44 PolarHBondContact O-N 2.84Å; K41-S45 PolarHBondContact O-N 3.46Å
42	Q	82.5	Confident	80.9	Confident	109 Å²	109	97.8 Å²	97.8	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-66.5	-42	175.9	-172.9	169.7	-13	0	0	111.9	Q38 S39 R40 E44 S45 L46	Q38-Q42 WeakPolarHBondContact O-CB 3.48Å; Q38-Q42 PolarHBondContact O-N 3.39Å; S39-Q42 PolarHBondContact O-N 2.9Å; R40-Q42 VanDerWaalsContact C-N 3.27Å; R40-Q42 PolarHBondContact O-N 3Å; Q42-E44 VanDerWaalsContact C-N 3.32Å; Q42-E44 PolarHBondContact O-N 2.97Å; Q42-S45 PolarHBondContact O-N 3.24Å; Q42-S45 PolarHBondContact O-OG 2.91Å; Q42-L46 HydrophobicContact CG-CD1 4.3Å; Q42-L46 WeakPolarHBondContact O-CB 3.48Å; Q42-L46 VanDerWaalsContact O-CG 3.24Å; Q42-L46 WeakPolarHBondContact O-CG 3.45Å; Q42-L46 PolarHBondContact O-N 3.29Å
43	N	80.8	Confident	81.4	Confident	73 Å²	73	99 Å²	99	39%	0.39	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-36.3	175	-76.1	-12.1	0	0	0	112.3	S39 R40 K47	S39-N43 WeakPolarHBondContact O-CB 3.4Å; S39-N43 VanDerWaalsContact O-CG 3.28Å; S39-N43 PolarHBondContact O-N 3.33Å; R40-N43 PolarHBondContact O-N 3.31Å; N43-K47 WeakPolarHBondContact O-CB 3.36Å; N43-K47 VanDerWaalsContact O-CG 3.26Å; N43-K47 WeakPolarHBondContact O-CG 3.21Å; N43-K47 PolarHBondContact O-N 3.47Å
44	E	82.5	Confident	81.6	Confident	117 Å²	117	95.3 Å²	95.3	55%	0.547	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-41.9	174.3	-75.9	179.4	-175.9	0	0	112.7	R40 K41 Q42 K47 K48	R40-E44 PolarHBondContact O-N 2.95Å; K41-E44 PolarHBondContact O-N 2.84Å; Q42-E44 VanDerWaalsContact C-N 3.32Å; Q42-E44 PolarHBondContact O-N 2.97Å; E44-K47 PolarHBondContact O-N 2.96Å; E44-K48 WeakPolarHBondContact O-CG 3.22Å; E44-K48 PolarHBondContact O-N 3.11Å
45	S	83.5	Confident	81.9	Confident	61 Å²	61	98 Å²	98	43%	0.427	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-40.6	175.9	70.8	0	0	0	0	111.3	K41 Q42 K48 S49	K41-S45 PolarHBondContact O-N 3.46Å; Q42-S45 PolarHBondContact O-N 3.24Å; Q42-S45 PolarHBondContact O-OG 2.91Å; S45-K48 PolarHBondContact O-N 3.38Å; S45-S49 WeakPolarHBondContact O-CB 3.45Å; S45-S49 PolarHBondContact O-N 2.83Å; S45-S49 PolarHBondContact O-OG 2.86Å; S45-S49 VanDerWaalsContact O-OG 3.14Å
46	L	81.1	Confident	82.2	Confident	102 Å²	102	98.8 Å²	98.8	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-43.2	172.7	-71.8	173.9	0	0	0	111.8	Q42 S49 G50	Q42-L46 HydrophobicContact CG-CD1 4.3Å; Q42-L46 WeakPolarHBondContact O-CB 3.48Å; Q42-L46 VanDerWaalsContact O-CG 3.24Å; Q42-L46 WeakPolarHBondContact O-CG 3.45Å; Q42-L46 PolarHBondContact O-N 3.29Å; L46-S49 PolarHBondContact O-N 3.41Å; L46-G50 PolarHBondContact O-N 2.91Å
47	K	80.9	Confident	82.4	Confident	154 Å²	154	100.7 Å²	100.7	67%	0.67	50%	0.504	S	S	*	.	H	α-helix	trans	-61.6	-44.6	175.1	-76.8	175.4	-179.1	-174.5	0	112.1	N43 E44 G50 V51	N43-K47 WeakPolarHBondContact O-CB 3.36Å; N43-K47 VanDerWaalsContact O-CG 3.26Å; N43-K47 WeakPolarHBondContact O-CG 3.21Å; N43-K47 PolarHBondContact O-N 3.47Å; E44-K47 PolarHBondContact O-N 2.96Å; K47-G50 PolarHBondContact O-N 3.25Å; K47-V51 WeakPolarHBondContact O-CG2 3.45Å; K47-V51 PolarHBondContact O-N 3.48Å
48	K	83.1	Confident	82.6	Confident	145 Å²	145	98.4 Å²	98.4	63%	0.63	49%	0.494	S	S	*	.	H	α-helix	trans	-63.7	-41	176.7	-71.9	178	-176.7	179	0	112.1	E44 S45 R52	E44-K48 WeakPolarHBondContact O-CG 3.22Å; E44-K48 PolarHBondContact O-N 3.11Å; S45-K48 PolarHBondContact O-N 3.38Å; K48-R52 PolarHBondContact O-N 3.13Å
49	S	82.3	Confident	82.8	Confident	53 Å²	53	95.2 Å²	95.2	37%	0.371	49%	0.486	S	S	.	.	H	α-helix	trans	-68.6	-39.3	175.4	-64.8	0	0	0	0	112	S45 L46 V51 R52 L53	S45-S49 WeakPolarHBondContact O-CB 3.45Å; S45-S49 PolarHBondContact O-N 2.83Å; S45-S49 PolarHBondContact O-OG 2.86Å; S45-S49 VanDerWaalsContact O-OG 3.14Å; L46-S49 PolarHBondContact O-N 3.41Å; S49-V51 PolarHBondContact O-N 3Å; S49-R52 PolarHBondContact O-N 2.97Å; S49-R52 PolarHBondContact OG-NH2 3.35Å; S49-L53 WeakPolarHBondContact O-CB 3.5Å; S49-L53 PolarHBondContact O-N 2.93Å
50	G	80.1	Confident	83.1	Confident	37 Å²	37	96.3 Å²	96.3	38%	0.381	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-41.1	174.7	0	0	0	0	0	112.6	L46 K47 L53 A54	L46-G50 PolarHBondContact O-N 2.91Å; K47-G50 PolarHBondContact O-N 3.25Å; G50-L53 PolarHBondContact O-N 3.33Å; G50-A54 VanDerWaalsContact O-CB 3.28Å; G50-A54 WeakPolarHBondContact O-CB 3.24Å; G50-A54 PolarHBondContact O-N 2.99Å
51	V	84.3	Confident	83.6	Confident	68 Å²	68	92.8 Å²	92.8	41%	0.412	48%	0.482	S	S	.	.	H	α-helix	trans	-65	-39.7	174.3	171.4	0	0	0	0	112	K47 S49 K55	K47-V51 WeakPolarHBondContact O-CG2 3.45Å; K47-V51 PolarHBondContact O-N 3.48Å; S49-V51 PolarHBondContact O-N 3Å; V51-K55 WeakPolarHBondContact O-CG 3.32Å; V51-K55 PolarHBondContact O-N 3.25Å; V51-K55 VanDerWaalsContact O-N 3.15Å
52	R	81.3	Confident	83.9	Confident	157 Å²	157	89.6 Å²	89.6	59%	0.592	47%	0.472	S	S	*	.	H	α-helix	trans	-65.6	-45.6	175.7	-75.7	-177.1	-74	158.4	-2.1	111.2	K48 S49 A54 K55 I56	K48-R52 PolarHBondContact O-N 3.13Å; S49-R52 PolarHBondContact O-N 2.97Å; S49-R52 PolarHBondContact OG-NH2 3.35Å; R52-A54 PolarHBondContact O-N 2.92Å; R52-K55 PolarHBondContact O-N 2.78Å; R52-I56 WeakPolarHBondContact O-CG1 3.29Å; R52-I56 PolarHBondContact O-N 3.41Å; R52-I56 VanDerWaalsContact O-N 3.08Å
53	L	82.5	Confident	84.2	Confident	108 Å²	108	89.6 Å²	89.6	57%	0.565	47%	0.474	S	S	*	.	H	α-helix	trans	-59.9	-45.7	176.3	-178.8	61.3	0	0	0	111.2	S49 G50 K55 I56 T57	S49-L53 WeakPolarHBondContact O-CB 3.5Å; S49-L53 PolarHBondContact O-N 2.93Å; G50-L53 PolarHBondContact O-N 3.33Å; L53-K55 VanDerWaalsContact C-N 3.3Å; L53-K55 PolarHBondContact O-N 3.01Å; L53-I56 PolarHBondContact O-N 3.4Å; L53-I56 VanDerWaalsContact O-N 3.16Å; L53-T57 HydrophobicContact CD1-CG2 4.1Å; L53-T57 HydrophobicContact CG-CG2 4.33Å; L53-T57 WeakPolarHBondContact O-CG2 3.39Å; L53-T57 PolarHBondContact O-N 2.92Å; L53-T57 PolarHBondContact O-OG1 3.17Å; L53-T57 VanDerWaalsContact O-OG1 3.13Å
54	A	82.2	Confident	84.4	Confident	44 Å²	44	90.1 Å²	90.1	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-60.7	-36.2	178.4	0	0	0	0	0	113.1	G50 R52 T57 F58	G50-A54 VanDerWaalsContact O-CB 3.28Å; G50-A54 WeakPolarHBondContact O-CB 3.24Å; G50-A54 PolarHBondContact O-N 2.99Å; R52-A54 PolarHBondContact O-N 2.92Å; A54-T57 WeakPolarHBondContact CA-OG1 3.45Å; A54-T57 PolarHBondContact O-OG1 2.85Å; A54-T57 VanDerWaalsContact O-OG1 3.06Å; A54-F58 VanDerWaalsContact O-CB 3.24Å; A54-F58 WeakPolarHBondContact O-CB 3.35Å; A54-F58 PolarHBondContact O-N 3.42Å
55	K	86.2	Confident	84.7	Confident	142 Å²	142	86.4 Å²	86.4	62%	0.617	46%	0.46	S	S	*	.	H	α-helix	trans	-67.7	-45.4	173.9	-72.7	179.7	-179.9	-172.1	0	111.7	V51 R52 L53 F58 S59	V51-K55 WeakPolarHBondContact O-CG 3.32Å; V51-K55 PolarHBondContact O-N 3.25Å; V51-K55 VanDerWaalsContact O-N 3.15Å; R52-K55 PolarHBondContact O-N 2.78Å; L53-K55 VanDerWaalsContact C-N 3.3Å; L53-K55 PolarHBondContact O-N 3.01Å; K55-F58 PolarHBondContact O-N 3.11Å; K55-S59 PolarHBondContact O-N 3.47Å; K55-S59 PolarHBondContact O-OG 2.72Å
56	I	87.2	Confident	85	Confident	105 Å²	105	86.1 Å²	86.1	54%	0.538	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-48.8	179	-66.3	166.2	0	0	0	110.1	R52 L53 F58 S59 V60	R52-I56 WeakPolarHBondContact O-CG1 3.29Å; R52-I56 PolarHBondContact O-N 3.41Å; R52-I56 VanDerWaalsContact O-N 3.08Å; L53-I56 PolarHBondContact O-N 3.4Å; L53-I56 VanDerWaalsContact O-N 3.16Å; I56-F58 VanDerWaalsContact C-N 3.32Å; I56-F58 PolarHBondContact O-N 3.34Å; I56-S59 PolarHBondContact O-N 2.99Å; I56-V60 HydrophobicContact CG2-CG2 4.35Å; I56-V60 VanDerWaalsContact O-CG2 3.31Å; I56-V60 WeakPolarHBondContact O-CG2 3.48Å; I56-V60 PolarHBondContact O-N 3.37Å
57	T	81.8	Confident	85.3	Confident	71 Å²	71	85.4 Å²	85.4	44%	0.436	46%	0.461	S	S	.	.	H	α-helix	trans	-61.7	-41	178.9	54.6	0	0	0	0	111.5	L53 A54 V60 S61	L53-T57 HydrophobicContact CD1-CG2 4.1Å; L53-T57 HydrophobicContact CG-CG2 4.33Å; L53-T57 WeakPolarHBondContact O-CG2 3.39Å; L53-T57 PolarHBondContact O-N 2.92Å; L53-T57 PolarHBondContact O-OG1 3.17Å; L53-T57 VanDerWaalsContact O-OG1 3.13Å; A54-T57 WeakPolarHBondContact CA-OG1 3.45Å; A54-T57 PolarHBondContact O-OG1 2.85Å; A54-T57 VanDerWaalsContact O-OG1 3.06Å; T57-V60 PolarHBondContact O-N 3.34Å; T57-S61 WeakPolarHBondContact O-CB 3.28Å; T57-S61 PolarHBondContact O-N 3.11Å; T57-S61 PolarHBondContact O-OG 2.67Å
58	F	86.8	Confident	85.4	Confident	73 Å²	73	80.9 Å²	80.9	32%	0.32	44%	0.442	S	S	.	.	H	α-helix	trans	-61.3	-45	174.8	-173.6	-98.1	0	0	0	112.5	A54 K55 I56 S61 L62 I91 V95	A54-F58 VanDerWaalsContact O-CB 3.24Å; A54-F58 WeakPolarHBondContact O-CB 3.35Å; A54-F58 PolarHBondContact O-N 3.42Å; K55-F58 PolarHBondContact O-N 3.11Å; I56-F58 VanDerWaalsContact C-N 3.32Å; I56-F58 PolarHBondContact O-N 3.34Å; F58-S61 PolarHBondContact O-N 2.85Å; F58-L62 WeakPolarHBondContact O-CB 3.34Å; F58-L62 PolarHBondContact O-N 3.33Å; F58-I91 HydrophobicContact CD2-CD1 4.46Å; F58-I91 HydrophobicContact CE2-CD1 4.21Å; F58-I91 HydrophobicContact CE2-CG2 4.4Å; F58-V95 HydrophobicContact CE2-CG2 3.86Å; F58-V95 HydrophobicContact CZ-CG2 4.16Å
59	S	87	Confident	85.6	Confident	65 Å²	65	76.1 Å²	76.1	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-42.7	176.9	-66.2	0	0	0	0	112.5	K55 I56 L62 I63	K55-S59 PolarHBondContact O-N 3.47Å; K55-S59 PolarHBondContact O-OG 2.72Å; I56-S59 PolarHBondContact O-N 2.99Å; S59-L62 PolarHBondContact O-N 3.02Å; S59-I63 WeakPolarHBondContact O-CG1 3.32Å; S59-I63 PolarHBondContact O-N 2.85Å; S59-I63 VanDerWaalsContact O-N 3.13Å
60	V	86.4	Confident	85.7	Confident	75 Å²	75	77.8 Å²	77.8	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-62.6	-46.7	175.7	173.7	0	0	0	0	110.5	I56 T57 L62 I63 L64	I56-V60 HydrophobicContact CG2-CG2 4.35Å; I56-V60 VanDerWaalsContact O-CG2 3.31Å; I56-V60 WeakPolarHBondContact O-CG2 3.48Å; I56-V60 PolarHBondContact O-N 3.37Å; T57-V60 PolarHBondContact O-N 3.34Å; V60-L62 PolarHBondContact O-N 3.38Å; V60-I63 PolarHBondContact O-N 3.49Å; V60-L64 HydrophobicContact CG1-CD1 4.05Å; V60-L64 HydrophobicContact CG1-CG 4.47Å; V60-L64 WeakPolarHBondContact O-CG 3.48Å; V60-L64 PolarHBondContact O-N 3.42Å
61	S	89	Confident	85.8	Confident	32 Å²	32	77.5 Å²	77.5	22%	0.224	43%	0.431	C	S	.	.	H	α-helix	trans	-60.3	-33.9	176.9	-64.5	0	0	0	0	112.3	T57 F58 L64 L65	T57-S61 WeakPolarHBondContact O-CB 3.28Å; T57-S61 PolarHBondContact O-N 3.11Å; T57-S61 PolarHBondContact O-OG 2.67Å; F58-S61 PolarHBondContact O-N 2.85Å; S61-L64 PolarHBondContact O-N 3.44Å; S61-L65 WeakPolarHBondContact O-CB 3.23Å; S61-L65 PolarHBondContact O-N 3.24Å
62	L	90.9	Very high	85.5	Confident	90 Å²	90	74.6 Å²	74.6	47%	0.471	42%	0.415	S	S	.	.	H	α-helix	trans	-70.2	-42.4	-179.5	-177.5	64.1	0	0	0	111	F58 S59 V60 L65 A66 I91	F58-L62 WeakPolarHBondContact O-CB 3.34Å; F58-L62 PolarHBondContact O-N 3.33Å; S59-L62 PolarHBondContact O-N 3.02Å; V60-L62 PolarHBondContact O-N 3.38Å; L62-L65 PolarHBondContact O-N 3.39Å; L62-A66 PolarHBondContact O-N 2.94Å; L62-I91 HydrophobicContact CB-CD1 4.14Å
63	I	89.6	Confident	85.5	Confident	109 Å²	109	70.3 Å²	70.3	56%	0.559	42%	0.42	S	S	*	.	H	α-helix	trans	-63.7	-45	174.9	-64.9	165.3	0	0	0	110	S59 V60 L65 A66 V67	S59-I63 WeakPolarHBondContact O-CG1 3.32Å; S59-I63 PolarHBondContact O-N 2.85Å; S59-I63 VanDerWaalsContact O-N 3.13Å; V60-I63 PolarHBondContact O-N 3.49Å; I63-L65 VanDerWaalsContact C-N 3.32Å; I63-L65 PolarHBondContact O-N 3.06Å; I63-A66 PolarHBondContact O-N 3.32Å; I63-V67 HydrophobicContact CG2-CG2 4.38Å; I63-V67 WeakPolarHBondContact O-CG2 3.32Å; I63-V67 PolarHBondContact O-N 2.83Å
64	L	83.6	Confident	85.3	Confident	84 Å²	84	72 Å²	72	44%	0.44	43%	0.429	S	S	.	.	H	α-helix	trans	-60.8	-40.1	177.5	-73.5	173.7	0	0	0	112.3	V60 S61 K68	V60-L64 HydrophobicContact CG1-CD1 4.05Å; V60-L64 HydrophobicContact CG1-CG 4.47Å; V60-L64 WeakPolarHBondContact O-CG 3.48Å; V60-L64 PolarHBondContact O-N 3.42Å; S61-L64 PolarHBondContact O-N 3.44Å; L64-K68 WeakPolarHBondContact O-CB 3.25Å; L64-K68 WeakPolarHBondContact O-CG 3.41Å; L64-K68 PolarHBondContact O-N 3.27Å
65	L	89.8	Confident	84.9	Confident	39 Å²	39	70.8 Å²	70.8	20%	0.204	42%	0.418	C	S	.	.	H	α-helix	trans	-62.9	-46.1	174.4	177.2	60.5	0	0	0	111.3	S61 L62 I63 K68 A69 V84 I91	S61-L65 WeakPolarHBondContact O-CB 3.23Å; S61-L65 PolarHBondContact O-N 3.24Å; L62-L65 PolarHBondContact O-N 3.39Å; I63-L65 VanDerWaalsContact C-N 3.32Å; I63-L65 PolarHBondContact O-N 3.06Å; L65-K68 PolarHBondContact O-N 2.96Å; L65-A69 WeakPolarHBondContact O-CB 3.42Å; L65-A69 PolarHBondContact O-N 3.02Å; L65-V84 HydrophobicContact CD1-CG1 4.07Å; L65-I91 HydrophobicContact CB-CG1 4.33Å; L65-I91 HydrophobicContact CD2-CB 4.4Å; L65-I91 HydrophobicContact CD2-CG1 3.87Å
66	A	89.9	Confident	84.2	Confident	56 Å²	56	67.1 Å²	67.1	46%	0.463	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-47.2	178.8	0	0	0	0	0	111.7	L62 I63 K68 A69 T70	L62-A66 PolarHBondContact O-N 2.94Å; I63-A66 PolarHBondContact O-N 3.32Å; A66-K68 PolarHBondContact O-N 3.4Å; A66-A69 PolarHBondContact O-N 2.89Å; A66-T70 WeakPolarHBondContact O-CG2 3.35Å; A66-T70 PolarHBondContact O-N 3.44Å; A66-T70 PolarHBondContact O-OG1 3Å
67	V	86.3	Confident	83.5	Confident	86 Å²	86	63.5 Å²	63.5	52%	0.521	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-48.8	177	173.3	0	0	0	0	110.8	I63 A69 T70 A71	I63-V67 HydrophobicContact CG2-CG2 4.38Å; I63-V67 WeakPolarHBondContact O-CG2 3.32Å; I63-V67 PolarHBondContact O-N 2.83Å; V67-A69 VanDerWaalsContact C-N 3.35Å; V67-A69 PolarHBondContact O-N 3.49Å; V67-T70 PolarHBondContact O-N 3.17Å; V67-T70 PolarHBondContact O-OG1 3.06Å; V67-A71 PolarHBondContact O-N 3.37Å
68	K	83.9	Confident	82.8	Confident	60 Å²	60	66.1 Å²	66.1	26%	0.261	42%	0.415	S	S	.	.	H	α-helix	trans	-66.5	-35.8	179	-72.3	174.8	177	-177.7	0	112.5	L64 L65 A66 A71 G72 S83 V84 D86 S87	L64-K68 WeakPolarHBondContact O-CB 3.25Å; L64-K68 WeakPolarHBondContact O-CG 3.41Å; L64-K68 PolarHBondContact O-N 3.27Å; L65-K68 PolarHBondContact O-N 2.96Å; A66-K68 PolarHBondContact O-N 3.4Å; K68-A71 PolarHBondContact O-N 2.85Å; K68-G72 PolarHBondContact O-N 3.06Å; K68-S83 WeakPolarHBondContact CD-O 3.45Å; K68-V84 VanDerWaalsContact C-CG2 3.48Å; K68-V84 HydrophobicContact CB-CG2 4.1Å; K68-V84 WeakPolarHBondContact O-CG2 3.48Å; K68-D86 IonicContact NZ-OD2 3.3Å; K68-S87 WeakPolarHBondContact CD-OG 3.42Å; K68-S87 WeakPolarHBondContact CE-OG 3.31Å; K68-S87 PolarHBondContact NZ-OG 3.2Å
69	A	86.6	Confident	82	Confident	44 Å²	44	67.1 Å²	67.1	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-43.9	177.3	0	0	0	0	0	111.3	L65 A66 V67 G72 G73 V84	L65-A69 WeakPolarHBondContact O-CB 3.42Å; L65-A69 PolarHBondContact O-N 3.02Å; A66-A69 PolarHBondContact O-N 2.89Å; V67-A69 VanDerWaalsContact C-N 3.35Å; V67-A69 PolarHBondContact O-N 3.49Å; A69-G72 PolarHBondContact O-N 3.34Å; A69-G73 PolarHBondContact O-N 3.37Å; A69-V84 HydrophobicContact CB-CG1 4.38Å
70	T	85.1	Confident	81.3	Confident	89 Å²	89	64.4 Å²	64.4	55%	0.546	41%	0.412	S	S	.	.	H	α-helix	trans	-62.8	-45.2	174.2	59.3	0	0	0	0	111.7	A66 V67 G72 G73 L74	A66-T70 WeakPolarHBondContact O-CG2 3.35Å; A66-T70 PolarHBondContact O-N 3.44Å; A66-T70 PolarHBondContact O-OG1 3Å; V67-T70 PolarHBondContact O-N 3.17Å; V67-T70 PolarHBondContact O-OG1 3.06Å; T70-G72 VanDerWaalsContact C-N 3.29Å; T70-G72 PolarHBondContact O-N 2.91Å; T70-G73 PolarHBondContact O-N 2.81Å; T70-L74 WeakPolarHBondContact O-CG 3.28Å; T70-L74 PolarHBondContact O-N 3.01Å; T70-L74 VanDerWaalsContact O-N 3.12Å
71	A	81.4	Confident	80.7	Confident	30 Å²	30	64.7 Å²	64.7	25%	0.248	41%	0.41	C	S	.	.	H	α-helix	trans	-61.1	-38.4	174.6	0	0	0	0	0	112.1	V67 K68 L74 S75 V80	V67-A71 PolarHBondContact O-N 3.37Å; K68-A71 PolarHBondContact O-N 2.85Å; A71-L74 PolarHBondContact O-N 3.17Å; A71-S75 WeakPolarHBondContact O-CB 3.45Å; A71-S75 PolarHBondContact O-N 3Å; A71-V80 HydrophobicContact CB-CG1 4.14Å
72	G	78.8	Confident	80.2	Confident	7 Å²	7	64.2 Å²	64.2	7%	0.072	41%	0.406	C	S	.	.	H	α-helix	trans	-65.5	-45.2	177.9	0	0	0	0	0	113.1	K68 A69 T70 L74 S75 G76 V80	K68-G72 PolarHBondContact O-N 3.06Å; A69-G72 PolarHBondContact O-N 3.34Å; T70-G72 VanDerWaalsContact C-N 3.29Å; T70-G72 PolarHBondContact O-N 2.91Å; G72-L74 VanDerWaalsContact C-N 3.33Å; G72-L74 PolarHBondContact O-N 3.25Å; G72-S75 PolarHBondContact O-N 2.86Å; G72-G76 PolarHBondContact O-N 2.98Å; G72-G76 VanDerWaalsContact O-N 3.16Å; G72-V80 VanDerWaalsContact CA-CG1 3.4Å
73	G	79.7	Confident	79.6	Confident	68 Å²	68	61.6 Å²	61.6	70%	0.701	40%	0.396	S	S	*	.	H	α-helix	trans	-63.6	-36.9	177	0	0	0	0	0	113.1	A69 T70	A69-G73 PolarHBondContact O-N 3.37Å; T70-G73 PolarHBondContact O-N 2.81Å
74	L	79.9	Confident	79.3	Confident	143 Å²	143	58.1 Å²	58.1	75%	0.749	38%	0.379	S	S	*	.	H	α-helix	trans	-77.8	-36.9	178.1	-66.4	173.4	0	0	0	113	T70 A71 G72	T70-L74 WeakPolarHBondContact O-CG 3.28Å; T70-L74 PolarHBondContact O-N 3.01Å; T70-L74 VanDerWaalsContact O-N 3.12Å; A71-L74 PolarHBondContact O-N 3.17Å; G72-L74 VanDerWaalsContact C-N 3.33Å; G72-L74 PolarHBondContact O-N 3.25Å
75	S	73.8	Confident	79.3	Confident	19 Å²	19	56.7 Å²	56.7	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-82.9	-24.8	-171.9	-161.6	0	0	0	0	113.4	A71 G72 S77 T158 T159	A71-S75 WeakPolarHBondContact O-CB 3.45Å; A71-S75 PolarHBondContact O-N 3Å; G72-S75 PolarHBondContact O-N 2.86Å; S75-S77 PolarHBondContact O-N 2.94Å; S75-S77 PolarHBondContact O-OG 3.25Å; S75-S77 PolarHBondContact OG-OG 3.04Å; S75-T158 PolarHBondContact OG-OG1 3.25Å; S75-T159 WeakPolarHBondContact OG-CG2 3.23Å
76	G	70.6	Confident	79.1	Confident	64 Å²	64	57.3 Å²	57.3	66%	0.66	38%	0.377	S	S	*	.			trans	58.4	7.2	-174.7	0	0	0	0	0	114.7	G72	G72-G76 PolarHBondContact O-N 2.98Å; G72-G76 VanDerWaalsContact O-N 3.16Å
77	S	71.6	Confident	79	Confident	30 Å²	30	54.9 Å²	54.9	21%	0.21	36%	0.357	C	S	.	.			trans	-91.4	133.5	-167.6	-52.8	0	0	0	0	111.1	S75 S79 V80 I81 T159	S75-S77 PolarHBondContact O-N 2.94Å; S75-S77 PolarHBondContact O-OG 3.25Å; S75-S77 PolarHBondContact OG-OG 3.04Å; S77-S79 PolarHBondContact O-N 3.11Å; S77-V80 PolarHBondContact O-N 3.38Å; S77-I81 WeakPolarHBondContact O-CG1 3.34Å; S77-I81 PolarHBondContact O-N 3.03Å; S77-T159 WeakPolarHBondContact OG-CG2 3.44Å
78	L	68.4	Low	79.1	Confident	125 Å²	125	52 Å²	52	65%	0.654	35%	0.345	S	S	*	.	H	α-helix	trans	-57.5	-35.1	-179.2	-171	66	0	0	0	113.1	S82	L78-S82 PolarHBondContact O-N 2.87Å; L78-S82 VanDerWaalsContact O-N 3.08Å
79	S	69.5	Low	79.4	Confident	95 Å²	95	50.4 Å²	50.4	66%	0.664	34%	0.339	S	S	*	.	H	α-helix	trans	-64.5	-44.3	175.3	177.9	0	0	0	0	112.2	S77 I81 S82 S83	S77-S79 PolarHBondContact O-N 3.11Å; S79-I81 PolarHBondContact O-N 3.4Å; S79-S82 VanDerWaalsContact O-CB 3.22Å; S79-S82 WeakPolarHBondContact O-CB 3.28Å; S79-S82 PolarHBondContact O-N 3.25Å; S79-S82 VanDerWaalsContact O-N 3.12Å; S79-S83 PolarHBondContact O-N 2.91Å
80	V	71.4	Confident	79.4	Confident	8 Å²	8	52.1 Å²	52.1	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-68.1	-39	179.4	-171.5	0	0	0	0	110.4	A71 G72 S77 S82 S83 V84 I162	A71-V80 HydrophobicContact CB-CG1 4.14Å; G72-V80 VanDerWaalsContact CA-CG1 3.4Å; S77-V80 PolarHBondContact O-N 3.38Å; V80-S82 VanDerWaalsContact C-N 3.26Å; V80-S82 PolarHBondContact O-N 2.99Å; V80-S83 WeakPolarHBondContact O-CB 3.29Å; V80-S83 PolarHBondContact O-N 3.17Å; V80-S83 PolarHBondContact O-OG 2.79Å; V80-V84 WeakPolarHBondContact O-CG2 3.39Å; V80-V84 PolarHBondContact O-N 2.94Å; V80-V84 VanDerWaalsContact O-N 3.11Å; V80-I162 HydrophobicContact CG2-CD1 3.79Å
81	I	75.6	Confident	79.7	Confident	81 Å²	81	49 Å²	49	42%	0.415	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-39.1	172.2	-63	169.1	0	0	0	111	S77 S79 S83 V84 V85	S77-I81 WeakPolarHBondContact O-CG1 3.34Å; S77-I81 PolarHBondContact O-N 3.03Å; S79-I81 PolarHBondContact O-N 3.4Å; I81-S83 VanDerWaalsContact C-N 3.3Å; I81-S83 PolarHBondContact O-N 3.37Å; I81-V84 WeakPolarHBondContact O-CB 3.44Å; I81-V84 PolarHBondContact O-N 2.92Å; I81-V84 VanDerWaalsContact O-N 3.16Å; I81-V85 WeakPolarHBondContact O-CG2 3.46Å; I81-V85 PolarHBondContact O-N 3.39Å
82	S	77	Confident	80.2	Confident	21 Å²	21	49.4 Å²	49.4	15%	0.147	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-40.9	174.3	-153.4	0	0	0	0	112.6	L78 S79 V80 V84 V85 D86 K141	L78-S82 PolarHBondContact O-N 2.87Å; L78-S82 VanDerWaalsContact O-N 3.08Å; S79-S82 VanDerWaalsContact O-CB 3.22Å; S79-S82 WeakPolarHBondContact O-CB 3.28Å; S79-S82 PolarHBondContact O-N 3.25Å; S79-S82 VanDerWaalsContact O-N 3.12Å; V80-S82 VanDerWaalsContact C-N 3.26Å; V80-S82 PolarHBondContact O-N 2.99Å; S82-V84 VanDerWaalsContact C-N 3.28Å; S82-V84 PolarHBondContact O-N 3.41Å; S82-V85 PolarHBondContact O-N 2.84Å; S82-D86 PolarHBondContact O-N 3.16Å; S82-K141 WeakPolarHBondContact OG-CD 3.4Å; S82-K141 PolarHBondContact OG-NZ 3.23Å
83	S	79.5	Confident	80.8	Confident	36 Å²	36	49.5 Å²	49.5	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-66.7	-30.8	177.6	80.5	0	0	0	0	112.9	K68 S79 V80 I81 S87	K68-S83 WeakPolarHBondContact CD-O 3.45Å; S79-S83 PolarHBondContact O-N 2.91Å; V80-S83 WeakPolarHBondContact O-CB 3.29Å; V80-S83 PolarHBondContact O-N 3.17Å; V80-S83 PolarHBondContact O-OG 2.79Å; I81-S83 VanDerWaalsContact C-N 3.3Å; I81-S83 PolarHBondContact O-N 3.37Å; S83-S87 PolarHBondContact O-N 2.77Å; S83-S87 PolarHBondContact O-OG 2.83Å
84	V	83.4	Confident	81.3	Confident	35 Å²	35	47.2 Å²	47.2	21%	0.212	30%	0.298	C	S	.	.	H	α-helix	trans	-67.6	-46.1	173.4	178.5	0	0	0	0	110.5	L65 K68 A69 V80 I81 S82 D86 S87 G88	L65-V84 HydrophobicContact CD1-CG1 4.07Å; K68-V84 VanDerWaalsContact C-CG2 3.48Å; K68-V84 HydrophobicContact CB-CG2 4.1Å; K68-V84 WeakPolarHBondContact O-CG2 3.48Å; A69-V84 HydrophobicContact CB-CG1 4.38Å; V80-V84 WeakPolarHBondContact O-CG2 3.39Å; V80-V84 PolarHBondContact O-N 2.94Å; V80-V84 VanDerWaalsContact O-N 3.11Å; I81-V84 WeakPolarHBondContact O-CB 3.44Å; I81-V84 PolarHBondContact O-N 2.92Å; I81-V84 VanDerWaalsContact O-N 3.16Å; S82-V84 VanDerWaalsContact C-N 3.28Å; S82-V84 PolarHBondContact O-N 3.41Å; V84-D86 PolarHBondContact O-N 3.14Å; V84-S87 PolarHBondContact O-N 2.79Å; V84-G88 PolarHBondContact O-N 2.98Å
85	V	83.5	Confident	81.9	Confident	54 Å²	54	42.9 Å²	42.9	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-46	177.7	172.8	0	0	0	0	111.1	I81 S82 S87 G88 M89	I81-V85 WeakPolarHBondContact O-CG2 3.46Å; I81-V85 PolarHBondContact O-N 3.39Å; S82-V85 PolarHBondContact O-N 2.84Å; V85-S87 PolarHBondContact O-N 3.17Å; V85-G88 WeakPolarHBondContact O-CA 3.41Å; V85-G88 PolarHBondContact O-N 3.22Å; V85-G88 VanDerWaalsContact O-N 3.15Å; V85-M89 HydrophobicContact CG1-CE 3.81Å; V85-M89 HydrophobicContact CG1-SD 3.99Å; V85-M89 WeakPolarHBondContact O-CG 3.23Å; V85-M89 PolarHBondContact O-N 2.83Å
86	D	84.8	Confident	82.8	Confident	52 Å²	52	43.6 Å²	43.6	28%	0.278	28%	0.279	S	S	.	.	H	α-helix	trans	-54.9	-49	175.3	168.7	78	0	0	0	112.1	K68 S82 V84 G88 M89 H90	K68-D86 IonicContact NZ-OD2 3.3Å; S82-D86 PolarHBondContact O-N 3.16Å; V84-D86 PolarHBondContact O-N 3.14Å; D86-G88 VanDerWaalsContact C-N 3.32Å; D86-G88 PolarHBondContact O-N 3.32Å; D86-M89 PolarHBondContact O-N 2.99Å; D86-H90 PolarHBondContact O-CD2 3.02Å; D86-H90 VanDerWaalsContact O-CD2 3.25Å; D86-H90 PolarHBondContact O-N 2.87Å; D86-H90 IonicContact OD1-CD2 3.79Å; D86-H90 IonicContact OD1-NE2 3.91Å; D86-H90 IonicContact OD2-CD2 3.2Å
87	S	87.2	Confident	83.8	Confident	5 Å²	5	44.4 Å²	44.4	4%	0.035	27%	0.268	C	S	.	.	H	α-helix	trans	-70	-30.4	178.5	-61.2	0	0	0	0	112.9	K68 S83 V84 V85 H90 I91	K68-S87 WeakPolarHBondContact CD-OG 3.42Å; K68-S87 WeakPolarHBondContact CE-OG 3.31Å; K68-S87 PolarHBondContact NZ-OG 3.2Å; S83-S87 PolarHBondContact O-N 2.77Å; S83-S87 PolarHBondContact O-OG 2.83Å; V84-S87 PolarHBondContact O-N 2.79Å; V85-S87 PolarHBondContact O-N 3.17Å; S87-H90 PolarHBondContact O-N 3.3Å; S87-I91 WeakPolarHBondContact O-CG1 3.36Å; S87-I91 PolarHBondContact O-N 3.03Å
88	G	89.4	Confident	84.7	Confident	26 Å²	26	50.4 Å²	50.4	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-41.7	170.8	0	0	0	0	0	112.1	V84 V85 D86 I91 A92	V84-G88 PolarHBondContact O-N 2.98Å; V85-G88 WeakPolarHBondContact O-CA 3.41Å; V85-G88 PolarHBondContact O-N 3.22Å; V85-G88 VanDerWaalsContact O-N 3.15Å; D86-G88 VanDerWaalsContact C-N 3.32Å; D86-G88 PolarHBondContact O-N 3.32Å; G88-I91 WeakPolarHBondContact O-CB 3.46Å; G88-I91 PolarHBondContact O-N 3Å; G88-A92 PolarHBondContact O-N 3.3Å
89	M	89.2	Confident	85.8	Confident	26 Å²	26	49.1 Å²	49.1	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-34.9	176.8	-71.8	168.4	165	0	0	112.6	V85 D86 I91 A92 S93 I130 M131 A134	V85-M89 HydrophobicContact CG1-CE 3.81Å; V85-M89 HydrophobicContact CG1-SD 3.99Å; V85-M89 WeakPolarHBondContact O-CG 3.23Å; V85-M89 PolarHBondContact O-N 2.83Å; D86-M89 PolarHBondContact O-N 2.99Å; M89-I91 VanDerWaalsContact C-N 3.34Å; M89-A92 PolarHBondContact O-N 2.97Å; M89-S93 WeakPolarHBondContact O-CB 3.43Å; M89-S93 PolarHBondContact O-N 3.32Å; M89-S93 PolarHBondContact O-OG 2.89Å; M89-I130 HydrophobicContact CB-CG2 4.01Å; M89-I130 HydrophobicContact CG-CG2 3.96Å; M89-M131 HydrophobicContact CB-SD 4.28Å; M89-A134 HydrophobicContact CE-CB 4.06Å; M89-A134 HydrophobicContact SD-CB 3.13Å; M89-A134 WeakPolarHBondContact SD-CB 3.38Å
90	H	88.4	Confident	86.7	Confident	81 Å²	81	45.5 Å²	45.5	38%	0.375	25%	0.254	S	S	.	.	H	α-helix	trans	-63	-39.5	169.9	-77.1	-58.4	0	0	0	112.5	D86 S87 G94 M131	D86-H90 PolarHBondContact O-CD2 3.02Å; D86-H90 VanDerWaalsContact O-CD2 3.25Å; D86-H90 PolarHBondContact O-N 2.87Å; D86-H90 IonicContact OD1-CD2 3.79Å; D86-H90 IonicContact OD1-NE2 3.91Å; D86-H90 IonicContact OD2-CD2 3.2Å; S87-H90 PolarHBondContact O-N 3.3Å; H90-G94 PolarHBondContact O-N 3.14Å; H90-M131 VanDerWaalsContact CE1-CE 3.41Å; H90-M131 WeakPolarHBondContact CE1-CE 3.39Å
91	I	89.9	Confident	87.5	Confident	23 Å²	23	47.6 Å²	47.6	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-47.4	172.7	-70.4	-62.3	0	0	0	111.4	F58 L62 L65 S87 G88 M89 S93 G94 V95	F58-I91 HydrophobicContact CD2-CD1 4.46Å; F58-I91 HydrophobicContact CE2-CD1 4.21Å; F58-I91 HydrophobicContact CE2-CG2 4.4Å; L62-I91 HydrophobicContact CB-CD1 4.14Å; L65-I91 HydrophobicContact CB-CG1 4.33Å; L65-I91 HydrophobicContact CD2-CB 4.4Å; L65-I91 HydrophobicContact CD2-CG1 3.87Å; S87-I91 WeakPolarHBondContact O-CG1 3.36Å; S87-I91 PolarHBondContact O-N 3.03Å; G88-I91 WeakPolarHBondContact O-CB 3.46Å; G88-I91 PolarHBondContact O-N 3Å; M89-I91 VanDerWaalsContact C-N 3.34Å; I91-S93 VanDerWaalsContact C-N 3.26Å; I91-S93 PolarHBondContact O-N 2.98Å; I91-G94 CarbonylContact O-C 3.56Å; I91-G94 WeakPolarHBondContact O-CA 3.48Å; I91-G94 PolarHBondContact O-N 2.92Å; I91-V95 HydrophobicContact CG2-CG2 4.25Å; I91-V95 WeakPolarHBondContact O-CG2 3.4Å; I91-V95 PolarHBondContact O-N 3.08Å
92	A	92.2	Very high	88	Confident	38 Å²	38	51.2 Å²	51.2	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-55.9	-44.1	176.9	0	0	0	0	0	111.1	G88 M89 G94 V95 I96	G88-A92 PolarHBondContact O-N 3.3Å; M89-A92 PolarHBondContact O-N 2.97Å; A92-G94 PolarHBondContact O-N 2.91Å; A92-V95 PolarHBondContact O-N 2.94Å; A92-I96 WeakPolarHBondContact O-CD1 3.34Å; A92-I96 VanDerWaalsContact O-CG1 3.26Å; A92-I96 WeakPolarHBondContact O-CG1 3.25Å; A92-I96 PolarHBondContact O-N 3.02Å
93	S	91.5	Very high	88.3	Confident	10 Å²	10	51.6 Å²	51.6	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-44.4	174.3	-58.4	0	0	0	0	112.1	M89 I91 V95 I96 I97	M89-S93 WeakPolarHBondContact O-CB 3.43Å; M89-S93 PolarHBondContact O-N 3.32Å; M89-S93 PolarHBondContact O-OG 2.89Å; I91-S93 VanDerWaalsContact C-N 3.26Å; I91-S93 PolarHBondContact O-N 2.98Å; S93-V95 PolarHBondContact O-N 3.19Å; S93-I96 PolarHBondContact O-N 3.33Å; S93-I97 WeakPolarHBondContact O-CG1 3.22Å; S93-I97 PolarHBondContact O-N 3.42Å
94	G	91	Very high	88.6	Confident	20 Å²	20	52 Å²	52	21%	0.206	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-40.8	174.8	0	0	0	0	0	113.1	H90 I91 A92 I97 W98	H90-G94 PolarHBondContact O-N 3.14Å; I91-G94 CarbonylContact O-C 3.56Å; I91-G94 WeakPolarHBondContact O-CA 3.48Å; I91-G94 PolarHBondContact O-N 2.92Å; A92-G94 PolarHBondContact O-N 2.91Å; G94-I97 PolarHBondContact O-N 2.89Å; G94-W98 WeakPolarHBondContact O-CB 3.11Å; G94-W98 PolarHBondContact O-N 2.85Å
95	V	92.3	Very high	88.4	Confident	51 Å²	51	58.9 Å²	58.9	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-44	174.8	172.7	0	0	0	0	110.7	F58 I91 A92 S93 I97 W98 I99	F58-V95 HydrophobicContact CE2-CG2 3.86Å; F58-V95 HydrophobicContact CZ-CG2 4.16Å; I91-V95 HydrophobicContact CG2-CG2 4.25Å; I91-V95 WeakPolarHBondContact O-CG2 3.4Å; I91-V95 PolarHBondContact O-N 3.08Å; A92-V95 PolarHBondContact O-N 2.94Å; S93-V95 PolarHBondContact O-N 3.19Å; V95-I97 VanDerWaalsContact C-N 3.34Å; V95-I97 PolarHBondContact O-N 3.25Å; V95-W98 PolarHBondContact O-N 3.32Å; V95-I99 HydrophobicContact CG1-CD1 3.6Å; V95-I99 HydrophobicContact CG1-CG1 4.13Å; V95-I99 WeakPolarHBondContact O-CB 3.37Å; V95-I99 VanDerWaalsContact O-CG1 3.31Å; V95-I99 WeakPolarHBondContact O-CG1 3.37Å; V95-I99 PolarHBondContact O-N 3.03Å
96	I	93.5	Very high	88.3	Confident	34 Å²	34	63.9 Å²	63.9	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-60.4	-44	177.1	-70.7	161.6	0	0	0	111.1	A92 S93 S100 I126 I127 I130	A92-I96 WeakPolarHBondContact O-CD1 3.34Å; A92-I96 VanDerWaalsContact O-CG1 3.26Å; A92-I96 WeakPolarHBondContact O-CG1 3.25Å; A92-I96 PolarHBondContact O-N 3.02Å; S93-I96 PolarHBondContact O-N 3.33Å; I96-S100 VanDerWaalsContact O-CB 3.24Å; I96-S100 WeakPolarHBondContact O-CB 3.35Å; I96-S100 PolarHBondContact O-N 3.47Å; I96-S100 PolarHBondContact O-OG 2.9Å; I96-I126 HydrophobicContact CD1-CG2 3.91Å; I96-I127 HydrophobicContact CB-CG1 4.42Å; I96-I127 HydrophobicContact CD1-CG1 4.5Å; I96-I127 HydrophobicContact CG2-CD1 4.27Å; I96-I127 HydrophobicContact CG2-CG1 4.09Å; I96-I130 HydrophobicContact CD1-CD1 3.3Å
97	I	90.3	Very high	87.8	Confident	82 Å²	82	71.6 Å²	71.6	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-44.9	175.2	-68.3	168.3	0	0	0	110.2	S93 G94 V95 S100 S101 I127	S93-I97 WeakPolarHBondContact O-CG1 3.22Å; S93-I97 PolarHBondContact O-N 3.42Å; G94-I97 PolarHBondContact O-N 2.89Å; V95-I97 VanDerWaalsContact C-N 3.34Å; V95-I97 PolarHBondContact O-N 3.25Å; I97-S100 PolarHBondContact O-N 3.07Å; I97-S101 WeakPolarHBondContact O-CB 3.47Å; I97-S101 PolarHBondContact O-N 3.34Å; I97-S101 PolarHBondContact O-OG 3.22Å; I97-I127 HydrophobicContact CD1-CD1 3.91Å; I97-I127 HydrophobicContact CG1-CD1 3.59Å
98	W	90.1	Very high	87.5	Confident	155 Å²	155	74.2 Å²	74.2	59%	0.587	36%	0.356	S	S	*	.	H	α-helix	trans	-62.4	-49.3	178.8	179.3	75.1	0	0	0	112.1	G94 V95 S100 S101 R102	G94-W98 WeakPolarHBondContact O-CB 3.11Å; G94-W98 PolarHBondContact O-N 2.85Å; V95-W98 PolarHBondContact O-N 3.32Å; W98-S100 VanDerWaalsContact C-N 3.31Å; W98-S100 PolarHBondContact O-N 2.78Å; W98-S101 PolarHBondContact O-N 3.34Å; W98-S101 PolarHBondContact O-OG 3.09Å; W98-R102 PolarHBondContact O-N 3.31Å
99	I	91.5	Very high	87.1	Confident	99 Å²	99	78.8 Å²	78.8	51%	0.508	37%	0.374	S	S	.	.	H	α-helix	trans	-59.8	-41.3	177.2	-69.4	174.2	0	0	0	110.6	V95 P103	V95-I99 HydrophobicContact CG1-CD1 3.6Å; V95-I99 HydrophobicContact CG1-CG1 4.13Å; V95-I99 WeakPolarHBondContact O-CB 3.37Å; V95-I99 VanDerWaalsContact O-CG1 3.31Å; V95-I99 WeakPolarHBondContact O-CG1 3.37Å; V95-I99 PolarHBondContact O-N 3.03Å; I99-P103 WeakPolarHBondContact O-CD 3.44Å; I99-P103 WeakPolarHBondContact O-CG 3.45Å
100	S	89.4	Confident	86.8	Confident	19 Å²	19	88.9 Å²	88.9	13%	0.133	41%	0.411	C	S	.	.	H	α-helix	trans	-72	-36.4	178.9	-59.1	0	0	0	0	112.3	I96 I97 W98 R102 P103 I104 S123	I96-S100 VanDerWaalsContact O-CB 3.24Å; I96-S100 WeakPolarHBondContact O-CB 3.35Å; I96-S100 PolarHBondContact O-N 3.47Å; I96-S100 PolarHBondContact O-OG 2.9Å; I97-S100 PolarHBondContact O-N 3.07Å; W98-S100 VanDerWaalsContact C-N 3.31Å; W98-S100 PolarHBondContact O-N 2.78Å; S100-R102 PolarHBondContact O-N 3.16Å; S100-P103 VanDerWaalsContact O-CD 3.27Å; S100-P103 WeakPolarHBondContact O-CD 3.44Å; S100-P103 WeakPolarHBondContact O-CG 3.46Å; S100-I104 WeakPolarHBondContact O-CD1 3.41Å; S100-I104 WeakPolarHBondContact O-CG1 3.44Å; S100-I104 PolarHBondContact O-N 3.35Å; S100-S123 WeakPolarHBondContact OG-CB 3.46Å
101	S	87.4	Confident	86.7	Confident	52 Å²	52	87.9 Å²	87.9	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-69.9	-32.5	-178.5	73.6	0	0	0	0	113.8	I97 W98 I104 R105	I97-S101 WeakPolarHBondContact O-CB 3.47Å; I97-S101 PolarHBondContact O-N 3.34Å; I97-S101 PolarHBondContact O-OG 3.22Å; W98-S101 PolarHBondContact O-N 3.34Å; W98-S101 PolarHBondContact O-OG 3.09Å; S101-I104 PolarHBondContact O-N 2.76Å; S101-R105 PolarHBondContact O-N 2.99Å; S101-R105 VanDerWaalsContact O-N 3.11Å
102	R	87.2	Confident	86.5	Confident	157 Å²	157	92 Å²	92	59%	0.592	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-51.7	-178.2	-161.2	-174.8	-174	-170.6	3.4	113.2	W98 S100 R105 K106	W98-R102 PolarHBondContact O-N 3.31Å; S100-R102 PolarHBondContact O-N 3.16Å; R102-R105 PolarHBondContact O-N 2.84Å; R102-K106 PolarHBondContact O-N 2.81Å
103	P	83.6	Confident	85.9	Confident	28 Å²	28	94.7 Å²	94.7	18%	0.182	45%	0.445	C	S	.	.	H	α-helix	trans	-72.7	-27.7	176	30.1	-36.2	0	0	0	113.2	I99 S100 R105 K106 R116 L119	I99-P103 WeakPolarHBondContact O-CD 3.44Å; I99-P103 WeakPolarHBondContact O-CG 3.45Å; S100-P103 VanDerWaalsContact O-CD 3.27Å; S100-P103 WeakPolarHBondContact O-CD 3.44Å; S100-P103 WeakPolarHBondContact O-CG 3.46Å; P103-R105 VanDerWaalsContact C-N 3.26Å; P103-R105 PolarHBondContact O-N 3.07Å; P103-K106 VanDerWaalsContact O-O 3.06Å; P103-R116 VanDerWaalsContact CB-NH1 3.31Å; P103-L119 HydrophobicContact CB-CD1 4.16Å; P103-L119 HydrophobicContact CG-CD1 3.58Å
104	I	84.2	Confident	85.3	Confident	46 Å²	46	98.8 Å²	98.8	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-61.9	-38.2	172	-68.7	166.2	0	0	0	110.5	S100 S101 R116 L119 E120	S100-I104 WeakPolarHBondContact O-CD1 3.41Å; S100-I104 WeakPolarHBondContact O-CG1 3.44Å; S100-I104 PolarHBondContact O-N 3.35Å; S101-I104 PolarHBondContact O-N 2.76Å; I104-R116 VanDerWaalsContact CG1-O 3.31Å; I104-R116 WeakPolarHBondContact CG1-O 3.24Å; I104-L119 HydrophobicContact CD1-CB 4.06Å; I104-L119 HydrophobicContact CG1-CB 4.13Å; I104-E120 HydrophobicContact CD1-CB 4.09Å
105	R	80.1	Confident	84.9	Confident	179 Å²	179	99.3 Å²	99.3	68%	0.675	46%	0.464	S	S	*	.	H	α-helix	trans	-76.3	-36.9	-179.6	-169.2	175.1	67.7	-156.8	1.1	113.1	S101 R102 P103 R107	S101-R105 PolarHBondContact O-N 2.99Å; S101-R105 VanDerWaalsContact O-N 3.11Å; R102-R105 PolarHBondContact O-N 2.84Å; P103-R105 VanDerWaalsContact C-N 3.26Å; P103-R105 PolarHBondContact O-N 3.07Å; R105-R107 PolarHBondContact O-N 3.46Å
106	K	80.4	Confident	84.5	Confident	159 Å²	159	100.2 Å²	100.2	69%	0.691	46%	0.462	S	S	*	.	S	Bend	trans	-83.4	97.8	177.3	-170.1	-177.9	180	-173.4	0	109.5	R102 P103 D108	R102-K106 PolarHBondContact O-N 2.81Å; P103-K106 VanDerWaalsContact O-O 3.06Å; K106-D108 PolarHBondContact O-N 3.39Å; K106-D108 VanDerWaalsContact O-N 3.15Å
107	R	74.9	Confident	84.1	Confident	213 Å²	213	99.8 Å²	99.8	80%	0.804	46%	0.461	S	S	*	.			trans	-75.1	101.4	174	-68.6	-175.4	176.4	-179.2	-4.7	110	R105	R105-R107 PolarHBondContact O-N 3.46Å
108	D	81.2	Confident	83.9	Confident	61 Å²	61	102.6 Å²	102.6	33%	0.326	47%	0.466	S	S	.	.			trans	-97.6	95.6	166.5	-176.5	-9.5	0	0	0	108.8	K106 R110 A111 Y112	K106-D108 PolarHBondContact O-N 3.39Å; K106-D108 VanDerWaalsContact O-N 3.15Å; D108-R110 PolarHBondContact O-N 3.27Å; D108-R110 PolarHBondContact OD1-N 3.12Å; D108-R110 VanDerWaalsContact OD1-N 3.08Å; D108-A111 PolarHBondContact OD1-N 3.26Å; D108-Y112 CarbonylContact O-C 3.6Å; D108-Y112 WeakPolarHBondContact O-CA 3.45Å; D108-Y112 PolarHBondContact O-N 2.85Å; D108-Y112 VanDerWaalsContact O-O 3.12Å
109	L	80.9	Confident	83.9	Confident	121 Å²	121	97.5 Å²	97.5	63%	0.634	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-19	-177.9	-64.2	174.6	0	0	0	113	P113	L109-P113 WeakPolarHBondContact O-CA 3.26Å
110	R	83.3	Confident	83.8	Confident	239 Å²	239	97 Å²	97	90%	0.902	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-48.9	-178.8	-173.5	178.2	-68	173.6	-1.5	110.8	D108	D108-R110 PolarHBondContact O-N 3.27Å; D108-R110 PolarHBondContact OD1-N 3.12Å; D108-R110 VanDerWaalsContact OD1-N 3.08Å
111	A	86.2	Confident	84	Confident	59 Å²	59	96.2 Å²	96.2	49%	0.488	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-31.8	178.3	0	0	0	0	0	112.6	D108	D108-A111 PolarHBondContact OD1-N 3.26Å
112	Y	84.8	Confident	84.2	Confident	111 Å²	111	97.4 Å²	97.4	44%	0.435	44%	0.442	S	S	.	.			trans	-132.7	76.1	-176	-62	-94.7	0	0	0	110.1	D108 R114 G115 R116	D108-Y112 CarbonylContact O-C 3.6Å; D108-Y112 WeakPolarHBondContact O-CA 3.45Å; D108-Y112 PolarHBondContact O-N 2.85Å; D108-Y112 VanDerWaalsContact O-O 3.12Å; Y112-R114 PolarHBondContact O-N 3.2Å; Y112-R114 VanDerWaalsContact O-N 3.16Å; Y112-G115 PolarHBondContact O-N 3.28Å; Y112-R116 HydrophobicContact CD1-CG 3.91Å; Y112-R116 VanDerWaalsContact CD2-CZ 3.49Å; Y112-R116 HydrophobicContact CG-CG 3.95Å; Y112-R116 VanDerWaalsContact CG-NE 3.33Å
113	P	80.9	Confident	84.5	Confident	93 Å²	93	90.3 Å²	90.3	60%	0.604	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.3	-176.9	24.1	-34.6	0	0	0	113	L109 G115	L109-P113 WeakPolarHBondContact O-CA 3.26Å; P113-G115 VanDerWaalsContact C-N 3.33Å
114	R	78.4	Confident	85	Confident	97 Å²	97	91.8 Å²	91.8	37%	0.366	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	8.7	176.5	-62.5	-69.7	176.2	158.8	-6.8	113.5	Y112 F259 E298	Y112-R114 PolarHBondContact O-N 3.2Å; Y112-R114 VanDerWaalsContact O-N 3.16Å; R114-F259 HydrophobicContact CB-CZ 4.29Å; R114-E298 VanDerWaalsContact O-OE1 3.11Å
115	G	81.9	Confident	85.5	Confident	30 Å²	30	90 Å²	90	31%	0.309	41%	0.414	S	S	.	.			trans	68.2	-166.7	-174.6	0	0	0	0	0	113.4	Y112 P113	Y112-G115 PolarHBondContact O-N 3.28Å; P113-G115 VanDerWaalsContact C-N 3.33Å
116	R	84.5	Confident	86.2	Confident	70 Å²	70	85.2 Å²	85.2	26%	0.264	40%	0.401	S	S	.	.	S	Bend	trans	-133.1	21.1	-175.9	-62.7	-174.9	-170.8	-179.6	16.2	113.3	P103 I104 Y112 R118 L119	P103-R116 VanDerWaalsContact CB-NH1 3.31Å; I104-R116 VanDerWaalsContact CG1-O 3.31Å; I104-R116 WeakPolarHBondContact CG1-O 3.24Å; Y112-R116 HydrophobicContact CD1-CG 3.91Å; Y112-R116 VanDerWaalsContact CD2-CZ 3.49Å; Y112-R116 HydrophobicContact CG-CG 3.95Å; Y112-R116 VanDerWaalsContact CG-NE 3.33Å; R116-R118 PolarHBondContact O-N 3.15Å; R116-R118 VanDerWaalsContact O-N 3.14Å; R116-L119 HydrophobicContact CB-CD1 3.95Å; R116-L119 HydrophobicContact CB-CG 4.34Å; R116-L119 WeakPolarHBondContact O-CB 3.36Å; R116-L119 WeakPolarHBondContact O-CG 3.44Å; R116-L119 PolarHBondContact O-N 3.21Å
117	T	85.4	Confident	86.8	Confident	26 Å²	26	78 Å²	78	16%	0.16	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.1	178.2	51	0	0	0	0	112.8	L119 E120 E298	T117-L119 PolarHBondContact O-N 3.08Å; T117-E120 WeakPolarHBondContact O-CB 3.32Å; T117-E120 PolarHBondContact O-N 3.4Å; T117-E120 VanDerWaalsContact O-N 3.16Å; T117-E298 PolarHBondContact OG1-OE1 3.3Å; T117-E298 VanDerWaalsContact OG1-OE1 3.07Å; T117-E298 PolarHBondContact OG1-OE2 3.06Å
118	R	86.5	Confident	87.7	Confident	140 Å²	140	68.1 Å²	68.1	53%	0.528	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.4	173	-56.6	-176.2	-174.9	179.5	1.1	114.5	R116 E120 P121 F259	R116-R118 PolarHBondContact O-N 3.15Å; R116-R118 VanDerWaalsContact O-N 3.14Å; R118-E120 PolarHBondContact O-N 2.92Å; R118-P121 WeakPolarHBondContact O-CD 3.38Å; R118-P121 WeakPolarHBondContact O-CG 3.41Å; R118-F259 HydrophobicContact CG-CD1 4.47Å; R118-F259 HydrophobicContact CG-CE1 4.3Å; R118-F259 VanDerWaalsContact CZ-CZ 3.42Å
119	L	89.9	Confident	88.2	Confident	49 Å²	49	72.1 Å²	72.1	26%	0.257	35%	0.348	S	S	.	.	H	α-helix	trans	-67.7	-22.5	177.9	-66.8	177.4	0	0	0	112.5	P103 I104 R116 T117 L122 S123	P103-L119 HydrophobicContact CB-CD1 4.16Å; P103-L119 HydrophobicContact CG-CD1 3.58Å; I104-L119 HydrophobicContact CD1-CB 4.06Å; I104-L119 HydrophobicContact CG1-CB 4.13Å; R116-L119 HydrophobicContact CB-CD1 3.95Å; R116-L119 HydrophobicContact CB-CG 4.34Å; R116-L119 WeakPolarHBondContact O-CB 3.36Å; R116-L119 WeakPolarHBondContact O-CG 3.44Å; R116-L119 PolarHBondContact O-N 3.21Å; T117-L119 PolarHBondContact O-N 3.08Å; L119-L122 HydrophobicContact CD2-CD2 4.11Å; L119-S123 VanDerWaalsContact O-CB 3.26Å; L119-S123 WeakPolarHBondContact O-CB 3.38Å; L119-S123 PolarHBondContact O-N 3.39Å; L119-S123 PolarHBondContact O-OG 3.47Å
120	E	89.3	Confident	88.7	Confident	89 Å²	89	68.3 Å²	68.3	42%	0.416	33%	0.328	S	S	.	.	H	α-helix	trans	-66.9	-58.4	-178.8	-172.3	169.6	168.2	0	0	112.9	I104 T117 R118 L122 S123 L124 T261	I104-E120 HydrophobicContact CD1-CB 4.09Å; T117-E120 WeakPolarHBondContact O-CB 3.32Å; T117-E120 PolarHBondContact O-N 3.4Å; T117-E120 VanDerWaalsContact O-N 3.16Å; R118-E120 PolarHBondContact O-N 2.92Å; E120-L122 VanDerWaalsContact C-N 3.26Å; E120-L122 PolarHBondContact O-N 3.2Å; E120-S123 PolarHBondContact O-N 3.11Å; E120-S123 PolarHBondContact O-OG 2.93Å; E120-L124 PolarHBondContact O-N 3.15Å; E120-T261 HydrophobicContact CB-CG2 4.02Å; E120-T261 HydrophobicContact CG-CG2 3.89Å; E120-T261 VanDerWaalsContact OE2-CG2 3.28Å; E120-T261 WeakPolarHBondContact OE2-CG2 3.14Å
121	P	92.1	Very high	89	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.013	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-34.2	175.5	26.1	-35.5	0	0	0	112.1	R118 S123 L124 V125 Q220 I223 I224	R118-P121 WeakPolarHBondContact O-CD 3.38Å; R118-P121 WeakPolarHBondContact O-CG 3.41Å; P121-S123 VanDerWaalsContact C-N 3.34Å; P121-S123 PolarHBondContact O-N 3.46Å; P121-L124 PolarHBondContact O-N 3.49Å; P121-V125 WeakPolarHBondContact O-CG2 3.21Å; P121-V125 PolarHBondContact O-N 3.27Å; P121-Q220 VanDerWaalsContact CB-OE1 3.31Å; P121-I223 HydrophobicContact CB-CG2 4.36Å; P121-I224 HydrophobicContact CB-CD1 4.25Å; P121-I224 HydrophobicContact CB-CG1 3.89Å; P121-I224 HydrophobicContact CG-CG1 3.93Å
122	L	93	Very high	89.1	Confident	77 Å²	77	55.3 Å²	55.3	40%	0.403	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-44.2	175	-179.5	63.8	0	0	0	111.7	L119 E120 L124 V125 I126 I224	L119-L122 HydrophobicContact CD2-CD2 4.11Å; E120-L122 VanDerWaalsContact C-N 3.26Å; E120-L122 PolarHBondContact O-N 3.2Å; L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 2.84Å; L122-V125 WeakPolarHBondContact O-CB 3.27Å; L122-V125 PolarHBondContact O-N 3.08Å; L122-I126 HydrophobicContact CG-CD1 4.48Å; L122-I126 PolarHBondContact O-N 3.43Å; L122-I126 VanDerWaalsContact O-N 3.15Å; L122-I224 HydrophobicContact CB-CD1 4.32Å; L122-I224 HydrophobicContact CD1-CD1 4.48Å
123	S	93.1	Very high	89.2	Confident	8 Å²	8	52.6 Å²	52.6	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-38.8	177.1	74.5	0	0	0	0	111.9	S100 L119 E120 P121 I126 I127	S100-S123 WeakPolarHBondContact OG-CB 3.46Å; L119-S123 VanDerWaalsContact O-CB 3.26Å; L119-S123 WeakPolarHBondContact O-CB 3.38Å; L119-S123 PolarHBondContact O-N 3.39Å; L119-S123 PolarHBondContact O-OG 3.47Å; E120-S123 PolarHBondContact O-N 3.11Å; E120-S123 PolarHBondContact O-OG 2.93Å; P121-S123 VanDerWaalsContact C-N 3.34Å; P121-S123 PolarHBondContact O-N 3.46Å; S123-I126 PolarHBondContact O-N 3.16Å; S123-I127 WeakPolarHBondContact O-CG1 3.47Å; S123-I127 PolarHBondContact O-N 3.01Å
124	L	93	Very high	89.4	Confident	58 Å²	58	48.6 Å²	48.6	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-68.5	-33	177.1	-68.8	174.7	0	0	0	112.7	E120 P121 L122 S128 Q220	E120-L124 PolarHBondContact O-N 3.15Å; P121-L124 PolarHBondContact O-N 3.49Å; L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 2.84Å; L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.41Å; L124-S128 PolarHBondContact O-OG 2.86Å; L124-Q220 HydrophobicContact CB-CG 3.86Å; L124-Q220 HydrophobicContact CD1-CG 4.23Å
125	V	94.8	Very high	89.7	Confident	10 Å²	10	44.4 Å²	44.4	6%	0.061	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-49.9	171.6	173.8	0	0	0	0	110.1	P121 L122 I127 S128 F129 Q220 M221 I224	P121-V125 WeakPolarHBondContact O-CG2 3.21Å; P121-V125 PolarHBondContact O-N 3.27Å; L122-V125 WeakPolarHBondContact O-CB 3.27Å; L122-V125 PolarHBondContact O-N 3.08Å; V125-I127 VanDerWaalsContact C-N 3.33Å; V125-I127 PolarHBondContact O-N 3.46Å; V125-S128 PolarHBondContact O-N 3.47Å; V125-S128 VanDerWaalsContact O-N 3.13Å; V125-S128 PolarHBondContact O-OG 3.04Å; V125-F129 HydrophobicContact CG1-CD2 4.12Å; V125-F129 HydrophobicContact CG1-CE2 4.12Å; V125-F129 WeakPolarHBondContact O-CD2 3.28Å; V125-F129 PolarHBondContact O-N 3.14Å; V125-F129 VanDerWaalsContact O-N 3.12Å; V125-Q220 HydrophobicContact CG2-CB 3.62Å; V125-M221 HydrophobicContact CB-SD 4.39Å; V125-M221 HydrophobicContact CG1-CG 4.14Å; V125-M221 HydrophobicContact CG1-SD 3.78Å; V125-M221 HydrophobicContact CG2-CG 3.85Å; V125-M221 HydrophobicContact CG2-SD 3.78Å; V125-I224 HydrophobicContact CG2-CD1 3.96Å
126	I	94.8	Very high	89.8	Confident	78 Å²	78	45.6 Å²	45.6	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-44	179.8	-61.2	168.6	0	0	0	110.9	I96 L122 S123 S128 F129 I130	I96-I126 HydrophobicContact CD1-CG2 3.91Å; L122-I126 HydrophobicContact CG-CD1 4.48Å; L122-I126 PolarHBondContact O-N 3.43Å; L122-I126 VanDerWaalsContact O-N 3.15Å; S123-I126 PolarHBondContact O-N 3.16Å; I126-S128 VanDerWaalsContact C-N 3.31Å; I126-S128 PolarHBondContact O-N 3.35Å; I126-F129 PolarHBondContact O-N 3.17Å; I126-I130 HydrophobicContact CG2-CD1 4.01Å; I126-I130 WeakPolarHBondContact O-CG1 3.48Å; I126-I130 PolarHBondContact O-N 3.1Å; I126-I130 VanDerWaalsContact O-N 3.08Å
127	I	93.9	Very high	89.8	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.036	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-40.7	176.6	-67.5	168	0	0	0	111.1	I96 I97 S123 V125 F129 I130 M131 W213	I96-I127 HydrophobicContact CB-CG1 4.42Å; I96-I127 HydrophobicContact CD1-CG1 4.5Å; I96-I127 HydrophobicContact CG2-CD1 4.27Å; I96-I127 HydrophobicContact CG2-CG1 4.09Å; I97-I127 HydrophobicContact CD1-CD1 3.91Å; I97-I127 HydrophobicContact CG1-CD1 3.59Å; S123-I127 WeakPolarHBondContact O-CG1 3.47Å; S123-I127 PolarHBondContact O-N 3.01Å; V125-I127 VanDerWaalsContact C-N 3.33Å; V125-I127 PolarHBondContact O-N 3.46Å; I127-F129 VanDerWaalsContact C-N 3.3Å; I127-F129 PolarHBondContact O-N 3.15Å; I127-I130 PolarHBondContact O-N 3.1Å; I127-M131 HydrophobicContact CG2-CG 4.03Å; I127-M131 WeakPolarHBondContact O-CB 3.2Å; I127-M131 WeakPolarHBondContact O-CG 3.48Å; I127-M131 PolarHBondContact O-N 3.17Å; I127-W213 HydrophobicContact CG2-CH2 4.26Å; I127-W213 HydrophobicContact CG2-CZ3 4.03Å
128	S	93.5	Very high	89.4	Confident	5 Å²	5	47.1 Å²	47.1	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-36.1	178.5	70.9	0	0	0	0	113	L124 V125 I126 G132 W213 G217	L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.41Å; L124-S128 PolarHBondContact O-OG 2.86Å; V125-S128 PolarHBondContact O-N 3.47Å; V125-S128 VanDerWaalsContact O-N 3.13Å; V125-S128 PolarHBondContact O-OG 3.04Å; I126-S128 VanDerWaalsContact C-N 3.31Å; I126-S128 PolarHBondContact O-N 3.35Å; S128-G132 WeakPolarHBondContact O-CA 3.38Å; S128-G132 PolarHBondContact O-N 2.99Å; S128-W213 WeakPolarHBondContact CB-O 3.35Å; S128-G217 WeakPolarHBondContact OG-CA 3.43Å
129	F	92.2	Very high	89	Confident	146 Å²	146	41.4 Å²	41.4	64%	0.64	22%	0.221	S	C	*	.	H	α-helix	trans	-67.4	-44.7	173.2	-89.9	-85.8	0	0	0	111.9	V125 I126 I127 G132 S133	V125-F129 HydrophobicContact CG1-CD2 4.12Å; V125-F129 HydrophobicContact CG1-CE2 4.12Å; V125-F129 WeakPolarHBondContact O-CD2 3.28Å; V125-F129 PolarHBondContact O-N 3.14Å; V125-F129 VanDerWaalsContact O-N 3.12Å; I126-F129 PolarHBondContact O-N 3.17Å; I127-F129 VanDerWaalsContact C-N 3.3Å; I127-F129 PolarHBondContact O-N 3.15Å; F129-G132 PolarHBondContact O-N 3.27Å; F129-S133 WeakPolarHBondContact O-CB 3.43Å; F129-S133 PolarHBondContact O-N 3.43Å; F129-S133 PolarHBondContact O-OG 3.01Å
130	I	91.2	Very high	88.6	Confident	41 Å²	41	45.5 Å²	45.5	21%	0.21	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-52.7	179	-66.9	168.1	0	0	0	110.5	M89 I96 I126 I127 G132 S133 A134	M89-I130 HydrophobicContact CB-CG2 4.01Å; M89-I130 HydrophobicContact CG-CG2 3.96Å; I96-I130 HydrophobicContact CD1-CD1 3.3Å; I126-I130 HydrophobicContact CG2-CD1 4.01Å; I126-I130 WeakPolarHBondContact O-CG1 3.48Å; I126-I130 PolarHBondContact O-N 3.1Å; I126-I130 VanDerWaalsContact O-N 3.08Å; I127-I130 PolarHBondContact O-N 3.1Å; I130-G132 PolarHBondContact O-N 3.11Å; I130-S133 PolarHBondContact O-N 3.44Å; I130-S133 PolarHBondContact O-OG 3.11Å; I130-A134 PolarHBondContact O-N 2.93Å
131	M	89	Confident	88	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.064	23%	0.23	C	C	.	.	H	α-helix	trans	-70.1	-32.2	-178.7	-62.7	-58.7	-60.1	0	0	112.8	M89 H90 I127 A134 S135 W213	M89-M131 HydrophobicContact CB-SD 4.28Å; H90-M131 VanDerWaalsContact CE1-CE 3.41Å; H90-M131 WeakPolarHBondContact CE1-CE 3.39Å; I127-M131 HydrophobicContact CG2-CG 4.03Å; I127-M131 WeakPolarHBondContact O-CB 3.2Å; I127-M131 WeakPolarHBondContact O-CG 3.48Å; I127-M131 PolarHBondContact O-N 3.17Å; M131-A134 VanDerWaalsContact O-CB 3.3Å; M131-A134 WeakPolarHBondContact O-CB 3.41Å; M131-A134 PolarHBondContact O-N 2.9Å; M131-S135 PolarHBondContact O-N 3.26Å; M131-S135 VanDerWaalsContact O-N 3.08Å; M131-S135 PolarHBondContact O-OG 3.41Å; M131-W213 HydrophobicContact CB-CD2 3.64Å; M131-W213 VanDerWaalsContact CB-CE2 3.46Å; M131-W213 HydrophobicContact CB-CE3 4.25Å; M131-W213 HydrophobicContact CB-CG 3.85Å; M131-W213 HydrophobicContact CB-CH2 4.5Å; M131-W213 HydrophobicContact CB-CZ2 3.94Å; M131-W213 HydrophobicContact CE-CZ2 4.39Å; M131-W213 HydrophobicContact CG-CD2 4.34Å; M131-W213 HydrophobicContact CG-CH2 4.17Å; M131-W213 HydrophobicContact CG-CZ2 3.85Å
132	G	88.3	Confident	87.1	Confident	12 Å²	12	45 Å²	45	12%	0.124	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-47.5	170.7	0	0	0	0	0	111.4	S128 F129 I130 A134 S135 V136	S128-G132 WeakPolarHBondContact O-CA 3.38Å; S128-G132 PolarHBondContact O-N 2.99Å; F129-G132 PolarHBondContact O-N 3.27Å; I130-G132 PolarHBondContact O-N 3.11Å; G132-A134 VanDerWaalsContact C-N 3.28Å; G132-A134 PolarHBondContact O-N 2.82Å; G132-S135 PolarHBondContact O-N 3.49Å; G132-V136 WeakPolarHBondContact O-CG2 3.21Å; G132-V136 PolarHBondContact O-N 3.49Å; G132-V136 VanDerWaalsContact O-N 3.12Å
133	S	87.2	Confident	86.4	Confident	53 Å²	53	44.1 Å²	44.1	37%	0.371	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-34.1	176.3	78.8	0	0	0	0	112.9	F129 I130 Q137	F129-S133 WeakPolarHBondContact O-CB 3.43Å; F129-S133 PolarHBondContact O-N 3.43Å; F129-S133 PolarHBondContact O-OG 3.01Å; I130-S133 PolarHBondContact O-N 3.44Å; I130-S133 PolarHBondContact O-OG 3.11Å; S133-Q137 WeakPolarHBondContact O-CG 3.31Å; S133-Q137 PolarHBondContact O-N 3.25Å; S133-Q137 PolarHBondContact O-NE2 2.85Å
134	A	85.4	Confident	85.7	Confident	9 Å²	9	47.8 Å²	47.8	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-48.6	173.6	0	0	0	0	0	111.7	M89 I130 M131 G132 V136 Q137 V138	M89-A134 HydrophobicContact CE-CB 4.06Å; M89-A134 HydrophobicContact SD-CB 3.13Å; M89-A134 WeakPolarHBondContact SD-CB 3.38Å; I130-A134 PolarHBondContact O-N 2.93Å; M131-A134 VanDerWaalsContact O-CB 3.3Å; M131-A134 WeakPolarHBondContact O-CB 3.41Å; M131-A134 PolarHBondContact O-N 2.9Å; G132-A134 VanDerWaalsContact C-N 3.28Å; G132-A134 PolarHBondContact O-N 2.82Å; A134-V136 VanDerWaalsContact C-N 3.33Å; A134-V136 PolarHBondContact O-N 2.81Å; A134-Q137 WeakPolarHBondContact O-CB 3.38Å; A134-Q137 PolarHBondContact O-N 3.25Å; A134-Q137 VanDerWaalsContact O-N 3.17Å; A134-V138 PolarHBondContact O-N 2.8Å; A134-V138 VanDerWaalsContact O-N 3.16Å
135	S	84	Confident	84.6	Confident	10 Å²	10	47.6 Å²	47.6	7%	0.07	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-41.9	-175.3	-54	0	0	0	0	110.5	M131 G132 Q137 V138 D139	M131-S135 PolarHBondContact O-N 3.26Å; M131-S135 VanDerWaalsContact O-N 3.08Å; M131-S135 PolarHBondContact O-OG 3.41Å; G132-S135 PolarHBondContact O-N 3.49Å; S135-Q137 VanDerWaalsContact C-N 3.32Å; S135-Q137 PolarHBondContact O-N 3.09Å; S135-V138 WeakPolarHBondContact O-CB 3.28Å; S135-V138 PolarHBondContact O-N 2.9Å; S135-V138 VanDerWaalsContact O-N 3.11Å; S135-D139 PolarHBondContact O-N 3.17Å
136	V	85.4	Confident	83.4	Confident	55 Å²	55	51 Å²	51	33%	0.333	28%	0.277	S	S	.	.	H	α-helix	trans	-61.6	-37.9	175.2	172.5	0	0	0	0	112	G132 A134 V138 D139 F140	G132-V136 WeakPolarHBondContact O-CG2 3.21Å; G132-V136 PolarHBondContact O-N 3.49Å; G132-V136 VanDerWaalsContact O-N 3.12Å; A134-V136 VanDerWaalsContact C-N 3.33Å; A134-V136 PolarHBondContact O-N 2.81Å; V136-V138 VanDerWaalsContact C-N 3.32Å; V136-V138 PolarHBondContact O-N 2.92Å; V136-D139 WeakPolarHBondContact O-CB 3.45Å; V136-D139 PolarHBondContact O-N 3.4Å; V136-F140 HydrophobicContact CG1-CD2 3.69Å; V136-F140 HydrophobicContact CG1-CE2 3.4Å; V136-F140 VanDerWaalsContact CG1-CE2 3.4Å; V136-F140 WeakPolarHBondContact O-CD2 3.37Å; V136-F140 PolarHBondContact O-N 2.95Å
137	Q	83.6	Confident	82.5	Confident	75 Å²	75	52.4 Å²	52.4	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-65.7	-35.8	175.1	-71.4	172.6	54.1	0	0	112.5	S133 A134 S135 K141	S133-Q137 WeakPolarHBondContact O-CG 3.31Å; S133-Q137 PolarHBondContact O-N 3.25Å; S133-Q137 PolarHBondContact O-NE2 2.85Å; A134-Q137 WeakPolarHBondContact O-CB 3.38Å; A134-Q137 PolarHBondContact O-N 3.25Å; A134-Q137 VanDerWaalsContact O-N 3.17Å; S135-Q137 VanDerWaalsContact C-N 3.32Å; S135-Q137 PolarHBondContact O-N 3.09Å; Q137-K141 WeakPolarHBondContact O-CG 3.18Å; Q137-K141 PolarHBondContact O-N 3.41Å; Q137-K141 VanDerWaalsContact O-N 3.14Å
138	V	76.6	Confident	81.3	Confident	52 Å²	52	60.7 Å²	60.7	32%	0.315	32%	0.316	S	S	.	.	H	α-helix	trans	-67.3	-39	175.1	175.8	0	0	0	0	110.6	A134 S135 V136 K141 S142	A134-V138 PolarHBondContact O-N 2.8Å; A134-V138 VanDerWaalsContact O-N 3.16Å; S135-V138 WeakPolarHBondContact O-CB 3.28Å; S135-V138 PolarHBondContact O-N 2.9Å; S135-V138 VanDerWaalsContact O-N 3.11Å; V136-V138 VanDerWaalsContact C-N 3.32Å; V136-V138 PolarHBondContact O-N 2.92Å; V138-K141 PolarHBondContact O-N 3.21Å; V138-S142 WeakPolarHBondContact O-CB 3.49Å; V138-S142 PolarHBondContact O-N 3.13Å; V138-S142 PolarHBondContact O-OG 3.39Å
139	D	77.9	Confident	79.7	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-57.9	-54.7	173.4	-69.2	-46.7	0	0	0	111.2	S135 V136 K141 S142 V143 S206	S135-D139 PolarHBondContact O-N 3.17Å; V136-D139 WeakPolarHBondContact O-CB 3.45Å; V136-D139 PolarHBondContact O-N 3.4Å; D139-K141 VanDerWaalsContact C-N 3.3Å; D139-K141 PolarHBondContact O-N 3.16Å; D139-S142 PolarHBondContact O-N 3.29Å; D139-S142 VanDerWaalsContact O-N 3.15Å; D139-V143 WeakPolarHBondContact O-CG2 3.39Å; D139-V143 PolarHBondContact O-N 3.38Å; D139-S206 WeakPolarHBondContact OD1-CB 3.47Å; D139-S206 PolarHBondContact OD1-OG 2.9Å
140	F	82.9	Confident	77.7	Confident	135 Å²	135	66.1 Å²	66.1	59%	0.592	35%	0.351	S	S	*	.	H	α-helix	trans	-58.5	-39.7	-179.2	-80.6	-66	0	0	0	112.8	V136 N144	V136-F140 HydrophobicContact CG1-CD2 3.69Å; V136-F140 HydrophobicContact CG1-CE2 3.4Å; V136-F140 VanDerWaalsContact CG1-CE2 3.4Å; V136-F140 WeakPolarHBondContact O-CD2 3.37Å; V136-F140 PolarHBondContact O-N 2.95Å; F140-N144 WeakPolarHBondContact O-CB 3.39Å; F140-N144 VanDerWaalsContact O-CG 3.3Å; F140-N144 PolarHBondContact O-N 3.34Å; F140-N144 PolarHBondContact O-ND2 3.05Å
141	K	76.4	Confident	75.7	Confident	62 Å²	62	68.8 Å²	68.8	27%	0.27	37%	0.369	S	S	.	.	H	α-helix	trans	-68.7	-40.9	177.4	-72.6	177.9	-170.9	179	0	112.3	S82 Q137 V138 D139 N144 A145	S82-K141 WeakPolarHBondContact OG-CD 3.4Å; S82-K141 PolarHBondContact OG-NZ 3.23Å; Q137-K141 WeakPolarHBondContact O-CG 3.18Å; Q137-K141 PolarHBondContact O-N 3.41Å; Q137-K141 VanDerWaalsContact O-N 3.14Å; V138-K141 PolarHBondContact O-N 3.21Å; D139-K141 VanDerWaalsContact C-N 3.3Å; D139-K141 PolarHBondContact O-N 3.16Å; K141-N144 PolarHBondContact O-N 3.06Å; K141-A145 VanDerWaalsContact O-CB 3.31Å; K141-A145 WeakPolarHBondContact O-CB 3.49Å; K141-A145 PolarHBondContact O-N 2.66Å
142	S	73.6	Confident	73.4	Confident	20 Å²	20	77.8 Å²	77.8	14%	0.14	41%	0.408	C	S	.	.	H	α-helix	trans	-66.5	-39.8	179.6	-55.6	0	0	0	0	111.3	V138 D139 L146	V138-S142 WeakPolarHBondContact O-CB 3.49Å; V138-S142 PolarHBondContact O-N 3.13Å; V138-S142 PolarHBondContact O-OG 3.39Å; D139-S142 PolarHBondContact O-N 3.29Å; D139-S142 VanDerWaalsContact O-N 3.15Å; S142-L146 PolarHBondContact O-N 2.83Å; S142-L146 VanDerWaalsContact O-N 3.16Å
143	V	77.2	Confident	71.6	Confident	57 Å²	57	80.6 Å²	80.6	35%	0.345	42%	0.424	S	S	.	.	H	α-helix	trans	-67.2	-45.6	174.7	173.9	0	0	0	0	111.3	D139 A145 L146 I147 I203	D139-V143 WeakPolarHBondContact O-CG2 3.39Å; D139-V143 PolarHBondContact O-N 3.38Å; V143-A145 VanDerWaalsContact C-N 3.35Å; V143-A145 PolarHBondContact O-N 3.41Å; V143-L146 WeakPolarHBondContact O-CB 3.42Å; V143-L146 PolarHBondContact O-N 2.86Å; V143-L146 VanDerWaalsContact O-N 3.15Å; V143-I147 HydrophobicContact CG1-CD1 3.61Å; V143-I147 HydrophobicContact CG1-CG1 4.43Å; V143-I147 WeakPolarHBondContact O-CG1 3.47Å; V143-I147 PolarHBondContact O-N 3.21Å; V143-I203 HydrophobicContact CG2-CD1 4.04Å; V143-I203 HydrophobicContact CG2-CG1 4.48Å
144	N	78.2	Confident	69.8	Low	85 Å²	85	82.1 Å²	82.1	46%	0.455	45%	0.448	S	S	.	.	H	α-helix	trans	-63	-40.2	177.4	-78.7	-16.4	0	0	0	112.5	F140 K141 L146 I147 Y148	F140-N144 WeakPolarHBondContact O-CB 3.39Å; F140-N144 VanDerWaalsContact O-CG 3.3Å; F140-N144 PolarHBondContact O-N 3.34Å; F140-N144 PolarHBondContact O-ND2 3.05Å; K141-N144 PolarHBondContact O-N 3.06Å; N144-L146 VanDerWaalsContact C-N 3.25Å; N144-L146 PolarHBondContact O-N 3.45Å; N144-I147 PolarHBondContact O-N 3.34Å; N144-Y148 HydrophobicContact CB-CD2 4.43Å; N144-Y148 PolarHBondContact O-N 2.8Å
145	A	69.9	Low	68.2	Low	54 Å²	54	86 Å²	86	45%	0.446	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-35.8	175.2	0	0	0	0	0	111.9	K141 V143 D149	K141-A145 VanDerWaalsContact O-CB 3.31Å; K141-A145 WeakPolarHBondContact O-CB 3.49Å; K141-A145 PolarHBondContact O-N 2.66Å; V143-A145 VanDerWaalsContact C-N 3.35Å; V143-A145 PolarHBondContact O-N 3.41Å; A145-D149 PolarHBondContact O-N 3.19Å
146	L	69.5	Low	67.1	Low	83 Å²	83	87.1 Å²	87.1	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-72	-34.9	177.8	-172.6	66.4	0	0	0	113	S142 V143 N144 Y196 P199	S142-L146 PolarHBondContact O-N 2.83Å; S142-L146 VanDerWaalsContact O-N 3.16Å; V143-L146 WeakPolarHBondContact O-CB 3.42Å; V143-L146 PolarHBondContact O-N 2.86Å; V143-L146 VanDerWaalsContact O-N 3.15Å; N144-L146 VanDerWaalsContact C-N 3.25Å; N144-L146 PolarHBondContact O-N 3.45Å; L146-Y196 HydrophobicContact CD1-CD1 4.14Å; L146-Y196 HydrophobicContact CD1-CE1 4.35Å; L146-P199 HydrophobicContact CD1-CG 4.17Å
147	I	77	Confident	66.4	Low	107 Å²	107	91.6 Å²	91.6	55%	0.549	50%	0.5	S	S	.	.	H	α-helix	trans	-88.3	-41.8	-173.5	-64.5	171.5	0	0	0	112.3	V143 N144	V143-I147 HydrophobicContact CG1-CD1 3.61Å; V143-I147 HydrophobicContact CG1-CG1 4.43Å; V143-I147 WeakPolarHBondContact O-CG1 3.47Å; V143-I147 PolarHBondContact O-N 3.21Å; N144-I147 PolarHBondContact O-N 3.34Å
148	Y	69.3	Low	64.9	Low	180 Å²	180	90.5 Å²	90.5	71%	0.706	50%	0.499	S	S	*	.	H	α-helix	trans	-105.4	-29.3	-167.5	-68.9	-76.9	0	0	0	114.5	N144 N150	N144-Y148 HydrophobicContact CB-CD2 4.43Å; N144-Y148 PolarHBondContact O-N 2.8Å; Y148-N150 PolarHBondContact O-N 2.92Å
149	D	59.7	Low	64	Low	111 Å²	111	89.2 Å²	89.2	59%	0.594	49%	0.491	S	S	*	.			trans	-96.5	82.8	-166	-130.3	-3.6	0	0	0	111.8	A145 V151	A145-D149 PolarHBondContact O-N 3.19Å; D149-V151 WeakPolarHBondContact O-CG2 3.35Å; D149-V151 PolarHBondContact O-N 3.2Å
150	N	50.4	Low	63.3	Low	154 Å²	154	92.4 Å²	92.4	82%	0.824	51%	0.507	S	S	*	.			trans	-71.4	82.4	158.3	-76.7	-68.9	0	0	0	108	Y148 K152	Y148-N150 PolarHBondContact O-N 2.92Å; N150-K152 PolarHBondContact O-N 3.42Å
151	V	47.7	Very low	62.4	Low	97 Å²	97	89.7 Å²	89.7	59%	0.588	51%	0.505	S	S	*	.			trans	-45.8	103.7	-166.7	-163.3	0	0	0	0	113.1	D149 P153	D149-V151 WeakPolarHBondContact O-CG2 3.35Å; D149-V151 PolarHBondContact O-N 3.2Å; V151-P153 HydrophobicContact CG1-CB 3.85Å; V151-P153 HydrophobicContact CG1-CG 4Å; V151-P153 WeakPolarHBondContact O-CD 3.3Å
152	K	41.2	Very low	61.8	Low	202 Å²	202	90.5 Å²	90.5	88%	0.878	51%	0.511	S	S	*	.			trans	-104.4	92.6	154.8	-76.5	-174.4	-178.8	178.5	0	107.2	N150 G154	N150-K152 PolarHBondContact O-N 3.42Å; K152-G154 PolarHBondContact O-N 3.04Å
153	P	51.1	Low	61.2	Low	72 Å²	72	94.9 Å²	94.9	47%	0.468	53%	0.531	S	S	.	.			trans	-86.9	123	-168	33.8	-31.3	0	0	0	110.1	V151 I155	V151-P153 HydrophobicContact CG1-CB 3.85Å; V151-P153 HydrophobicContact CG1-CG 4Å; V151-P153 WeakPolarHBondContact O-CD 3.3Å; P153-I155 HydrophobicContact CB-CD1 4.09Å; P153-I155 HydrophobicContact CB-CG1 3.35Å; P153-I155 HydrophobicContact CG-CD1 3.49Å; P153-I155 VanDerWaalsContact CG-CD1 3.49Å; P153-I155 HydrophobicContact CG-CG1 3.36Å; P153-I155 PolarHBondContact O-N 3.39Å
154	G	48.5	Very low	60.7	Low	85 Å²	85	94.1 Å²	94.1	88%	0.876	53%	0.531	S	S	*	.			trans	-68.5	82.4	152.4	0	0	0	0	0	107.7	K152 G156	K152-G154 PolarHBondContact O-N 3.04Å; G154-G156 PolarHBondContact O-N 3.21Å
155	I	53	Low	60.2	Low	91 Å²	91	92.3 Å²	92.3	47%	0.467	53%	0.527	S	S	.	.			trans	-77.4	108	-173.2	-63.1	174.2	0	0	0	109.4	P153 I160	P153-I155 HydrophobicContact CB-CD1 4.09Å; P153-I155 HydrophobicContact CB-CG1 3.35Å; P153-I155 HydrophobicContact CG-CD1 3.49Å; P153-I155 VanDerWaalsContact CG-CD1 3.49Å; P153-I155 HydrophobicContact CG-CG1 3.36Å; P153-I155 PolarHBondContact O-N 3.39Å; I155-I160 HydrophobicContact CB-CG1 4.44Å; I155-I160 HydrophobicContact CG2-CB 4.36Å; I155-I160 HydrophobicContact CG2-CD1 3.35Å; I155-I160 HydrophobicContact CG2-CG1 2.96Å
156	G	59.9	Low	59.8	Low	33 Å²	33	92.7 Å²	92.7	34%	0.34	52%	0.524	S	S	.	.			trans	-77.1	150.2	160.1	0	0	0	0	0	110.9	G154 T158 T159 I160	G154-G156 PolarHBondContact O-N 3.21Å; G156-T158 PolarHBondContact O-N 2.87Å; G156-T159 PolarHBondContact N-OG1 3.15Å; G156-T159 PolarHBondContact O-N 2.83Å; G156-T159 PolarHBondContact O-OG1 2.82Å; G156-I160 PolarHBondContact O-N 3.31Å
157	I	70.2	Confident	59.7	Low	149 Å²	149	93.1 Å²	93.1	76%	0.764	53%	0.53	S	S	*	.	H	α-helix	trans	-52.3	-31.3	178.7	-63.3	161.1	0	0	0	112	I160 S161	I157-I160 WeakPolarHBondContact O-CB 3.37Å; I157-I160 PolarHBondContact O-N 3.34Å; I157-S161 PolarHBondContact O-N 3.43Å
158	T	52.5	Low	59.4	Low	52 Å²	52	93 Å²	93	32%	0.319	53%	0.529	S	S	.	.	H	α-helix	trans	-68.3	-39.1	177.4	52.4	0	0	0	0	113.5	S75 G156 S161 I162	S75-T158 PolarHBondContact OG-OG1 3.25Å; G156-T158 PolarHBondContact O-N 2.87Å; T158-S161 PolarHBondContact O-N 3.18Å; T158-I162 WeakPolarHBondContact O-CG1 3.41Å; T158-I162 PolarHBondContact O-N 3.49Å; T158-I162 VanDerWaalsContact O-N 3.12Å
159	T	57.1	Low	59.1	Low	25 Å²	25	88.4 Å²	88.4	15%	0.153	52%	0.521	C	S	.	.	H	α-helix	trans	-70.3	-36.5	176.3	59.9	0	0	0	0	110.6	S75 S77 G156 S161 I162 M163	S75-T159 WeakPolarHBondContact OG-CG2 3.23Å; S77-T159 WeakPolarHBondContact OG-CG2 3.44Å; G156-T159 PolarHBondContact N-OG1 3.15Å; G156-T159 PolarHBondContact O-N 2.83Å; G156-T159 PolarHBondContact O-OG1 2.82Å; T159-S161 VanDerWaalsContact C-N 3.33Å; T159-S161 PolarHBondContact O-N 2.93Å; T159-I162 PolarHBondContact O-N 2.91Å; T159-M163 WeakPolarHBondContact O-CB 2.81Å; T159-M163 VanDerWaalsContact O-CG 3.3Å; T159-M163 WeakPolarHBondContact O-CG 3.35Å; T159-M163 PolarHBondContact O-N 2.91Å
160	I	65.1	Low	59.2	Low	87 Å²	87	86.5 Å²	86.5	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-58.2	-47.1	170.7	-54.1	-179.9	0	0	0	110.1	I155 G156 I157 I162 M163 A164	I155-I160 HydrophobicContact CB-CG1 4.44Å; I155-I160 HydrophobicContact CG2-CB 4.36Å; I155-I160 HydrophobicContact CG2-CD1 3.35Å; I155-I160 HydrophobicContact CG2-CG1 2.96Å; G156-I160 PolarHBondContact O-N 3.31Å; I157-I160 WeakPolarHBondContact O-CB 3.37Å; I157-I160 PolarHBondContact O-N 3.34Å; I160-I162 VanDerWaalsContact C-N 3.31Å; I160-I162 PolarHBondContact O-N 3.38Å; I160-M163 CarbonylContact O-C 3.59Å; I160-M163 PolarHBondContact O-N 3.47Å; I160-A164 WeakPolarHBondContact O-CB 3.31Å; I160-A164 PolarHBondContact O-N 3.21Å
161	S	62.5	Low	60.1	Low	78 Å²	78	84.4 Å²	84.4	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-62.7	-38.6	-178.3	-173.3	0	0	0	0	112.2	I157 T158 T159 A165	I157-S161 PolarHBondContact O-N 3.43Å; T158-S161 PolarHBondContact O-N 3.18Å; T159-S161 VanDerWaalsContact C-N 3.33Å; T159-S161 PolarHBondContact O-N 2.93Å; S161-A165 VanDerWaalsContact O-CB 3.27Å; S161-A165 WeakPolarHBondContact O-CB 3.24Å; S161-A165 PolarHBondContact O-N 3.39Å
162	I	65.1	Low	61.1	Low	78 Å²	78	83.3 Å²	83.3	40%	0.4	48%	0.484	S	S	.	.	H	α-helix	trans	-69.4	-43.8	176.1	-65.7	167.4	0	0	0	110.3	V80 T158 T159 I160 A165 T166	V80-I162 HydrophobicContact CG2-CD1 3.79Å; T158-I162 WeakPolarHBondContact O-CG1 3.41Å; T158-I162 PolarHBondContact O-N 3.49Å; T158-I162 VanDerWaalsContact O-N 3.12Å; T159-I162 PolarHBondContact O-N 2.91Å; I160-I162 VanDerWaalsContact C-N 3.31Å; I160-I162 PolarHBondContact O-N 3.38Å; I162-A165 PolarHBondContact O-N 3.32Å; I162-T166 WeakPolarHBondContact O-CG2 3.21Å; I162-T166 PolarHBondContact O-N 3.47Å; I162-T166 PolarHBondContact O-OG1 3.49Å
163	M	61.1	Low	62.2	Low	112 Å²	112	78.7 Å²	78.7	55%	0.552	47%	0.468	S	S	*	.	H	α-helix	trans	-62.5	-41	174.9	-73.5	179.4	133.1	0	0	111.9	T159 I160 T166 V167	T159-M163 WeakPolarHBondContact O-CB 2.81Å; T159-M163 VanDerWaalsContact O-CG 3.3Å; T159-M163 WeakPolarHBondContact O-CG 3.35Å; T159-M163 PolarHBondContact O-N 2.91Å; I160-M163 CarbonylContact O-C 3.59Å; I160-M163 PolarHBondContact O-N 3.47Å; M163-T166 WeakPolarHBondContact CA-OG1 3.34Å; M163-T166 PolarHBondContact O-N 2.98Å; M163-T166 PolarHBondContact O-OG1 3.46Å; M163-V167 WeakPolarHBondContact O-CB 3.27Å; M163-V167 WeakPolarHBondContact O-CG2 3.42Å; M163-V167 PolarHBondContact O-N 2.86Å
164	A	65.7	Low	62.8	Low	41 Å²	41	80.7 Å²	80.7	34%	0.339	47%	0.467	S	S	.	.	H	α-helix	trans	-66.1	-41.7	175.6	0	0	0	0	0	110.7	I160 V167 I168	I160-A164 WeakPolarHBondContact O-CB 3.31Å; I160-A164 PolarHBondContact O-N 3.21Å; A164-V167 PolarHBondContact O-N 2.88Å; A164-I168 WeakPolarHBondContact O-CB 3.24Å; A164-I168 WeakPolarHBondContact O-CD1 3.37Å; A164-I168 WeakPolarHBondContact O-CG1 3.26Å; A164-I168 PolarHBondContact O-N 3.4Å
165	A	67.8	Low	63.7	Low	47 Å²	47	79.3 Å²	79.3	39%	0.388	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.1	0	0	0	0	0	112.4	S161 I162 I168 T169	S161-A165 VanDerWaalsContact O-CB 3.27Å; S161-A165 WeakPolarHBondContact O-CB 3.24Å; S161-A165 PolarHBondContact O-N 3.39Å; I162-A165 PolarHBondContact O-N 3.32Å; A165-I168 PolarHBondContact O-N 2.8Å; A165-T169 WeakPolarHBondContact O-CB 3.45Å; A165-T169 PolarHBondContact O-N 2.85Å; A165-T169 PolarHBondContact O-OG1 3.34Å
166	T	61.4	Low	64.4	Low	62 Å²	62	78.4 Å²	78.4	38%	0.38	44%	0.437	S	S	.	.	H	α-helix	trans	-68.2	-38.5	174.3	58.4	0	0	0	0	111.4	I162 M163 T169 K170	I162-T166 WeakPolarHBondContact O-CG2 3.21Å; I162-T166 PolarHBondContact O-N 3.47Å; I162-T166 PolarHBondContact O-OG1 3.49Å; M163-T166 WeakPolarHBondContact CA-OG1 3.34Å; M163-T166 PolarHBondContact O-N 2.98Å; M163-T166 PolarHBondContact O-OG1 3.46Å; T166-T169 PolarHBondContact O-N 2.85Å; T166-K170 WeakPolarHBondContact O-CB 3.39Å; T166-K170 WeakPolarHBondContact O-CG 3.41Å; T166-K170 PolarHBondContact O-N 2.83Å
167	V	67.8	Low	64.5	Low	92 Å²	92	80.9 Å²	80.9	56%	0.558	45%	0.449	S	S	*	.	H	α-helix	trans	-64.4	-44.5	173.2	170.6	0	0	0	0	111.6	M163 A164 K170 F171	M163-V167 WeakPolarHBondContact O-CB 3.27Å; M163-V167 WeakPolarHBondContact O-CG2 3.42Å; M163-V167 PolarHBondContact O-N 2.86Å; A164-V167 PolarHBondContact O-N 2.88Å; V167-K170 CarbonylContact O-C 3.59Å; V167-K170 PolarHBondContact O-N 3.27Å; V167-F171 WeakPolarHBondContact O-CB 3.29Å; V167-F171 PolarHBondContact O-N 3.31Å
168	I	71	Confident	64.1	Low	104 Å²	104	82.5 Å²	82.5	53%	0.533	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-44.8	176.3	-69.5	162.8	0	0	0	110.2	A164 A165 K170 F171 V172	A164-I168 WeakPolarHBondContact O-CB 3.24Å; A164-I168 WeakPolarHBondContact O-CD1 3.37Å; A164-I168 WeakPolarHBondContact O-CG1 3.26Å; A164-I168 PolarHBondContact O-N 3.4Å; A165-I168 PolarHBondContact O-N 2.8Å; I168-K170 VanDerWaalsContact C-N 3.31Å; I168-K170 PolarHBondContact O-N 3.12Å; I168-F171 WeakPolarHBondContact O-CB 3.37Å; I168-F171 PolarHBondContact O-N 3.25Å; I168-F171 VanDerWaalsContact O-N 3.14Å; I168-V172 HydrophobicContact CG2-CG2 4.44Å; I168-V172 WeakPolarHBondContact O-CG2 3.36Å; I168-V172 PolarHBondContact O-N 3.48Å
169	T	63.2	Low	64.9	Low	85 Å²	85	88.1 Å²	88.1	52%	0.521	47%	0.466	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.8	-55.8	0	0	0	0	110.8	A165 T166 V172 L173	A165-T169 WeakPolarHBondContact O-CB 3.45Å; A165-T169 PolarHBondContact O-N 2.85Å; A165-T169 PolarHBondContact O-OG1 3.34Å; T166-T169 PolarHBondContact O-N 2.85Å; T169-V172 PolarHBondContact O-N 3.41Å; T169-L173 HydrophobicContact CG2-CD1 4.37Å; T169-L173 WeakPolarHBondContact O-CG 3.48Å; T169-L173 PolarHBondContact O-N 3.43Å
170	K	61.9	Low	65	Low	71 Å²	71	96.1 Å²	96.1	31%	0.309	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-37.4	173.7	-73.9	172.5	-176.3	174.6	0	112.7	T166 V167 I168 L173 W174 D198	T166-K170 WeakPolarHBondContact O-CB 3.39Å; T166-K170 WeakPolarHBondContact O-CG 3.41Å; T166-K170 PolarHBondContact O-N 2.83Å; V167-K170 CarbonylContact O-C 3.59Å; V167-K170 PolarHBondContact O-N 3.27Å; I168-K170 VanDerWaalsContact C-N 3.31Å; I168-K170 PolarHBondContact O-N 3.12Å; K170-L173 PolarHBondContact O-N 3.47Å; K170-W174 WeakPolarHBondContact O-CB 3.24Å; K170-W174 PolarHBondContact O-N 3.41Å; K170-D198 WeakPolarHBondContact CE-OD1 3.47Å; K170-D198 IonicContact NZ-OD1 3.51Å; K170-D198 PolarHBondContact NZ-OD1 3.4Å; K170-D198 IonicContact NZ-OD2 3.81Å; K170-D198 PolarHBondContact NZ-OD2 3.46Å
171	F	67.4	Low	64.2	Low	109 Å²	109	101 Å²	101	48%	0.478	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-39.2	176.6	-177.5	-105.6	0	0	0	111.9	V167 I168 W174 L175	V167-F171 WeakPolarHBondContact O-CB 3.29Å; V167-F171 PolarHBondContact O-N 3.31Å; I168-F171 WeakPolarHBondContact O-CB 3.37Å; I168-F171 PolarHBondContact O-N 3.25Å; I168-F171 VanDerWaalsContact O-N 3.14Å; F171-W174 HydrophobicContact CD2-CE3 4.23Å; F171-W174 HydrophobicContact CE2-CE3 4.01Å; F171-W174 HydrophobicContact CE2-CZ3 4.07Å; F171-W174 WeakPolarHBondContact O-CB 3.49Å; F171-W174 PolarHBondContact O-N 3.13Å; F171-L175 HydrophobicContact CD1-CD1 3.8Å; F171-L175 HydrophobicContact CE1-CD1 3.35Å; F171-L175 HydrophobicContact CE1-CG 4.17Å; F171-L175 HydrophobicContact CZ-CD1 3.87Å; F171-L175 HydrophobicContact CZ-CG 4.27Å; F171-L175 WeakPolarHBondContact O-CB 3.48Å; F171-L175 PolarHBondContact O-N 3.38Å
172	V	69.5	Low	63.6	Low	75 Å²	75	105 Å²	105	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-65.8	-44.4	172.8	173.6	0	0	0	0	110.5	I168 T169 W174 L175 V176	I168-V172 HydrophobicContact CG2-CG2 4.44Å; I168-V172 WeakPolarHBondContact O-CG2 3.36Å; I168-V172 PolarHBondContact O-N 3.48Å; T169-V172 PolarHBondContact O-N 3.41Å; V172-W174 VanDerWaalsContact C-N 3.31Å; V172-W174 PolarHBondContact O-N 3.26Å; V172-L175 PolarHBondContact O-N 2.81Å; V172-V176 HydrophobicContact CG1-CG2 4.22Å; V172-V176 WeakPolarHBondContact O-CB 3.48Å; V172-V176 VanDerWaalsContact O-CG2 3.24Å; V172-V176 WeakPolarHBondContact O-CG2 3.41Å; V172-V176 PolarHBondContact O-N 3.25Å
173	L	64.3	Low	62.8	Low	104 Å²	104	104.7 Å²	104.7	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-59	-42.1	172.9	-78.4	162.1	0	0	0	111.7	T169 K170 V176 C177	T169-L173 HydrophobicContact CG2-CD1 4.37Å; T169-L173 WeakPolarHBondContact O-CG 3.48Å; T169-L173 PolarHBondContact O-N 3.43Å; K170-L173 PolarHBondContact O-N 3.47Å; L173-V176 PolarHBondContact O-N 3.43Å; L173-C177 WeakPolarHBondContact O-CB 3.17Å; L173-C177 PolarHBondContact O-N 2.8Å; L173-C177 PolarHBondContact O-SG 3.16Å
174	W	64.4	Low	62.7	Low	114 Å²	114	106.7 Å²	106.7	43%	0.432	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-45.3	174.8	178.3	85.2	0	0	0	112.1	K170 F171 V172 C177 R178	K170-W174 WeakPolarHBondContact O-CB 3.24Å; K170-W174 PolarHBondContact O-N 3.41Å; F171-W174 HydrophobicContact CD2-CE3 4.23Å; F171-W174 HydrophobicContact CE2-CE3 4.01Å; F171-W174 HydrophobicContact CE2-CZ3 4.07Å; F171-W174 WeakPolarHBondContact O-CB 3.49Å; F171-W174 PolarHBondContact O-N 3.13Å; V172-W174 VanDerWaalsContact C-N 3.31Å; V172-W174 PolarHBondContact O-N 3.26Å; W174-C177 PolarHBondContact O-N 3.17Å; W174-R178 VanDerWaalsContact O-CB 3.26Å; W174-R178 WeakPolarHBondContact O-CB 3.26Å; W174-R178 PolarHBondContact O-N 2.97Å
175	L	67.5	Low	62.1	Low	57 Å²	57	109.2 Å²	109.2	30%	0.298	56%	0.555	S	S	.	*	H	α-helix	trans	-62.3	-46.4	174.8	-84.8	168.5	0	0	0	111.5	F171 V172 C177 R178 F179	F171-L175 HydrophobicContact CD1-CD1 3.8Å; F171-L175 HydrophobicContact CE1-CD1 3.35Å; F171-L175 HydrophobicContact CE1-CG 4.17Å; F171-L175 HydrophobicContact CZ-CD1 3.87Å; F171-L175 HydrophobicContact CZ-CG 4.27Å; F171-L175 WeakPolarHBondContact O-CB 3.48Å; F171-L175 PolarHBondContact O-N 3.38Å; V172-L175 PolarHBondContact O-N 2.81Å; L175-C177 PolarHBondContact O-N 2.9Å; L175-R178 CarbonylContact O-C 3.52Å; L175-R178 WeakPolarHBondContact O-CA 3.27Å; L175-R178 WeakPolarHBondContact O-CB 3.37Å; L175-R178 PolarHBondContact O-N 3.49Å; L175-R178 VanDerWaalsContact O-N 3.12Å; L175-F179 HydrophobicContact CD2-CE2 4.32Å; L175-F179 WeakPolarHBondContact O-CB 3.49Å; L175-F179 VanDerWaalsContact O-CD2 3.23Å; L175-F179 WeakPolarHBondContact O-CD2 3.43Å; L175-F179 PolarHBondContact O-N 3.45Å
176	V	67.2	Low	61.4	Low	71 Å²	71	112 Å²	112	43%	0.43	57%	0.57	S	S	.	*	H	α-helix	trans	-62.7	-42.8	178.7	171.3	0	0	0	0	110.9	V172 L173 R178 F179 Y180	V172-V176 HydrophobicContact CG1-CG2 4.22Å; V172-V176 WeakPolarHBondContact O-CB 3.48Å; V172-V176 VanDerWaalsContact O-CG2 3.24Å; V172-V176 WeakPolarHBondContact O-CG2 3.41Å; V172-V176 PolarHBondContact O-N 3.25Å; L173-V176 PolarHBondContact O-N 3.43Å; V176-R178 VanDerWaalsContact C-N 3.32Å; V176-R178 PolarHBondContact O-N 2.94Å; V176-F179 PolarHBondContact O-N 2.91Å; V176-Y180 HydrophobicContact CG1-CD2 4.15Å; V176-Y180 WeakPolarHBondContact O-CB 3.26Å; V176-Y180 PolarHBondContact O-N 2.95Å
177	C	61.7	Low	61.1	Low	86 Å²	86	112.3 Å²	112.3	58%	0.581	58%	0.579	S	S	*	*	H	α-helix	trans	-65.2	-34.1	172.9	-72	0	0	0	0	112.3	L173 W174 L175	L173-C177 WeakPolarHBondContact O-CB 3.17Å; L173-C177 PolarHBondContact O-N 2.8Å; L173-C177 PolarHBondContact O-SG 3.16Å; W174-C177 PolarHBondContact O-N 3.17Å; L175-C177 PolarHBondContact O-N 2.9Å
178	R	62.7	Low	60.6	Low	182 Å²	182	117.3 Å²	117.3	69%	0.687	59%	0.589	S	S	*	*	H	α-helix	trans	-70.6	-32.5	174	-174.8	172.9	175.1	85.5	1.2	112.2	W174 L175 V176	W174-R178 VanDerWaalsContact O-CB 3.26Å; W174-R178 WeakPolarHBondContact O-CB 3.26Å; W174-R178 PolarHBondContact O-N 2.97Å; L175-R178 CarbonylContact O-C 3.52Å; L175-R178 WeakPolarHBondContact O-CA 3.27Å; L175-R178 WeakPolarHBondContact O-CB 3.37Å; L175-R178 PolarHBondContact O-N 3.49Å; L175-R178 VanDerWaalsContact O-N 3.12Å; V176-R178 VanDerWaalsContact C-N 3.32Å; V176-R178 PolarHBondContact O-N 2.94Å
179	F	67.7	Low	59.7	Low	170 Å²	170	117.8 Å²	117.8	75%	0.746	59%	0.592	S	S	*	*	H	α-helix	trans	-80.1	-35	177.3	-91.3	-73.7	0	0	0	112.8	L175 V176	L175-F179 HydrophobicContact CD2-CE2 4.32Å; L175-F179 WeakPolarHBondContact O-CB 3.49Å; L175-F179 VanDerWaalsContact O-CD2 3.23Å; L175-F179 WeakPolarHBondContact O-CD2 3.43Å; L175-F179 PolarHBondContact O-N 3.45Å; V176-F179 PolarHBondContact O-N 2.91Å
180	Y	60.2	Low	59.2	Low	194 Å²	194	114.6 Å²	114.6	76%	0.761	58%	0.577	S	S	*	*	S	Bend	trans	-101.2	84.1	178.4	-79.1	-87.2	0	0	0	111.5	V176	V176-Y180 HydrophobicContact CG1-CD2 4.15Å; V176-Y180 WeakPolarHBondContact O-CB 3.26Å; V176-Y180 PolarHBondContact O-N 2.95Å
181	K	47.1	Very low	58.9	Low	188 Å²	188	116.1 Å²	116.1	82%	0.817	60%	0.596	S	S	*	*			trans	78.8	137.1	160.1	-86.1	-179.5	168.6	-179.8	0	119.8
182	D	50.4	Low	58.2	Low	163 Å²	163	118.5 Å²	118.5	87%	0.872	61%	0.608	S	S	*	*			trans	-46.2	124.6	175.5	-52.7	-62.7	0	0	0	113.5
183	S	48.2	Very low	57.3	Low	71 Å²	71	120.9 Å²	120.9	50%	0.497	61%	0.613	S	S	.	*			trans	-173.5	115	135.3	-170.6	0	0	0	0	109.6	V185 C186	S183-V185 PolarHBondContact O-N 3.02Å; S183-V185 WeakPolarHBondContact OG-CG2 3.33Å; S183-C186 PolarHBondContact O-N 2.97Å; S183-C186 VanDerWaalsContact O-N 3.09Å
184	I	59	Low	56.8	Low	155 Å²	155	123.1 Å²	123.1	80%	0.795	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.7	-17.8	176.3	-67.8	151.1	0	0	0	113	C186 A187 Y188	I184-C186 VanDerWaalsContact C-N 3.33Å; I184-C186 PolarHBondContact O-N 3.03Å; I184-A187 PolarHBondContact O-N 3.48Å; I184-Y188 PolarHBondContact O-N 2.88Å
185	V	53.9	Low	56.5	Low	93 Å²	93	122.9 Å²	122.9	56%	0.564	63%	0.63	S	S	*	*	H	α-helix	trans	-62.9	-34.1	176.6	-176.1	0	0	0	0	112.7	S183 A187 L189	S183-V185 PolarHBondContact O-N 3.02Å; S183-V185 WeakPolarHBondContact OG-CG2 3.33Å; V185-A187 VanDerWaalsContact C-N 3.35Å; V185-A187 PolarHBondContact O-N 3Å; V185-L189 HydrophobicContact CG1-CD1 4.36Å
186	C	52.2	Low	56.2	Low	105 Å²	105	126.8 Å²	126.8	71%	0.709	64%	0.641	S	S	*	*	H	α-helix	trans	-73.5	-25.3	179.7	-63.5	0	0	0	0	113.2	S183 I184	S183-C186 PolarHBondContact O-N 2.97Å; S183-C186 VanDerWaalsContact O-N 3.09Å; I184-C186 VanDerWaalsContact C-N 3.33Å; I184-C186 PolarHBondContact O-N 3.03Å
187	A	55.9	Low	55.9	Low	69 Å²	69	127.5 Å²	127.5	57%	0.57	64%	0.642	S	S	*	*	H	α-helix	trans	-82.4	-37	-177.8	0	0	0	0	0	112.6	I184 V185 G190	I184-A187 PolarHBondContact O-N 3.48Å; V185-A187 VanDerWaalsContact C-N 3.35Å; V185-A187 PolarHBondContact O-N 3Å; A187-G190 PolarHBondContact O-N 3.31Å
188	Y	57.2	Low	56.2	Low	197 Å²	197	127.6 Å²	127.6	77%	0.773	64%	0.637	S	S	*	*	H	α-helix	trans	-76.5	-37.5	-175.1	-157.5	-96.3	0	0	0	113.1	I184 G190	I184-Y188 PolarHBondContact O-N 2.88Å; Y188-G190 PolarHBondContact O-N 2.82Å
189	L	52	Low	56.5	Low	114 Å²	114	120.4 Å²	120.4	60%	0.597	61%	0.614	S	S	*	*	H	α-helix	trans	-69.4	-19.6	171.4	-89.2	90.7	0	0	0	112.8	V185	V185-L189 HydrophobicContact CG1-CD1 4.36Å
190	G	52.6	Low	56.8	Low	19 Å²	19	116 Å²	116	20%	0.196	60%	0.598	C	S	.	*	H	α-helix	trans	-76.6	-26.7	-174.6	0	0	0	0	0	115.4	A187 Y188 W194	A187-G190 PolarHBondContact O-N 3.31Å; Y188-G190 PolarHBondContact O-N 2.82Å; G190-W194 WeakPolarHBondContact O-CB 3.48Å; G190-W194 VanDerWaalsContact O-CG 3.25Å
191	S	56.1	Low	57.3	Low	102 Å²	102	108.1 Å²	108.1	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-83.7	-29.8	-170.4	64.2	0	0	0	0	114.6
192	H	53.1	Low	58.4	Low	159 Å²	159	100.9 Å²	100.9	74%	0.736	55%	0.55	S	S	*	*	H	α-helix	trans	-107.6	-28.2	-172.9	-154.6	67.8	0	0	0	114.2
193	F	49.7	Very low	59.8	Low	125 Å²	125	94.7 Å²	94.7	55%	0.548	52%	0.517	S	S	.	.	S	Bend	trans	-104.6	7.6	-175	-77.2	-82.8	0	0	0	114.7	S195 Y196 L197	F193-S195 PolarHBondContact O-N 2.89Å; F193-Y196 PolarHBondContact O-N 3.23Å; F193-Y196 VanDerWaalsContact O-N 3.17Å; F193-L197 WeakPolarHBondContact O-CG 3.31Å; F193-L197 PolarHBondContact O-N 2.98Å; F193-L197 VanDerWaalsContact O-N 3.14Å
194	W	54	Low	61.4	Low	152 Å²	152	96.6 Å²	96.6	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-63.7	-33.5	-170.2	-126.6	32.8	0	0	0	115.1	G190 Y196 L197	G190-W194 WeakPolarHBondContact O-CB 3.48Å; G190-W194 VanDerWaalsContact O-CG 3.25Å; W194-Y196 VanDerWaalsContact C-N 3.28Å; W194-Y196 PolarHBondContact O-N 3.4Å; W194-L197 PolarHBondContact O-N 3.38Å
195	S	57.8	Low	62.4	Low	108 Å²	108	94.3 Å²	94.3	76%	0.755	51%	0.509	S	S	*	.	H	α-helix	trans	-68.8	-26.9	178.3	-56.4	0	0	0	0	113.1	F193	F193-S195 PolarHBondContact O-N 2.89Å
196	Y	62.3	Low	63.7	Low	140 Å²	140	90 Å²	90	55%	0.549	48%	0.483	S	S	.	.	H	α-helix	trans	-92.7	-23.3	179	-68.1	-77.9	0	0	0	113.2	L146 F193 W194 D198 P199 I200	L146-Y196 HydrophobicContact CD1-CD1 4.14Å; L146-Y196 HydrophobicContact CD1-CE1 4.35Å; F193-Y196 PolarHBondContact O-N 3.23Å; F193-Y196 VanDerWaalsContact O-N 3.17Å; W194-Y196 VanDerWaalsContact C-N 3.28Å; W194-Y196 PolarHBondContact O-N 3.4Å; Y196-D198 VanDerWaalsContact C-N 3.29Å; Y196-D198 PolarHBondContact O-N 3.24Å; Y196-P199 VanDerWaalsContact O-CD 3.25Å; Y196-P199 WeakPolarHBondContact O-CD 3.39Å; Y196-P199 WeakPolarHBondContact O-CG 3.38Å; Y196-I200 WeakPolarHBondContact O-CB 3.39Å; Y196-I200 WeakPolarHBondContact O-CD1 3.45Å; Y196-I200 WeakPolarHBondContact O-CG1 3.46Å; Y196-I200 PolarHBondContact O-N 3.32Å; Y196-I200 VanDerWaalsContact O-N 3.16Å
197	L	61.2	Low	65.3	Low	86 Å²	86	89.7 Å²	89.7	45%	0.45	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-31.8	-177.7	-82.5	168.1	0	0	0	113.3	F193 W194 G201	F193-L197 WeakPolarHBondContact O-CG 3.31Å; F193-L197 PolarHBondContact O-N 2.98Å; F193-L197 VanDerWaalsContact O-N 3.14Å; W194-L197 PolarHBondContact O-N 3.38Å; L197-G201 WeakPolarHBondContact O-CA 3.41Å; L197-G201 PolarHBondContact O-N 3.08Å
198	D	67.1	Low	66.8	Low	88 Å²	88	94.5 Å²	94.5	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-67.1	-54.2	179.3	-163.1	49.2	0	0	0	113.6	K170 Y196 G201 A202	K170-D198 WeakPolarHBondContact CE-OD1 3.47Å; K170-D198 IonicContact NZ-OD1 3.51Å; K170-D198 PolarHBondContact NZ-OD1 3.4Å; K170-D198 IonicContact NZ-OD2 3.81Å; K170-D198 PolarHBondContact NZ-OD2 3.46Å; Y196-D198 VanDerWaalsContact C-N 3.29Å; Y196-D198 PolarHBondContact O-N 3.24Å; D198-G201 PolarHBondContact O-N 3.41Å; D198-A202 WeakPolarHBondContact O-CB 3.26Å; D198-A202 PolarHBondContact O-N 2.87Å
199	P	69.4	Low	68.1	Low	31 Å²	31	88.6 Å²	88.6	20%	0.201	46%	0.46	C	S	.	.	H	α-helix	trans	-65.9	-37.9	176.3	24.6	-34	0	0	0	112.5	L146 Y196 A202 I203	L146-P199 HydrophobicContact CD1-CG 4.17Å; Y196-P199 VanDerWaalsContact O-CD 3.25Å; Y196-P199 WeakPolarHBondContact O-CD 3.39Å; Y196-P199 WeakPolarHBondContact O-CG 3.38Å; P199-A202 PolarHBondContact O-N 2.84Å; P199-I203 VanDerWaalsContact O-CG1 3.27Å; P199-I203 WeakPolarHBondContact O-CG1 3.45Å; P199-I203 PolarHBondContact O-N 3.41Å
200	I	73.5	Confident	69.9	Low	78 Å²	78	84.2 Å²	84.2	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.6	-66.8	169.7	0	0	0	110.4	Y196 A202 I203 L204	Y196-I200 WeakPolarHBondContact O-CB 3.39Å; Y196-I200 WeakPolarHBondContact O-CD1 3.45Å; Y196-I200 WeakPolarHBondContact O-CG1 3.46Å; Y196-I200 PolarHBondContact O-N 3.32Å; Y196-I200 VanDerWaalsContact O-N 3.16Å; I200-A202 VanDerWaalsContact C-N 3.33Å; I200-A202 PolarHBondContact O-N 3.44Å; I200-I203 PolarHBondContact O-N 2.91Å; I200-L204 HydrophobicContact CG2-CD1 4.1Å; I200-L204 HydrophobicContact CG2-CG 4.43Å; I200-L204 WeakPolarHBondContact O-CG 3.38Å; I200-L204 PolarHBondContact O-N 2.62Å
201	G	69.7	Low	71.6	Confident	27 Å²	27	84.7 Å²	84.7	28%	0.278	44%	0.444	S	S	.	.	H	α-helix	trans	-59.9	-42.9	176.3	0	0	0	0	0	112.1	L197 D198 L204 I205	L197-G201 WeakPolarHBondContact O-CA 3.41Å; L197-G201 PolarHBondContact O-N 3.08Å; D198-G201 PolarHBondContact O-N 3.41Å; G201-L204 PolarHBondContact O-N 3.12Å; G201-I205 WeakPolarHBondContact O-CB 3.44Å; G201-I205 WeakPolarHBondContact O-CD1 3.38Å; G201-I205 VanDerWaalsContact O-CG1 3.23Å; G201-I205 WeakPolarHBondContact O-CG1 3.22Å; G201-I205 PolarHBondContact O-N 3.13Å
202	A	72	Confident	73.2	Confident	37 Å²	37	82.2 Å²	82.2	31%	0.306	43%	0.426	S	S	.	.	H	α-helix	trans	-59	-49.7	175.1	0	0	0	0	0	111.8	D198 P199 I200 L204 I205 S206	D198-A202 WeakPolarHBondContact O-CB 3.26Å; D198-A202 PolarHBondContact O-N 2.87Å; P199-A202 PolarHBondContact O-N 2.84Å; I200-A202 VanDerWaalsContact C-N 3.33Å; I200-A202 PolarHBondContact O-N 3.44Å; A202-L204 PolarHBondContact O-N 3.14Å; A202-I205 PolarHBondContact O-N 2.71Å; A202-S206 PolarHBondContact O-N 3.45Å; A202-S206 PolarHBondContact O-OG 2.94Å
203	I	79.9	Confident	75	Confident	33 Å²	33	77.8 Å²	77.8	17%	0.169	40%	0.403	C	S	.	.	H	α-helix	trans	-59.4	-43.7	178.6	-67.7	164.3	0	0	0	111.5	V143 P199 I200 I205 S206 L207	V143-I203 HydrophobicContact CG2-CD1 4.04Å; V143-I203 HydrophobicContact CG2-CG1 4.48Å; P199-I203 VanDerWaalsContact O-CG1 3.27Å; P199-I203 WeakPolarHBondContact O-CG1 3.45Å; P199-I203 PolarHBondContact O-N 3.41Å; I200-I203 PolarHBondContact O-N 2.91Å; I203-I205 VanDerWaalsContact C-N 3.35Å; I203-I205 PolarHBondContact O-N 2.95Å; I203-S206 WeakPolarHBondContact CA-OG 3.43Å; I203-S206 PolarHBondContact O-N 3.3Å; I203-S206 PolarHBondContact O-OG 2.78Å; I203-S206 VanDerWaalsContact O-OG 3.05Å; I203-L207 HydrophobicContact CG2-CD1 3.91Å; I203-L207 HydrophobicContact CG2-CG 4.38Å; I203-L207 WeakPolarHBondContact O-CB 3.45Å; I203-L207 VanDerWaalsContact O-CG 3.3Å; I203-L207 WeakPolarHBondContact O-CG 3.41Å; I203-L207 PolarHBondContact O-N 3.4Å
204	L	80.4	Confident	77	Confident	110 Å²	110	77.2 Å²	77.2	58%	0.576	40%	0.404	S	S	*	.	H	α-helix	trans	-64.4	-40.5	178.5	-70.6	175.3	0	0	0	112	I200 G201 A202 Y208	I200-L204 HydrophobicContact CG2-CD1 4.1Å; I200-L204 HydrophobicContact CG2-CG 4.43Å; I200-L204 WeakPolarHBondContact O-CG 3.38Å; I200-L204 PolarHBondContact O-N 2.62Å; G201-L204 PolarHBondContact O-N 3.12Å; A202-L204 PolarHBondContact O-N 3.14Å; L204-Y208 WeakPolarHBondContact O-CB 3.44Å; L204-Y208 PolarHBondContact O-N 3.29Å
205	I	80.3	Confident	79	Confident	107 Å²	107	75.5 Å²	75.5	55%	0.549	41%	0.405	S	S	.	.	H	α-helix	trans	-67.3	-44.2	178.2	-69.2	165.3	0	0	0	110.7	G201 A202 I203 Y208 L209	G201-I205 WeakPolarHBondContact O-CB 3.44Å; G201-I205 WeakPolarHBondContact O-CD1 3.38Å; G201-I205 VanDerWaalsContact O-CG1 3.23Å; G201-I205 WeakPolarHBondContact O-CG1 3.22Å; G201-I205 PolarHBondContact O-N 3.13Å; A202-I205 PolarHBondContact O-N 2.71Å; I203-I205 VanDerWaalsContact C-N 3.35Å; I203-I205 PolarHBondContact O-N 2.95Å; I205-Y208 WeakPolarHBondContact O-CB 3.39Å; I205-Y208 PolarHBondContact O-N 2.84Å; I205-L209 HydrophobicContact CG2-CD1 3.6Å; I205-L209 WeakPolarHBondContact O-CB 3.35Å; I205-L209 WeakPolarHBondContact O-CD1 3.43Å; I205-L209 WeakPolarHBondContact O-CG 3.48Å; I205-L209 PolarHBondContact O-N 3.32Å
206	S	82.2	Confident	80.5	Confident	4 Å²	4	71.7 Å²	71.7	3%	0.028	38%	0.377	C	S	.	.	H	α-helix	trans	-68	-40	179.2	43.9	0	0	0	0	112.7	D139 A202 I203 Y208 L209 S210	D139-S206 WeakPolarHBondContact OD1-CB 3.47Å; D139-S206 PolarHBondContact OD1-OG 2.9Å; A202-S206 PolarHBondContact O-N 3.45Å; A202-S206 PolarHBondContact O-OG 2.94Å; I203-S206 WeakPolarHBondContact CA-OG 3.43Å; I203-S206 PolarHBondContact O-N 3.3Å; I203-S206 PolarHBondContact O-OG 2.78Å; I203-S206 VanDerWaalsContact O-OG 3.05Å; S206-Y208 VanDerWaalsContact C-N 3.32Å; S206-Y208 PolarHBondContact O-N 3.45Å; S206-L209 PolarHBondContact O-N 3.48Å; S206-S210 VanDerWaalsContact O-CB 3.28Å; S206-S210 WeakPolarHBondContact O-CB 3.33Å; S206-S210 PolarHBondContact O-N 3.06Å
207	L	85.7	Confident	82.1	Confident	97 Å²	97	65.2 Å²	65.2	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-59.2	-43.2	170.9	-76.4	172.4	0	0	0	111.8	I203 G211	I203-L207 HydrophobicContact CG2-CD1 3.91Å; I203-L207 HydrophobicContact CG2-CG 4.38Å; I203-L207 WeakPolarHBondContact O-CB 3.45Å; I203-L207 VanDerWaalsContact O-CG 3.3Å; I203-L207 WeakPolarHBondContact O-CG 3.41Å; I203-L207 PolarHBondContact O-N 3.4Å; L207-G211 PolarHBondContact O-N 3.03Å
208	Y	85.8	Confident	83.7	Confident	170 Å²	170	64.8 Å²	64.8	67%	0.667	35%	0.35	S	S	*	.	H	α-helix	trans	-62.9	-46.5	176.1	171.8	-98.4	0	0	0	112.3	L204 I205 S206 G211 S212	L204-Y208 WeakPolarHBondContact O-CB 3.44Å; L204-Y208 PolarHBondContact O-N 3.29Å; I205-Y208 WeakPolarHBondContact O-CB 3.39Å; I205-Y208 PolarHBondContact O-N 2.84Å; S206-Y208 VanDerWaalsContact C-N 3.32Å; S206-Y208 PolarHBondContact O-N 3.45Å; Y208-G211 PolarHBondContact O-N 2.92Å; Y208-S212 VanDerWaalsContact O-CB 3.26Å; Y208-S212 WeakPolarHBondContact O-CB 3.41Å; Y208-S212 PolarHBondContact O-N 2.95Å
209	L	86	Confident	84.9	Confident	73 Å²	73	67.1 Å²	67.1	38%	0.382	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-49.1	176.7	-79.8	152.1	0	0	0	111	I205 S206 G211 S212 W213	I205-L209 HydrophobicContact CG2-CD1 3.6Å; I205-L209 WeakPolarHBondContact O-CB 3.35Å; I205-L209 WeakPolarHBondContact O-CD1 3.43Å; I205-L209 WeakPolarHBondContact O-CG 3.48Å; I205-L209 PolarHBondContact O-N 3.32Å; S206-L209 PolarHBondContact O-N 3.48Å; L209-G211 PolarHBondContact O-N 3.21Å; L209-S212 WeakPolarHBondContact O-CB 3.49Å; L209-S212 PolarHBondContact O-N 2.94Å; L209-W213 PolarHBondContact O-N 3.35Å
210	S	88.1	Confident	86.1	Confident	22 Å²	22	66.7 Å²	66.7	15%	0.154	35%	0.348	C	S	.	.	H	α-helix	trans	-56.5	-49.3	178	-174.3	0	0	0	0	111.4	S206 S212 W213 M214	S206-S210 VanDerWaalsContact O-CB 3.28Å; S206-S210 WeakPolarHBondContact O-CB 3.33Å; S206-S210 PolarHBondContact O-N 3.06Å; S210-S212 PolarHBondContact O-N 3.33Å; S210-W213 PolarHBondContact O-N 3.28Å; S210-M214 WeakPolarHBondContact O-CB 3.44Å; S210-M214 PolarHBondContact O-N 3.03Å
211	G	89.6	Confident	87.1	Confident	30 Å²	30	67.2 Å²	67.2	31%	0.309	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-41.8	176.2	0	0	0	0	0	113.2	L207 Y208 L209 M214 I215	L207-G211 PolarHBondContact O-N 3.03Å; Y208-G211 PolarHBondContact O-N 2.92Å; L209-G211 PolarHBondContact O-N 3.21Å; G211-M214 PolarHBondContact O-N 3.43Å; G211-I215 WeakPolarHBondContact O-CB 3.49Å; G211-I215 VanDerWaalsContact O-CG1 3.27Å; G211-I215 WeakPolarHBondContact O-CG1 3.36Å; G211-I215 PolarHBondContact O-N 3.39Å
212	S	89	Confident	88.2	Confident	49 Å²	49	72.8 Å²	72.8	34%	0.343	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-43.5	177.5	-176.1	0	0	0	0	112.3	Y208 L209 S210 T216	Y208-S212 VanDerWaalsContact O-CB 3.26Å; Y208-S212 WeakPolarHBondContact O-CB 3.41Å; Y208-S212 PolarHBondContact O-N 2.95Å; L209-S212 WeakPolarHBondContact O-CB 3.49Å; L209-S212 PolarHBondContact O-N 2.94Å; S210-S212 PolarHBondContact O-N 3.33Å; S212-T216 VanDerWaalsContact O-CB 3.29Å; S212-T216 WeakPolarHBondContact O-CB 3.37Å; S212-T216 PolarHBondContact O-N 2.94Å; S212-T216 PolarHBondContact O-OG1 3.47Å
213	W	91.1	Very high	89.2	Confident	66 Å²	66	72.4 Å²	72.4	25%	0.25	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-43.2	175	-74	117.1	0	0	0	111.5	I127 S128 M131 L209 S210 I215 T216 G217	I127-W213 HydrophobicContact CG2-CH2 4.26Å; I127-W213 HydrophobicContact CG2-CZ3 4.03Å; S128-W213 WeakPolarHBondContact CB-O 3.35Å; M131-W213 HydrophobicContact CB-CD2 3.64Å; M131-W213 VanDerWaalsContact CB-CE2 3.46Å; M131-W213 HydrophobicContact CB-CE3 4.25Å; M131-W213 HydrophobicContact CB-CG 3.85Å; M131-W213 HydrophobicContact CB-CH2 4.5Å; M131-W213 HydrophobicContact CB-CZ2 3.94Å; M131-W213 HydrophobicContact CE-CZ2 4.39Å; M131-W213 HydrophobicContact CG-CD2 4.34Å; M131-W213 HydrophobicContact CG-CH2 4.17Å; M131-W213 HydrophobicContact CG-CZ2 3.85Å; L209-W213 PolarHBondContact O-N 3.35Å; S210-W213 PolarHBondContact O-N 3.28Å; W213-I215 PolarHBondContact O-N 3.29Å; W213-T216 WeakPolarHBondContact O-CB 3.34Å; W213-T216 PolarHBondContact O-N 3.19Å; W213-G217 PolarHBondContact O-N 3.07Å
214	M	92.9	Very high	89.7	Confident	113 Å²	113	74.5 Å²	74.5	56%	0.557	37%	0.365	S	S	*	.	H	α-helix	trans	-59.7	-48.4	176.8	-172.4	63.9	80.5	0	0	111.9	S210 G211 T216 G217 I218	S210-M214 WeakPolarHBondContact O-CB 3.44Å; S210-M214 PolarHBondContact O-N 3.03Å; G211-M214 PolarHBondContact O-N 3.43Å; M214-T216 VanDerWaalsContact C-N 3.29Å; M214-T216 PolarHBondContact O-N 3.4Å; M214-G217 PolarHBondContact O-N 3.2Å; M214-I218 HydrophobicContact CG-CD1 4.14Å; M214-I218 WeakPolarHBondContact O-CG1 3.49Å; M214-I218 PolarHBondContact O-N 2.88Å
215	I	94.1	Very high	90.2	Very high	116 Å²	116	73.9 Å²	73.9	60%	0.595	37%	0.371	S	S	*	.	H	α-helix	trans	-61.3	-40.6	176.3	-68.3	165.8	0	0	0	110.6	G211 W213 I218 R219	G211-I215 WeakPolarHBondContact O-CB 3.49Å; G211-I215 VanDerWaalsContact O-CG1 3.27Å; G211-I215 WeakPolarHBondContact O-CG1 3.36Å; G211-I215 PolarHBondContact O-N 3.39Å; W213-I215 PolarHBondContact O-N 3.29Å; I215-I218 PolarHBondContact O-N 2.84Å; I215-R219 VanDerWaalsContact O-CB 3.3Å; I215-R219 WeakPolarHBondContact O-CB 3.28Å; I215-R219 PolarHBondContact O-N 3.38Å
216	T	91.1	Very high	90.8	Very high	28 Å²	28	70 Å²	70	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-63.4	-44.4	177.4	-64.8	0	0	0	0	111.5	S212 W213 M214 R219 Q220	S212-T216 VanDerWaalsContact O-CB 3.29Å; S212-T216 WeakPolarHBondContact O-CB 3.37Å; S212-T216 PolarHBondContact O-N 2.94Å; S212-T216 PolarHBondContact O-OG1 3.47Å; W213-T216 WeakPolarHBondContact O-CB 3.34Å; W213-T216 PolarHBondContact O-N 3.19Å; M214-T216 VanDerWaalsContact C-N 3.29Å; M214-T216 PolarHBondContact O-N 3.4Å; T216-R219 PolarHBondContact O-N 2.95Å; T216-Q220 WeakPolarHBondContact O-CG 3.36Å; T216-Q220 PolarHBondContact O-N 3.25Å
217	G	94.5	Very high	91.3	Very high	5 Å²	5	75.5 Å²	75.5	5%	0.052	38%	0.38	C	S	.	.	H	α-helix	trans	-58.7	-51.4	175.2	0	0	0	0	0	111.9	S128 W213 M214 R219 Q220 M221	S128-G217 WeakPolarHBondContact OG-CA 3.43Å; W213-G217 PolarHBondContact O-N 3.07Å; M214-G217 PolarHBondContact O-N 3.2Å; G217-R219 VanDerWaalsContact C-N 3.3Å; G217-R219 PolarHBondContact O-N 3.41Å; G217-Q220 PolarHBondContact O-N 3.43Å; G217-Q220 VanDerWaalsContact O-N 3.17Å; G217-M221 WeakPolarHBondContact O-CG 3.23Å; G217-M221 PolarHBondContact O-N 3.32Å
218	I	94.6	Very high	91.7	Very high	76 Å²	76	73.3 Å²	73.3	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-60.6	-39.4	177.9	-65.3	167.5	0	0	0	111.3	M214 I215 M221 R222	M214-I218 HydrophobicContact CG-CD1 4.14Å; M214-I218 WeakPolarHBondContact O-CG1 3.49Å; M214-I218 PolarHBondContact O-N 2.88Å; I215-I218 PolarHBondContact O-N 2.84Å; I218-M221 PolarHBondContact O-N 3.27Å; I218-R222 WeakPolarHBondContact O-CG 3.46Å; I218-R222 PolarHBondContact O-N 3.07Å
219	R	93.7	Very high	92	Very high	137 Å²	137	65.6 Å²	65.6	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.9	-177.8	177.7	63.3	166.9	-2.9	111.9	I215 T216 G217 R222 I223	I215-R219 VanDerWaalsContact O-CB 3.3Å; I215-R219 WeakPolarHBondContact O-CB 3.28Å; I215-R219 PolarHBondContact O-N 3.38Å; T216-R219 PolarHBondContact O-N 2.95Å; G217-R219 VanDerWaalsContact C-N 3.3Å; G217-R219 PolarHBondContact O-N 3.41Å; R219-R222 PolarHBondContact O-N 2.82Å; R219-I223 WeakPolarHBondContact O-CG1 3.38Å; R219-I223 PolarHBondContact O-N 3.22Å
220	Q	93.9	Very high	92.3	Very high	22 Å²	22	66.6 Å²	66.6	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-70.9	-36.6	178.5	-66	-62	-16.8	0	0	111.8	P121 L124 V125 T216 G217 R222 I223 I224	P121-Q220 VanDerWaalsContact CB-OE1 3.31Å; L124-Q220 HydrophobicContact CB-CG 3.86Å; L124-Q220 HydrophobicContact CD1-CG 4.23Å; V125-Q220 HydrophobicContact CG2-CB 3.62Å; T216-Q220 WeakPolarHBondContact O-CG 3.36Å; T216-Q220 PolarHBondContact O-N 3.25Å; G217-Q220 PolarHBondContact O-N 3.43Å; G217-Q220 VanDerWaalsContact O-N 3.17Å; Q220-R222 VanDerWaalsContact C-N 3.34Å; Q220-R222 PolarHBondContact O-N 3.21Å; Q220-I223 WeakPolarHBondContact O-CB 3.36Å; Q220-I223 PolarHBondContact O-N 3.38Å; Q220-I223 VanDerWaalsContact O-N 3.11Å; Q220-I224 WeakPolarHBondContact O-CG1 3.46Å; Q220-I224 PolarHBondContact O-N 3.08Å
221	M	94.1	Very high	92.5	Very high	89 Å²	89	69.8 Å²	69.8	44%	0.438	37%	0.374	S	S	.	.	H	α-helix	trans	-57.3	-46.1	170.9	-74.6	-61.6	-68.6	0	0	111.7	V125 G217 I218 I223 I224 S225	V125-M221 HydrophobicContact CB-SD 4.39Å; V125-M221 HydrophobicContact CG1-CG 4.14Å; V125-M221 HydrophobicContact CG1-SD 3.78Å; V125-M221 HydrophobicContact CG2-CG 3.85Å; V125-M221 HydrophobicContact CG2-SD 3.78Å; G217-M221 WeakPolarHBondContact O-CG 3.23Å; G217-M221 PolarHBondContact O-N 3.32Å; I218-M221 PolarHBondContact O-N 3.27Å; M221-I223 VanDerWaalsContact C-N 3.26Å; M221-I223 PolarHBondContact O-N 3.35Å; M221-I224 WeakPolarHBondContact O-CB 3.37Å; M221-I224 PolarHBondContact O-N 2.7Å; M221-I224 VanDerWaalsContact O-N 3.1Å; M221-I224 HydrophobicContact SD-CD1 4.36Å; M221-S225 PolarHBondContact O-N 3.17Å; M221-S225 PolarHBondContact O-OG 3.42Å; M221-S225 VanDerWaalsContact O-OG 3.11Å
222	R	93.3	Very high	92.6	Very high	145 Å²	145	73.5 Å²	73.5	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-58.1	-36.8	175.1	-72.3	170.8	174.6	149.4	-2.7	112.8	I218 R219 Q220 S225 K227	I218-R222 WeakPolarHBondContact O-CG 3.46Å; I218-R222 PolarHBondContact O-N 3.07Å; R219-R222 PolarHBondContact O-N 2.82Å; Q220-R222 VanDerWaalsContact C-N 3.34Å; Q220-R222 PolarHBondContact O-N 3.21Å; R222-S225 PolarHBondContact O-N 2.9Å; R222-K227 HydrophobicContact CB-CD 4.36Å; R222-K227 WeakPolarHBondContact O-CB 3.48Å; R222-K227 PolarHBondContact O-N 3.28Å; R222-K227 VanDerWaalsContact O-N 3.12Å
223	I	92.5	Very high	92.7	Very high	29 Å²	29	72.3 Å²	72.3	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-42.3	176.8	-69.7	168.7	0	0	0	110.6	P121 R219 Q220 M221 S225 G226 H258 G260	P121-I223 HydrophobicContact CB-CG2 4.36Å; R219-I223 WeakPolarHBondContact O-CG1 3.38Å; R219-I223 PolarHBondContact O-N 3.22Å; Q220-I223 WeakPolarHBondContact O-CB 3.36Å; Q220-I223 PolarHBondContact O-N 3.38Å; Q220-I223 VanDerWaalsContact O-N 3.11Å; M221-I223 VanDerWaalsContact C-N 3.26Å; M221-I223 PolarHBondContact O-N 3.35Å; I223-S225 VanDerWaalsContact C-N 3.29Å; I223-S225 PolarHBondContact O-N 3.01Å; I223-G226 PolarHBondContact O-N 2.86Å; I223-G226 VanDerWaalsContact O-N 3.15Å; I223-H258 HydrophobicContact CG2-CB 3.9Å; I223-G260 WeakPolarHBondContact CG2-O 3.44Å
224	I	91.4	Very high	92.7	Very high	76 Å²	76	71.8 Å²	71.8	39%	0.39	38%	0.376	S	S	.	.	H	α-helix	trans	-63.5	-37.7	176.4	-64.1	166.4	0	0	0	110.9	P121 L122 V125 Q220 M221 G226	P121-I224 HydrophobicContact CB-CD1 4.25Å; P121-I224 HydrophobicContact CB-CG1 3.89Å; P121-I224 HydrophobicContact CG-CG1 3.93Å; L122-I224 HydrophobicContact CB-CD1 4.32Å; L122-I224 HydrophobicContact CD1-CD1 4.48Å; V125-I224 HydrophobicContact CG2-CD1 3.96Å; Q220-I224 WeakPolarHBondContact O-CG1 3.46Å; Q220-I224 PolarHBondContact O-N 3.08Å; M221-I224 WeakPolarHBondContact O-CB 3.37Å; M221-I224 PolarHBondContact O-N 2.7Å; M221-I224 VanDerWaalsContact O-N 3.1Å; M221-I224 HydrophobicContact SD-CD1 4.36Å; I224-G226 PolarHBondContact O-N 3.47Å; I224-G226 VanDerWaalsContact O-N 3.1Å
225	S	91.2	Very high	92.7	Very high	98 Å²	98	70 Å²	70	69%	0.685	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	6.2	175.5	-57.2	0	0	0	0	114.5	M221 R222 I223	M221-S225 PolarHBondContact O-N 3.17Å; M221-S225 PolarHBondContact O-OG 3.42Å; M221-S225 VanDerWaalsContact O-OG 3.11Å; R222-S225 PolarHBondContact O-N 2.9Å; I223-S225 VanDerWaalsContact C-N 3.29Å; I223-S225 PolarHBondContact O-N 3.01Å
226	G	91.5	Very high	92.5	Very high	26 Å²	26	68.6 Å²	68.6	27%	0.268	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	36.3	177	0	0	0	0	0	113.9	I223 I224 A228 H257	I223-G226 PolarHBondContact O-N 2.86Å; I223-G226 VanDerWaalsContact O-N 3.15Å; I224-G226 PolarHBondContact O-N 3.47Å; I224-G226 VanDerWaalsContact O-N 3.1Å; G226-A228 PolarHBondContact O-N 2.91Å; G226-H257 WeakPolarHBondContact O-CB 3.45Å
227	K	93.5	Very high	92.5	Very high	118 Å²	118	67.2 Å²	67.2	51%	0.513	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-50.8	135	173.9	-179.3	176.5	-179.8	179.2	0	111.2	R222 H258	R222-K227 HydrophobicContact CB-CD 4.36Å; R222-K227 WeakPolarHBondContact O-CB 3.48Å; R222-K227 PolarHBondContact O-N 3.28Å; R222-K227 VanDerWaalsContact O-N 3.12Å; K227-H258 WeakPolarHBondContact O-CB 3.46Å; K227-H258 PolarHBondContact O-CD2 3.49Å; K227-H258 VanDerWaalsContact O-CD2 3.27Å; K227-H258 PolarHBondContact O-N 3.31Å
228	A	93.7	Very high	92.4	Very high	52 Å²	52	69.1 Å²	69.1	43%	0.43	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-54.5	145.6	175	0	0	0	0	0	112.3	G226	G226-A228 PolarHBondContact O-N 2.91Å
229	A	92.8	Very high	92.1	Very high	7 Å²	7	71.9 Å²	71.9	6%	0.058	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-61.7	159.8	174	0	0	0	0	0	111.1	I233 Q234 A256 Y263	A229-I233 HydrophobicContact CB-CB 4.29Å; A229-I233 HydrophobicContact CB-CG2 4.32Å; A229-Q234 HydrophobicContact CB-CG 4.28Å; A229-A256 HydrophobicContact CB-CB 3.79Å; A229-A256 VanDerWaalsContact CB-O 3.27Å; A229-A256 WeakPolarHBondContact CB-O 3.48Å; A229-A256 PolarHBondContact N-O 3.49Å; A229-Y263 HydrophobicContact CB-CD1 3.65Å; A229-Y263 HydrophobicContact CB-CE1 3.41Å; A229-Y263 VanDerWaalsContact CB-CE1 3.41Å; A229-Y263 HydrophobicContact CB-CG 4.46Å
230	N	92.3	Very high	92	Very high	94 Å²	94	66.4 Å²	66.4	50%	0.503	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-57.4	137.7	172.8	-174.9	-43.2	0	0	0	109.3	L232 I233 Q234	N230-L232 PolarHBondContact O-N 2.87Å; N230-L232 PolarHBondContact OD1-N 2.77Å; N230-I233 HydrophobicContact CB-CD1 4.46Å; N230-I233 HydrophobicContact CB-CG1 4.45Å; N230-I233 WeakPolarHBondContact O-CB 3.48Å; N230-I233 PolarHBondContact O-N 3.48Å; N230-Q234 PolarHBondContact O-N 2.92Å
231	P	91.7	Very high	91.7	Very high	90 Å²	90	65.3 Å²	65.3	58%	0.584	35%	0.353	S	S	*	.	H	α-helix	trans	-50.4	-32.5	178.5	17.2	-32.3	0	0	0	113.2	I233 Q234 S235	P231-I233 VanDerWaalsContact C-N 3.32Å; P231-I233 PolarHBondContact O-N 3.49Å; P231-Q234 PolarHBondContact O-N 3.46Å; P231-S235 PolarHBondContact O-N 3.42Å; P231-S235 PolarHBondContact O-OG 2.91Å; P231-S235 VanDerWaalsContact O-OG 3.04Å
232	L	91.3	Very high	91.5	Very high	107 Å²	107	66.3 Å²	66.3	56%	0.56	36%	0.359	S	S	*	.	H	α-helix	trans	-61	-38.1	175.2	-176.3	139.1	0	0	0	113.3	N230 Q236	N230-L232 PolarHBondContact O-N 2.87Å; N230-L232 PolarHBondContact OD1-N 2.77Å; L232-Q236 VanDerWaalsContact O-CG 3.23Å; L232-Q236 WeakPolarHBondContact O-CG 3.4Å; L232-Q236 PolarHBondContact O-N 3.46Å; L232-Q236 VanDerWaalsContact O-N 3.11Å
233	I	90.6	Very high	91.2	Very high	25 Å²	25	64.1 Å²	64.1	13%	0.128	36%	0.358	C	S	.	.	H	α-helix	trans	-72.8	-40.8	177.4	-62.3	177.6	0	0	0	109.9	A229 N230 P231 Q236 I237 Y263 Y296	A229-I233 HydrophobicContact CB-CB 4.29Å; A229-I233 HydrophobicContact CB-CG2 4.32Å; N230-I233 HydrophobicContact CB-CD1 4.46Å; N230-I233 HydrophobicContact CB-CG1 4.45Å; N230-I233 WeakPolarHBondContact O-CB 3.48Å; N230-I233 PolarHBondContact O-N 3.48Å; P231-I233 VanDerWaalsContact C-N 3.32Å; P231-I233 PolarHBondContact O-N 3.49Å; I233-Q236 WeakPolarHBondContact O-CB 3.14Å; I233-Q236 PolarHBondContact O-N 3.3Å; I233-I237 HydrophobicContact CG2-CD1 3.96Å; I233-I237 WeakPolarHBondContact O-CG1 3.27Å; I233-I237 PolarHBondContact O-N 3.39Å; I233-Y263 HydrophobicContact CD1-CD2 4.47Å; I233-Y263 HydrophobicContact CD1-CE2 3.51Å; I233-Y263 WeakPolarHBondContact CD1-OH 3.48Å; I233-Y263 HydrophobicContact CG2-CE2 4.48Å; I233-Y296 HydrophobicContact CG2-CD2 4.39Å; I233-Y296 HydrophobicContact CG2-CE2 3.97Å
234	Q	92.2	Very high	90.9	Very high	54 Å²	54	64.9 Å²	64.9	25%	0.252	36%	0.361	S	S	.	.	H	α-helix	trans	-59.4	-50.6	175.3	-68	-175.8	-6.1	0	0	110.7	A229 N230 P231 Q236 I237 T238 A256	A229-Q234 HydrophobicContact CB-CG 4.28Å; N230-Q234 PolarHBondContact O-N 2.92Å; P231-Q234 PolarHBondContact O-N 3.46Å; Q234-Q236 VanDerWaalsContact C-N 3.27Å; Q234-Q236 PolarHBondContact O-N 3.12Å; Q234-I237 PolarHBondContact O-N 2.99Å; Q234-T238 PolarHBondContact O-N 3.18Å; Q234-T238 PolarHBondContact O-OG1 3.16Å; Q234-A256 HydrophobicContact CG-CB 4.26Å
235	S	91.7	Very high	90.5	Very high	77 Å²	77	63.8 Å²	63.8	54%	0.538	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-34.5	176.8	-54.8	0	0	0	0	113.2	P231 K239	P231-S235 PolarHBondContact O-N 3.42Å; P231-S235 PolarHBondContact O-OG 2.91Å; P231-S235 VanDerWaalsContact O-OG 3.04Å; S235-K239 WeakPolarHBondContact O-CB 3.3Å; S235-K239 PolarHBondContact O-N 3.17Å
236	Q	90.9	Very high	90.1	Very high	85 Å²	85	65.1 Å²	65.1	40%	0.397	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-44	174	-78.3	173.9	-8.3	0	0	112	L232 I233 Q234 K239 I240	L232-Q236 VanDerWaalsContact O-CG 3.23Å; L232-Q236 WeakPolarHBondContact O-CG 3.4Å; L232-Q236 PolarHBondContact O-N 3.46Å; L232-Q236 VanDerWaalsContact O-N 3.11Å; I233-Q236 WeakPolarHBondContact O-CB 3.14Å; I233-Q236 PolarHBondContact O-N 3.3Å; Q234-Q236 VanDerWaalsContact C-N 3.27Å; Q234-Q236 PolarHBondContact O-N 3.12Å; Q236-K239 PolarHBondContact O-N 3.11Å; Q236-I240 VanDerWaalsContact O-CG1 3.25Å; Q236-I240 WeakPolarHBondContact O-CG1 3.13Å; Q236-I240 PolarHBondContact O-N 2.75Å
237	I	91.7	Very high	89.8	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-45	177.3	-66.4	165.8	0	0	0	110.1	I233 Q234 K239 I240 C241 V254 A256 V265 V267 I291	I233-I237 HydrophobicContact CG2-CD1 3.96Å; I233-I237 WeakPolarHBondContact O-CG1 3.27Å; I233-I237 PolarHBondContact O-N 3.39Å; Q234-I237 PolarHBondContact O-N 2.99Å; I237-K239 VanDerWaalsContact C-N 3.3Å; I237-K239 PolarHBondContact O-N 2.78Å; I237-I240 PolarHBondContact O-N 2.96Å; I237-I240 VanDerWaalsContact O-N 3.11Å; I237-C241 PolarHBondContact O-N 3.35Å; I237-V254 HydrophobicContact CB-CG1 4.12Å; I237-V254 HydrophobicContact CG2-CG1 3.59Å; I237-A256 HydrophobicContact CD1-CB 3.81Å; I237-V265 HydrophobicContact CD1-CG1 4.12Å; I237-V265 HydrophobicContact CD1-CG2 3.76Å; I237-V265 HydrophobicContact CG2-CG1 3.87Å; I237-V267 HydrophobicContact CG2-CG2 4.46Å; I237-I291 HydrophobicContact CG2-CD1 4.32Å
238	T	91.5	Very high	89.4	Confident	45 Å²	45	63.9 Å²	63.9	28%	0.276	35%	0.348	S	S	.	.	H	α-helix	trans	-57.1	-44.2	175	-52.7	0	0	0	0	111.2	Q234 I240 C241 I242	Q234-T238 PolarHBondContact O-N 3.18Å; Q234-T238 PolarHBondContact O-OG1 3.16Å; T238-I240 PolarHBondContact O-N 3.46Å; T238-C241 VanDerWaalsContact O-CB 3.28Å; T238-C241 WeakPolarHBondContact O-CB 3.38Å; T238-C241 PolarHBondContact O-N 3.4Å; T238-I242 HydrophobicContact CG2-CD1 4.23Å; T238-I242 WeakPolarHBondContact O-CG1 3.46Å; T238-I242 PolarHBondContact O-N 2.47Å
239	K	89.6	Confident	89.2	Confident	133 Å²	133	66.6 Å²	66.6	58%	0.578	35%	0.351	S	S	*	.	H	α-helix	trans	-61.4	-43.8	175.3	-177	172.1	-177.4	172.4	0	112.3	S235 Q236 I237 C241 I242 D243	S235-K239 WeakPolarHBondContact O-CB 3.3Å; S235-K239 PolarHBondContact O-N 3.17Å; Q236-K239 PolarHBondContact O-N 3.11Å; I237-K239 VanDerWaalsContact C-N 3.3Å; I237-K239 PolarHBondContact O-N 2.78Å; K239-C241 PolarHBondContact O-N 3.05Å; K239-I242 PolarHBondContact O-N 3.3Å; K239-D243 WeakPolarHBondContact O-CB 3.17Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 3Å
240	I	89.9	Confident	89	Confident	22 Å²	22	72.4 Å²	72.4	11%	0.113	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-31.9	177.4	-67.4	164.6	0	0	0	111.6	Q236 I237 T238 H244 F287 K290 I291 L294	Q236-I240 VanDerWaalsContact O-CG1 3.25Å; Q236-I240 WeakPolarHBondContact O-CG1 3.13Å; Q236-I240 PolarHBondContact O-N 2.75Å; I237-I240 PolarHBondContact O-N 2.96Å; I237-I240 VanDerWaalsContact O-N 3.11Å; T238-I240 PolarHBondContact O-N 3.46Å; I240-H244 WeakPolarHBondContact O-CB 3.39Å; I240-H244 PolarHBondContact O-N 3.43Å; I240-F287 HydrophobicContact CG2-CE2 4.45Å; I240-K290 HydrophobicContact CG2-CD 4.13Å; I240-K290 HydrophobicContact CG2-CG 4.47Å; I240-K290 PolarHBondContact O-NZ 2.97Å; I240-I291 HydrophobicContact CB-CD1 4.22Å; I240-I291 HydrophobicContact CG2-CD1 3.6Å; I240-L294 HydrophobicContact CD1-CD1 3.92Å; I240-L294 HydrophobicContact CD1-CD2 4.14Å
241	C	89.3	Confident	88.9	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-67.4	-51.5	175.2	-167.5	0	0	0	0	111.5	I237 T238 K239 D243 H244 I251 F287	I237-C241 PolarHBondContact O-N 3.35Å; T238-C241 VanDerWaalsContact O-CB 3.28Å; T238-C241 WeakPolarHBondContact O-CB 3.38Å; T238-C241 PolarHBondContact O-N 3.4Å; K239-C241 PolarHBondContact O-N 3.05Å; C241-D243 VanDerWaalsContact C-N 3.29Å; C241-D243 PolarHBondContact O-N 2.85Å; C241-H244 WeakPolarHBondContact O-CB 3.4Å; C241-H244 PolarHBondContact O-N 3.4Å; C241-H244 VanDerWaalsContact O-N 3.09Å; C241-I251 HydrophobicContact CB-CD1 3.8Å; C241-I251 VanDerWaalsContact SG-CD1 3.5Å; C241-F287 HydrophobicContact CB-CE1 4.41Å; C241-F287 HydrophobicContact CB-CE2 4.13Å; C241-F287 HydrophobicContact CB-CZ 3.56Å; C241-F287 VanDerWaalsContact SG-CZ 3.51Å
242	I	89	Confident	88.7	Confident	110 Å²	110	67.9 Å²	67.9	56%	0.564	34%	0.341	S	S	*	.	H	α-helix	trans	-57.8	-43	176	-63.6	168	0	0	0	111.1	T238 K239 H244 I251	T238-I242 HydrophobicContact CG2-CD1 4.23Å; T238-I242 WeakPolarHBondContact O-CG1 3.46Å; T238-I242 PolarHBondContact O-N 2.47Å; K239-I242 PolarHBondContact O-N 3.3Å; I242-H244 PolarHBondContact O-N 3.48Å; I242-I251 HydrophobicContact CB-CD1 4.46Å; I242-I251 HydrophobicContact CD1-CD1 4.49Å; I242-I251 HydrophobicContact CG1-CD1 3.46Å; I242-I251 VanDerWaalsContact CG1-CD1 3.46Å
243	D	87.9	Confident	88.7	Confident	98 Å²	98	64.9 Å²	64.9	52%	0.524	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	1	-178	-66.1	-21.4	0	0	0	113.3	K239 C241	K239-D243 WeakPolarHBondContact O-CB 3.17Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 3Å; C241-D243 VanDerWaalsContact C-N 3.29Å; C241-D243 PolarHBondContact O-N 2.85Å
244	H	84.4	Confident	88.8	Confident	45 Å²	45	64.9 Å²	64.9	21%	0.208	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-56.6	-172.8	-176.3	36.8	0	0	0	114.3	I240 C241 I242 F248 F287	I240-H244 WeakPolarHBondContact O-CB 3.39Å; I240-H244 PolarHBondContact O-N 3.43Å; C241-H244 WeakPolarHBondContact O-CB 3.4Å; C241-H244 PolarHBondContact O-N 3.4Å; C241-H244 VanDerWaalsContact O-N 3.09Å; I242-H244 PolarHBondContact O-N 3.48Å; H244-F248 HydrophobicContact CB-CE2 4.01Å; H244-F248 AromaticContact CD2-CE2 3.83Å; H244-F248 AromaticContact CD2-CZ 3.86Å; H244-F287 HydrophobicContact CB-CD2 3.83Å; H244-F287 HydrophobicContact CB-CE2 4.08Å; H244-F287 WeakPolarHBondContact CD2-CB 3.16Å; H244-F287 AromaticContact CD2-CD2 3.23Å; H244-F287 WeakPolarHBondContact CD2-CD2 3.2Å; H244-F287 AromaticContact CD2-CG 3.51Å; H244-F287 AromaticContact CG-CD2 3.54Å; H244-F287 VanDerWaalsContact NE2-CA 3.28Å; H244-F287 WeakPolarHBondContact NE2-CA 3.5Å; H244-F287 VanDerWaalsContact NE2-CB 3.34Å; H244-F287 WeakPolarHBondContact NE2-CB 3.38Å; H244-F287 AromaticContact NE2-CD2 3.92Å; H244-F287 PolarHBondContact NE2-N 3.12Å
245	E	83.1	Confident	88.8	Confident	53 Å²	53	65.5 Å²	65.5	25%	0.248	33%	0.333	C	S	.	.			trans	-144.6	124	-171.1	-175.6	61.4	-134.8	0	0	109.4	K247 F248 I283	E245-K247 HydrophobicContact CG-CB 3.87Å; E245-K247 HydrophobicContact CG-CG 4.34Å; E245-K247 PolarHBondContact O-N 3.34Å; E245-F248 HydrophobicContact CB-CD2 4.12Å; E245-F248 HydrophobicContact CB-CE1 4.4Å; E245-F248 HydrophobicContact CB-CE2 4.01Å; E245-F248 HydrophobicContact CB-CG 4.39Å; E245-F248 HydrophobicContact CB-CZ 4.13Å; E245-F248 PolarHBondContact O-N 2.84Å; E245-I283 HydrophobicContact CB-CG2 4.13Å; E245-I283 HydrophobicContact CG-CD1 4.29Å; E245-I283 HydrophobicContact CG-CG1 4.36Å; E245-I283 HydrophobicContact CG-CG2 3.83Å
246	P	82.6	Confident	88.9	Confident	127 Å²	127	61.9 Å²	61.9	83%	0.825	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.5	178.2	27.5	-36.8	0	0	0	113.7	F248	P246-F248 PolarHBondContact O-N 3.14Å
247	K	86.5	Confident	89.1	Confident	92 Å²	92	59.5 Å²	59.5	40%	0.4	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-10.1	175.3	-64.7	179.6	171.6	-174.4	0	113.9	E245 E249 L271 I275 E279 I283	E245-K247 HydrophobicContact CG-CB 3.87Å; E245-K247 HydrophobicContact CG-CG 4.34Å; E245-K247 PolarHBondContact O-N 3.34Å; K247-E249 PolarHBondContact O-N 2.97Å; K247-E249 VanDerWaalsContact O-N 3.12Å; K247-L271 HydrophobicContact CB-CD2 4.31Å; K247-L271 WeakPolarHBondContact O-CD2 3.17Å; K247-I275 HydrophobicContact CD-CD1 4.17Å; K247-E279 IonicContact NZ-OE2 3.83Å; K247-E279 PolarHBondContact NZ-OE2 3.18Å; K247-I283 HydrophobicContact CD-CD1 3.69Å
248	F	85.3	Confident	89.2	Confident	26 Å²	26	61 Å²	61	11%	0.114	30%	0.303	C	S	.	.			trans	-68.1	107.9	171.3	-66.5	-30.2	0	0	0	109.5	H244 E245 P246 V269 L271 I283 F287	H244-F248 HydrophobicContact CB-CE2 4.01Å; H244-F248 AromaticContact CD2-CE2 3.83Å; H244-F248 AromaticContact CD2-CZ 3.86Å; E245-F248 HydrophobicContact CB-CD2 4.12Å; E245-F248 HydrophobicContact CB-CE1 4.4Å; E245-F248 HydrophobicContact CB-CE2 4.01Å; E245-F248 HydrophobicContact CB-CG 4.39Å; E245-F248 HydrophobicContact CB-CZ 4.13Å; E245-F248 PolarHBondContact O-N 2.84Å; P246-F248 PolarHBondContact O-N 3.14Å; F248-V269 HydrophobicContact CD1-CB 4Å; F248-V269 HydrophobicContact CD1-CG1 4.37Å; F248-V269 HydrophobicContact CD1-CG2 4.06Å; F248-V269 HydrophobicContact CE1-CB 4.1Å; F248-V269 HydrophobicContact CE1-CG1 4.33Å; F248-V269 HydrophobicContact CE1-CG2 3.73Å; F248-V269 HydrophobicContact CE2-CG1 4.44Å; F248-V269 HydrophobicContact CG-CB 4.48Å; F248-V269 HydrophobicContact CZ-CG1 4.36Å; F248-V269 HydrophobicContact CZ-CG2 4.3Å; F248-L271 HydrophobicContact CD1-CD2 3.55Å; F248-L271 HydrophobicContact CD1-CG 4.44Å; F248-L271 HydrophobicContact CE1-CD2 3.99Å; F248-I283 HydrophobicContact CE1-CG2 3.6Å; F248-I283 HydrophobicContact CZ-CG2 3.89Å; F248-F287 HydrophobicContact CZ-CB 4.45Å; F248-F287 HydrophobicContact CZ-CD1 4.35Å; F248-F287 HydrophobicContact CZ-CG 4.29Å
249	E	88.1	Confident	89.1	Confident	109 Å²	109	60.2 Å²	60.2	51%	0.509	30%	0.296	S	S	.	.			trans	-72.3	-37.4	178.7	-63.6	-168.5	170.9	0	0	110.8	K247 V270 N272	K247-E249 PolarHBondContact O-N 2.97Å; K247-E249 VanDerWaalsContact O-N 3.12Å; E249-V270 PolarHBondContact N-O 2.84Å; E249-N272 WeakPolarHBondContact OE1-CA 3.25Å; E249-N272 VanDerWaalsContact OE1-CB 3.23Å; E249-N272 WeakPolarHBondContact OE1-CB 3.34Å; E249-N272 PolarHBondContact OE1-ND2 3.48Å
250	R	88.6	Confident	89	Confident	128 Å²	128	54 Å²	54	48%	0.483	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	150.5	178.4	-169.9	174.9	-69.7	177.9	2.9	111.4	V270	R250-V270 HydrophobicContact CB-CB 4.14Å; R250-V270 HydrophobicContact CB-CG2 4.21Å; R250-V270 PolarHBondContact O-N 3.15Å
251	I	90.3	Very high	88.7	Confident	44 Å²	44	56 Å²	56	23%	0.226	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.2	167.4	-56.8	166.3	0	0	0	106.3	C241 I242 V254	C241-I251 HydrophobicContact CB-CD1 3.8Å; C241-I251 VanDerWaalsContact SG-CD1 3.5Å; I242-I251 HydrophobicContact CB-CD1 4.46Å; I242-I251 HydrophobicContact CD1-CD1 4.49Å; I242-I251 HydrophobicContact CG1-CD1 3.46Å; I242-I251 VanDerWaalsContact CG1-CD1 3.46Å; I251-V254 HydrophobicContact CG2-CG2 3.55Å
252	E	89.2	Confident	88.8	Confident	45 Å²	45	58 Å²	58	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-54.8	-176.4	-53.8	-160.4	138.6	0	0	111.3	H268 V270 H310	E252-H268 HydrophobicContact CB-CB 4.19Å; E252-H268 PolarHBondContact N-O 3.11Å; E252-V270 HydrophobicContact CG-CG2 3.57Å; E252-V270 WeakPolarHBondContact OE1-CG2 3.32Å; E252-H310 IonicContact OE1-CE1 3.98Å; E252-H310 IonicContact OE2-NE2 3.34Å
253	T	89.8	Confident	89	Confident	44 Å²	44	54 Å²	54	27%	0.27	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	134.6	-174	-60.1	0	0	0	0	110.2	L255 V267 H268	T253-L255 HydrophobicContact CG2-CB 4.33Å; T253-V267 WeakPolarHBondContact O-CA 3.36Å; T253-H268 PolarHBondContact O-N 3.16Å
254	V	92.5	Very high	89.3	Confident	25 Å²	25	50.1 Å²	50.1	15%	0.152	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	96.9	168.4	-178.2	0	0	0	0	107.4	I237 I251 V267	I237-V254 HydrophobicContact CB-CG1 4.12Å; I237-V254 HydrophobicContact CG2-CG1 3.59Å; I251-V254 HydrophobicContact CG2-CG2 3.55Å; V254-V267 HydrophobicContact CG1-CG2 4.49Å; V254-V267 HydrophobicContact CG2-CG1 4.17Å
255	L	92.7	Very high	89.9	Confident	68 Å²	68	48 Å²	48	36%	0.356	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.1	176.6	-176.1	65.5	0	0	0	109.2	T253 V265 E266	T253-L255 HydrophobicContact CG2-CB 4.33Å; L255-V265 CarbonylContact O-C 3.53Å; L255-V265 WeakPolarHBondContact O-CA 3.3Å; L255-E266 HydrophobicContact CB-CB 4.3Å; L255-E266 PolarHBondContact N-O 3.3Å; L255-E266 PolarHBondContact O-N 2.96Å
256	A	95	Very high	90.4	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	120.9	168.9	0	0	0	0	0	108	A229 Q234 I237 L264 V265	A229-A256 HydrophobicContact CB-CB 3.79Å; A229-A256 VanDerWaalsContact CB-O 3.27Å; A229-A256 WeakPolarHBondContact CB-O 3.48Å; A229-A256 PolarHBondContact N-O 3.49Å; Q234-A256 HydrophobicContact CG-CB 4.26Å; I237-A256 HydrophobicContact CD1-CB 3.81Å; A256-L264 WeakPolarHBondContact CA-O 3.36Å; A256-V265 HydrophobicContact CB-CG2 4.2Å
257	H	94.2	Very high	90.9	Very high	35 Å²	35	42 Å²	42	16%	0.162	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	155.7	-179.3	68.6	80.1	0	0	0	111.3	G226 F259 Y263 L264 E266	G226-H257 WeakPolarHBondContact O-CB 3.45Å; H257-F259 PolarHBondContact O-N 3.17Å; H257-Y263 VanDerWaalsContact O-CA 3.32Å; H257-Y263 WeakPolarHBondContact O-CA 3.5Å; H257-L264 PolarHBondContact N-O 3.31Å; H257-L264 PolarHBondContact O-N 3.44Å; H257-E266 IonicContact NE2-OE1 2.75Å
258	H	93.4	Very high	91.2	Very high	33 Å²	33	38.3 Å²	38.3	15%	0.153	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	137.1	-178.8	-86	-78.3	0	0	0	111.2	I223 K227 Y263	I223-H258 HydrophobicContact CG2-CB 3.9Å; K227-H258 WeakPolarHBondContact O-CB 3.46Å; K227-H258 PolarHBondContact O-CD2 3.49Å; K227-H258 VanDerWaalsContact O-CD2 3.27Å; K227-H258 PolarHBondContact O-N 3.31Å; H258-Y263 AromaticContact CD2-CE1 3.65Å; H258-Y263 AromaticContact CE1-CE1 3.38Å; H258-Y263 WeakPolarHBondContact CE1-CE1 3.33Å; H258-Y263 AromaticContact CE1-CZ 3.49Å; H258-Y263 VanDerWaalsContact CE1-CZ 3.49Å; H258-Y263 PolarHBondContact CE1-OH 2.76Å; H258-Y263 AromaticContact CG-CE1 3.82Å; H258-Y263 AromaticContact ND1-CE1 3.64Å; H258-Y263 AromaticContact NE2-CE1 3.38Å; H258-Y263 WeakPolarHBondContact NE2-CE1 3.09Å; H258-Y263 AromaticContact NE2-CZ 3.71Å; H258-Y263 PolarHBondContact NE2-OH 3.39Å
259	F	88.9	Confident	91.6	Very high	27 Å²	27	37 Å²	37	12%	0.118	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	91.5	172.7	-167.9	-89	0	0	0	107.6	R114 R118 H257 T261 N262 L264	R114-F259 HydrophobicContact CB-CZ 4.29Å; R118-F259 HydrophobicContact CG-CD1 4.47Å; R118-F259 HydrophobicContact CG-CE1 4.3Å; R118-F259 VanDerWaalsContact CZ-CZ 3.42Å; H257-F259 PolarHBondContact O-N 3.17Å; F259-T261 PolarHBondContact O-N 3.38Å; F259-N262 CarbonylContact C-O 3.53Å; F259-N262 PolarHBondContact N-O 3.02Å; F259-N262 PolarHBondContact O-N 2.95Å; F259-L264 HydrophobicContact CB-CB 3.99Å; F259-L264 HydrophobicContact CD2-CB 4.38Å; F259-L264 HydrophobicContact CD2-CD2 4.2Å; F259-L264 HydrophobicContact CE2-CD2 4.43Å; F259-L264 HydrophobicContact CG-CB 4.43Å
260	G	87.5	Confident	91.8	Very high	4 Å²	4	31.9 Å²	31.9	4%	0.041	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-131.8	-165.5	0	0	0	0	0	110.9	I223	I223-G260 WeakPolarHBondContact CG2-O 3.44Å
261	T	85.6	Confident	92	Very high	63 Å²	63	26 Å²	26	39%	0.387	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-16.6	177.1	58.3	0	0	0	0	114.2	E120 F259	E120-T261 HydrophobicContact CB-CG2 4.02Å; E120-T261 HydrophobicContact CG-CG2 3.89Å; E120-T261 VanDerWaalsContact OE2-CG2 3.28Å; E120-T261 WeakPolarHBondContact OE2-CG2 3.14Å; F259-T261 PolarHBondContact O-N 3.38Å
262	N	90.9	Very high	92.1	Very high	43 Å²	43	27 Å²	27	23%	0.23	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	-176.2	-176.5	-69.8	-22.1	0	0	0	110.3	F259 Y296 E298	F259-N262 CarbonylContact C-O 3.53Å; F259-N262 PolarHBondContact N-O 3.02Å; F259-N262 PolarHBondContact O-N 2.95Å; N262-Y296 CarbonylContact C-O 3.44Å; N262-Y296 WeakPolarHBondContact CA-O 3.3Å; N262-Y296 WeakPolarHBondContact CB-O 3.4Å; N262-E298 HydrophobicContact CB-CB 3.77Å
263	Y	93.5	Very high	92.3	Very high	26 Å²	26	31.7 Å²	31.7	10%	0.102	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	140.2	179.4	-61.3	-73.3	0	0	0	111.9	A229 I233 H257 H258 Y296 E298	A229-Y263 HydrophobicContact CB-CD1 3.65Å; A229-Y263 HydrophobicContact CB-CE1 3.41Å; A229-Y263 VanDerWaalsContact CB-CE1 3.41Å; A229-Y263 HydrophobicContact CB-CG 4.46Å; I233-Y263 HydrophobicContact CD1-CD2 4.47Å; I233-Y263 HydrophobicContact CD1-CE2 3.51Å; I233-Y263 WeakPolarHBondContact CD1-OH 3.48Å; I233-Y263 HydrophobicContact CG2-CE2 4.48Å; H257-Y263 VanDerWaalsContact O-CA 3.32Å; H257-Y263 WeakPolarHBondContact O-CA 3.5Å; H258-Y263 AromaticContact CD2-CE1 3.65Å; H258-Y263 AromaticContact CE1-CE1 3.38Å; H258-Y263 WeakPolarHBondContact CE1-CE1 3.33Å; H258-Y263 AromaticContact CE1-CZ 3.49Å; H258-Y263 VanDerWaalsContact CE1-CZ 3.49Å; H258-Y263 PolarHBondContact CE1-OH 2.76Å; H258-Y263 AromaticContact CG-CE1 3.82Å; H258-Y263 AromaticContact ND1-CE1 3.64Å; H258-Y263 AromaticContact NE2-CE1 3.38Å; H258-Y263 WeakPolarHBondContact NE2-CE1 3.09Å; H258-Y263 AromaticContact NE2-CZ 3.71Å; H258-Y263 PolarHBondContact NE2-OH 3.39Å; Y263-Y296 AromaticContact CD2-CD2 3.91Å; Y263-Y296 HydrophobicContact CD2-CD2 3.91Å; Y263-Y296 HydrophobicContact CD2-CG 4.42Å; Y263-Y296 WeakPolarHBondContact CD2-O 3.31Å; Y263-Y296 HydrophobicContact CE2-CD2 4.47Å; Y263-Y296 PolarHBondContact N-O 3.15Å; Y263-E298 PolarHBondContact O-N 3.49Å
264	L	94	Very high	92.5	Very high	15 Å²	15	36.4 Å²	36.4	8%	0.079	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.6	156.4	-169.6	62.5	0	0	0	106.9	A256 H257 F259 R299 F301	A256-L264 WeakPolarHBondContact CA-O 3.36Å; H257-L264 PolarHBondContact N-O 3.31Å; H257-L264 PolarHBondContact O-N 3.44Å; F259-L264 HydrophobicContact CB-CB 3.99Å; F259-L264 HydrophobicContact CD2-CB 4.38Å; F259-L264 HydrophobicContact CD2-CD2 4.2Å; F259-L264 HydrophobicContact CE2-CD2 4.43Å; F259-L264 HydrophobicContact CG-CB 4.43Å; L264-R299 HydrophobicContact CD1-CB 3.67Å; L264-R299 HydrophobicContact CD1-CG 4.29Å; L264-F301 HydrophobicContact CD1-CD2 3.97Å; L264-F301 HydrophobicContact CD1-CE2 3.62Å; L264-F301 HydrophobicContact CD2-CE2 4.02Å; L264-F301 HydrophobicContact CG-CD2 4.3Å; L264-F301 HydrophobicContact CG-CE2 4.1Å
265	V	95.7	Very high	92.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.9	-178.6	-176.1	0	0	0	0	108.6	I237 L255 A256 V267 I291 V297 R299 A300 F301	I237-V265 HydrophobicContact CD1-CG1 4.12Å; I237-V265 HydrophobicContact CD1-CG2 3.76Å; I237-V265 HydrophobicContact CG2-CG1 3.87Å; L255-V265 CarbonylContact O-C 3.53Å; L255-V265 WeakPolarHBondContact O-CA 3.3Å; A256-V265 HydrophobicContact CB-CG2 4.2Å; V265-V267 HydrophobicContact CG1-CG2 3.72Å; V265-I291 HydrophobicContact CB-CG2 4.23Å; V265-I291 HydrophobicContact CG1-CG2 4.18Å; V265-I291 HydrophobicContact CG2-CG2 4.38Å; V265-V297 HydrophobicContact CG2-CB 4.49Å; V265-V297 HydrophobicContact CG2-CG1 3.95Å; V265-V297 HydrophobicContact CG2-CG2 3.77Å; V265-R299 PolarHBondContact N-O 2.95Å; V265-R299 VanDerWaalsContact N-O 3.08Å; V265-A300 HydrophobicContact CB-CB 4.42Å; V265-A300 CarbonylContact O-C 3.34Å; V265-A300 WeakPolarHBondContact O-CA 3.47Å; V265-F301 PolarHBondContact O-N 3.46Å
266	E	94.5	Very high	92.6	Very high	54 Å²	54	37.1 Å²	37.1	25%	0.252	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.4	176.8	-70.5	168.9	-168.7	0	0	106.9	L255 H257 F301	L255-E266 HydrophobicContact CB-CB 4.3Å; L255-E266 PolarHBondContact N-O 3.3Å; L255-E266 PolarHBondContact O-N 2.96Å; H257-E266 IonicContact NE2-OE1 2.75Å; E266-F301 WeakPolarHBondContact CA-O 3.16Å; E266-F301 HydrophobicContact CG-CB 4.21Å; E266-F301 HydrophobicContact CG-CD2 3.86Å
267	V	93.8	Very high	92.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.9	-177.9	-170.8	0	0	0	0	109.2	I237 T253 V254 V265 V269 F287 F301 V302 H303	I237-V267 HydrophobicContact CG2-CG2 4.46Å; T253-V267 WeakPolarHBondContact O-CA 3.36Å; V254-V267 HydrophobicContact CG1-CG2 4.49Å; V254-V267 HydrophobicContact CG2-CG1 4.17Å; V265-V267 HydrophobicContact CG1-CG2 3.72Å; V267-V269 HydrophobicContact CG1-CG1 3.93Å; V267-F287 HydrophobicContact CB-CE1 4.04Å; V267-F287 HydrophobicContact CG1-CE1 3.84Å; V267-F287 HydrophobicContact CG1-CZ 4.46Å; V267-F287 HydrophobicContact CG2-CE1 4.16Å; V267-F301 PolarHBondContact N-O 3.47Å; V267-V302 CarbonylContact O-C 3.55Å; V267-V302 VanDerWaalsContact O-CA 3.31Å; V267-V302 WeakPolarHBondContact O-CA 3.21Å; V267-H303 PolarHBondContact O-N 2.79Å
268	H	92.7	Very high	92.7	Very high	15 Å²	15	50 Å²	50	7%	0.069	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.4	174.6	-58.7	-176.2	0	0	0	108.3	E252 T253 H303 E315 H316	E252-H268 HydrophobicContact CB-CB 4.19Å; E252-H268 PolarHBondContact N-O 3.11Å; T253-H268 PolarHBondContact O-N 3.16Å; H268-H303 WeakPolarHBondContact CA-O 3.47Å; H268-H303 HydrophobicContact CB-CB 4.38Å; H268-H303 VanDerWaalsContact CD2-CB 3.47Å; H268-H303 WeakPolarHBondContact CD2-CB 3.5Å; H268-E315 IonicContact CE1-OE2 3.56Å; H268-E315 IonicContact ND1-OE2 3.52Å; H268-H316 AromaticContact CE1-CD2 3.52Å; H268-H316 AromaticContact CE1-CE1 3.7Å; H268-H316 AromaticContact CE1-NE2 2.98Å; H268-H316 PolarHBondContact CE1-NE2 3.16Å; H268-H316 AromaticContact ND1-NE2 3.81Å; H268-H316 AromaticContact NE2-NE2 3.78Å
269	V	92.7	Very high	92.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.1	-178.3	-63.8	0	0	0	0	109.9	F248 V267 V302 H303 V304 D305	F248-V269 HydrophobicContact CD1-CB 4Å; F248-V269 HydrophobicContact CD1-CG1 4.37Å; F248-V269 HydrophobicContact CD1-CG2 4.06Å; F248-V269 HydrophobicContact CE1-CB 4.1Å; F248-V269 HydrophobicContact CE1-CG1 4.33Å; F248-V269 HydrophobicContact CE1-CG2 3.73Å; F248-V269 HydrophobicContact CE2-CG1 4.44Å; F248-V269 HydrophobicContact CG-CB 4.48Å; F248-V269 HydrophobicContact CZ-CG1 4.36Å; F248-V269 HydrophobicContact CZ-CG2 4.3Å; V267-V269 HydrophobicContact CG1-CG1 3.93Å; V269-V302 HydrophobicContact CG2-CG1 4.16Å; V269-H303 PolarHBondContact N-O 3.3Å; V269-V304 HydrophobicContact CG2-CG2 4.04Å; V269-V304 WeakPolarHBondContact O-CA 3.27Å; V269-D305 PolarHBondContact O-N 3.43Å
270	V	92.3	Very high	93	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.9	175.2	-175.3	0	0	0	0	109.2	E249 R250 E252 D305 F308	E249-V270 PolarHBondContact N-O 2.84Å; R250-V270 HydrophobicContact CB-CB 4.14Å; R250-V270 HydrophobicContact CB-CG2 4.21Å; R250-V270 PolarHBondContact O-N 3.15Å; E252-V270 HydrophobicContact CG-CG2 3.57Å; E252-V270 WeakPolarHBondContact OE1-CG2 3.32Å; V270-D305 CarbonylContact C-O 3.55Å; V270-D305 VanDerWaalsContact CA-O 3.28Å; V270-D305 WeakPolarHBondContact CA-O 3.46Å; V270-D305 HydrophobicContact CG2-CB 4.45Å; V270-F308 HydrophobicContact CG2-CB 4.35Å
271	L	93.4	Very high	93.3	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	28%	0.283	C	S	.	.			trans	-112.6	157.7	171.6	-69.5	-179.3	0	0	0	110.2	K247 F248 E273 I275 A280 V304 D305 Y306	K247-L271 HydrophobicContact CB-CD2 4.31Å; K247-L271 WeakPolarHBondContact O-CD2 3.17Å; F248-L271 HydrophobicContact CD1-CD2 3.55Å; F248-L271 HydrophobicContact CD1-CG 4.44Å; F248-L271 HydrophobicContact CE1-CD2 3.99Å; L271-E273 PolarHBondContact O-N 3.03Å; L271-I275 HydrophobicContact CB-CG2 4.25Å; L271-I275 HydrophobicContact CD1-CD1 4.24Å; L271-A280 HydrophobicContact CD1-CB 3.79Å; L271-V304 HydrophobicContact CB-CG1 4.14Å; L271-V304 HydrophobicContact CD1-CG1 3.51Å; L271-V304 HydrophobicContact CG-CG1 3.81Å; L271-D305 PolarHBondContact N-O 3.46Å; L271-Y306 WeakPolarHBondContact O-CA 3.36Å
272	N	92.9	Very high	93.7	Very high	66 Å²	66	57.2 Å²	57.2	35%	0.353	29%	0.287	S	S	.	.			trans	-57.6	133.1	174.7	-163.5	-76.7	0	0	0	111.4	E249 N274 I275	E249-N272 WeakPolarHBondContact OE1-CA 3.25Å; E249-N272 VanDerWaalsContact OE1-CB 3.23Å; E249-N272 WeakPolarHBondContact OE1-CB 3.34Å; E249-N272 PolarHBondContact OE1-ND2 3.48Å; N272-N274 PolarHBondContact O-N 3.05Å; N272-N274 VanDerWaalsContact O-N 3.16Å; N272-N274 WeakPolarHBondContact OD1-CB 3.46Å; N272-N274 PolarHBondContact OD1-N 3.3Å; N272-N274 PolarHBondContact OD1-ND2 3.12Å; N272-I275 VanDerWaalsContact O-CB 3.28Å; N272-I275 WeakPolarHBondContact O-CB 3.37Å; N272-I275 WeakPolarHBondContact O-CG2 3.16Å; N272-I275 PolarHBondContact O-N 3.32Å
273	E	92.1	Very high	93.8	Very high	143 Å²	143	56.1 Å²	56.1	67%	0.668	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.5	177.9	-171.4	-176.7	176.6	0	0	113.4	L271 I275 Y306	L271-E273 PolarHBondContact O-N 3.03Å; E273-I275 PolarHBondContact O-N 3.38Å; E273-Y306 HydrophobicContact CB-CD2 4.49Å; E273-Y306 HydrophobicContact CG-CD2 4.15Å; E273-Y306 HydrophobicContact CG-CG 4.44Å
274	N	93.4	Very high	93.8	Very high	144 Å²	144	55.8 Å²	55.8	77%	0.77	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-1.2	-179.5	-56.6	-71.2	0	0	0	113.5	N272	N272-N274 PolarHBondContact O-N 3.05Å; N272-N274 VanDerWaalsContact O-N 3.16Å; N272-N274 WeakPolarHBondContact OD1-CB 3.46Å; N272-N274 PolarHBondContact OD1-N 3.3Å; N272-N274 PolarHBondContact OD1-ND2 3.12Å
275	I	93.2	Very high	93.8	Very high	35 Å²	35	58 Å²	58	18%	0.179	29%	0.292	C	S	.	.	S	Bend	trans	-68.9	140.5	176	-155.6	172.8	0	0	0	109.6	K247 L271 N272 E273 E279 A280 I283	K247-I275 HydrophobicContact CD-CD1 4.17Å; L271-I275 HydrophobicContact CB-CG2 4.25Å; L271-I275 HydrophobicContact CD1-CD1 4.24Å; N272-I275 VanDerWaalsContact O-CB 3.28Å; N272-I275 WeakPolarHBondContact O-CB 3.37Å; N272-I275 WeakPolarHBondContact O-CG2 3.16Å; N272-I275 PolarHBondContact O-N 3.32Å; E273-I275 PolarHBondContact O-N 3.38Å; I275-E279 HydrophobicContact CD1-CB 3.9Å; I275-E279 HydrophobicContact CG1-CB 3.68Å; I275-A280 HydrophobicContact CG2-CB 3.97Å; I275-I283 HydrophobicContact CD1-CD1 3.73Å
276	T	95.1	Very high	93.7	Very high	72 Å²	72	59.1 Å²	59.1	44%	0.442	30%	0.304	S	S	.	.			trans	-67.2	144	174.4	69	0	0	0	0	110	K278 E279 A280	T276-K278 PolarHBondContact O-N 2.65Å; T276-K278 VanDerWaalsContact O-N 3.11Å; T276-E279 PolarHBondContact O-N 3.04Å; T276-E279 WeakPolarHBondContact OG1-CB 3.37Å; T276-E279 WeakPolarHBondContact OG1-CG 3.44Å; T276-E279 PolarHBondContact OG1-N 2.89Å; T276-A280 PolarHBondContact O-N 3.39Å
277	L	94.8	Very high	93.7	Very high	153 Å²	153	56.5 Å²	56.5	80%	0.801	29%	0.292	S	S	*	.	H	α-helix	trans	-52.6	-36.3	175.2	177.5	63.2	0	0	0	112	A280 H281	L277-A280 PolarHBondContact O-N 2.88Å; L277-H281 VanDerWaalsContact O-CB 3.32Å; L277-H281 WeakPolarHBondContact O-CB 3.33Å; L277-H281 PolarHBondContact O-N 3.29Å
278	K	95.7	Very high	93.7	Very high	154 Å²	154	58.8 Å²	58.8	67%	0.67	30%	0.302	S	S	*	.	H	α-helix	trans	-61.4	-48.3	175.8	-176.5	-176.9	175.9	-173.4	0	111.8	T276 H281 D282	T276-K278 PolarHBondContact O-N 2.65Å; T276-K278 VanDerWaalsContact O-N 3.11Å; K278-H281 PolarHBondContact O-N 2.71Å; K278-D282 VanDerWaalsContact O-CG 3.31Å; K278-D282 PolarHBondContact O-N 3.47Å
279	E	94.3	Very high	93.7	Very high	82 Å²	82	64 Å²	64	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-42.2	177.8	-79.3	-178.1	-149.7	0	0	112.1	K247 I275 T276 H281 D282 I283	K247-E279 IonicContact NZ-OE2 3.83Å; K247-E279 PolarHBondContact NZ-OE2 3.18Å; I275-E279 HydrophobicContact CD1-CB 3.9Å; I275-E279 HydrophobicContact CG1-CB 3.68Å; T276-E279 PolarHBondContact O-N 3.04Å; T276-E279 WeakPolarHBondContact OG1-CB 3.37Å; T276-E279 WeakPolarHBondContact OG1-CG 3.44Å; T276-E279 PolarHBondContact OG1-N 2.89Å; E279-H281 VanDerWaalsContact C-N 3.33Å; E279-H281 PolarHBondContact O-N 2.88Å; E279-D282 PolarHBondContact O-N 3.14Å; E279-I283 WeakPolarHBondContact O-CB 3.49Å; E279-I283 WeakPolarHBondContact O-CD1 3.46Å; E279-I283 VanDerWaalsContact O-CG1 3.24Å; E279-I283 WeakPolarHBondContact O-CG1 3.46Å; E279-I283 PolarHBondContact O-N 3.22Å
280	A	94.3	Very high	93.7	Very high	11 Å²	11	66.5 Å²	66.5	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-44.5	174.5	0	0	0	0	0	111.9	L271 I275 T276 L277 S284	L271-A280 HydrophobicContact CD1-CB 3.79Å; I275-A280 HydrophobicContact CG2-CB 3.97Å; T276-A280 PolarHBondContact O-N 3.39Å; L277-A280 PolarHBondContact O-N 2.88Å; A280-S284 WeakPolarHBondContact O-CB 3.47Å; A280-S284 PolarHBondContact O-N 3.15Å; A280-S284 PolarHBondContact O-OG 3.38Å
281	H	94.7	Very high	93.7	Very high	98 Å²	98	66.5 Å²	66.5	45%	0.454	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-49.4	174.6	177.2	-82.7	0	0	0	111.8	L277 K278 E279 I283 S284 E285	L277-H281 VanDerWaalsContact O-CB 3.32Å; L277-H281 WeakPolarHBondContact O-CB 3.33Å; L277-H281 PolarHBondContact O-N 3.29Å; K278-H281 PolarHBondContact O-N 2.71Å; E279-H281 VanDerWaalsContact C-N 3.33Å; E279-H281 PolarHBondContact O-N 2.88Å; H281-I283 VanDerWaalsContact C-N 3.34Å; H281-I283 PolarHBondContact O-N 2.76Å; H281-S284 WeakPolarHBondContact CA-OG 3.22Å; H281-S284 PolarHBondContact O-N 3.35Å; H281-S284 PolarHBondContact O-OG 2.88Å; H281-E285 IonicContact CE1-OE2 3.74Å; H281-E285 PolarHBondContact CE1-OE2 3.05Å; H281-E285 VanDerWaalsContact O-CB 3.22Å; H281-E285 WeakPolarHBondContact O-CB 3.22Å; H281-E285 PolarHBondContact O-N 3.25Å
282	D	94.9	Very high	93.7	Very high	87 Å²	87	69 Å²	69	47%	0.465	34%	0.344	S	S	.	.	H	α-helix	trans	-64.7	-37.9	-176.7	-71	-14.8	0	0	0	112.3	K278 E279 G286	K278-D282 VanDerWaalsContact O-CG 3.31Å; K278-D282 PolarHBondContact O-N 3.47Å; E279-D282 PolarHBondContact O-N 3.14Å; D282-G286 PolarHBondContact O-N 3.3Å
283	I	92.8	Very high	93.7	Very high	19 Å²	19	71.2 Å²	71.2	10%	0.097	35%	0.352	C	S	.	.	H	α-helix	trans	-66.4	-52	175.1	-67.8	164.6	0	0	0	110.5	E245 K247 F248 I275 E279 H281 E285 G286 F287	E245-I283 HydrophobicContact CB-CG2 4.13Å; E245-I283 HydrophobicContact CG-CD1 4.29Å; E245-I283 HydrophobicContact CG-CG1 4.36Å; E245-I283 HydrophobicContact CG-CG2 3.83Å; K247-I283 HydrophobicContact CD-CD1 3.69Å; F248-I283 HydrophobicContact CE1-CG2 3.6Å; F248-I283 HydrophobicContact CZ-CG2 3.89Å; I275-I283 HydrophobicContact CD1-CD1 3.73Å; E279-I283 WeakPolarHBondContact O-CB 3.49Å; E279-I283 WeakPolarHBondContact O-CD1 3.46Å; E279-I283 VanDerWaalsContact O-CG1 3.24Å; E279-I283 WeakPolarHBondContact O-CG1 3.46Å; E279-I283 PolarHBondContact O-N 3.22Å; H281-I283 VanDerWaalsContact C-N 3.34Å; H281-I283 PolarHBondContact O-N 2.76Å; I283-E285 PolarHBondContact O-N 2.97Å; I283-G286 PolarHBondContact O-N 3.16Å; I283-F287 WeakPolarHBondContact O-CB 3.39Å; I283-F287 PolarHBondContact O-N 3.38Å
284	S	93.5	Very high	93.6	Very high	19 Å²	19	65.1 Å²	65.1	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-40.6	-178.1	56.9	0	0	0	0	112.6	A280 H281 F287 Q288	A280-S284 WeakPolarHBondContact O-CB 3.47Å; A280-S284 PolarHBondContact O-N 3.15Å; A280-S284 PolarHBondContact O-OG 3.38Å; H281-S284 WeakPolarHBondContact CA-OG 3.22Å; H281-S284 PolarHBondContact O-N 3.35Å; H281-S284 PolarHBondContact O-OG 2.88Å; S284-F287 WeakPolarHBondContact O-CB 3.35Å; S284-F287 PolarHBondContact O-N 3.39Å; S284-Q288 WeakPolarHBondContact O-CB 3.39Å; S284-Q288 PolarHBondContact O-N 2.95Å
285	E	94.2	Very high	93.3	Very high	62 Å²	62	60.5 Å²	60.5	29%	0.29	30%	0.301	S	S	.	.	H	α-helix	trans	-66.8	-42.3	176.4	-160.1	-161.2	160.7	0	0	110.9	H281 I283 F287 Q288 R289	H281-E285 IonicContact CE1-OE2 3.74Å; H281-E285 PolarHBondContact CE1-OE2 3.05Å; H281-E285 VanDerWaalsContact O-CB 3.22Å; H281-E285 WeakPolarHBondContact O-CB 3.22Å; H281-E285 PolarHBondContact O-N 3.25Å; I283-E285 PolarHBondContact O-N 2.97Å; E285-F287 VanDerWaalsContact C-N 3.27Å; E285-F287 PolarHBondContact O-N 3.29Å; E285-Q288 PolarHBondContact O-N 2.95Å; E285-R289 WeakPolarHBondContact O-CB 3.4Å; E285-R289 VanDerWaalsContact O-CG 3.29Å; E285-R289 WeakPolarHBondContact O-CG 3.34Å; E285-R289 PolarHBondContact O-N 3.44Å; E285-R289 IonicContact OE1-CZ 3.81Å; E285-R289 VanDerWaalsContact OE1-CZ 3.26Å; E285-R289 IonicContact OE1-NE 2.78Å; E285-R289 PolarHBondContact OE1-NE 3Å; E285-R289 IonicContact OE1-NH2 2.85Å; E285-R289 PolarHBondContact OE1-NH2 3.47Å; E285-R289 IonicContact OE2-CZ 3.02Å; E285-R289 IonicContact OE2-NH2 3.26Å; E285-R289 PolarHBondContact OE2-NH2 3.31Å
286	G	93	Very high	93	Very high	23 Å²	23	61.6 Å²	61.6	24%	0.237	30%	0.304	C	S	.	.	H	α-helix	trans	-55.7	-43.5	171.9	0	0	0	0	0	112.1	D282 I283 K290	D282-G286 PolarHBondContact O-N 3.3Å; I283-G286 PolarHBondContact O-N 3.16Å; G286-K290 WeakPolarHBondContact O-CB 3.15Å; G286-K290 PolarHBondContact O-N 3.41Å
287	F	93.3	Very high	92.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.7	-48.2	177.9	-171.2	-132.1	0	0	0	112.5	I240 C241 H244 F248 V267 I283 S284 E285 R289 K290 I291 V302	I240-F287 HydrophobicContact CG2-CE2 4.45Å; C241-F287 HydrophobicContact CB-CE1 4.41Å; C241-F287 HydrophobicContact CB-CE2 4.13Å; C241-F287 HydrophobicContact CB-CZ 3.56Å; C241-F287 VanDerWaalsContact SG-CZ 3.51Å; H244-F287 HydrophobicContact CB-CD2 3.83Å; H244-F287 HydrophobicContact CB-CE2 4.08Å; H244-F287 WeakPolarHBondContact CD2-CB 3.16Å; H244-F287 AromaticContact CD2-CD2 3.23Å; H244-F287 WeakPolarHBondContact CD2-CD2 3.2Å; H244-F287 AromaticContact CD2-CG 3.51Å; H244-F287 AromaticContact CG-CD2 3.54Å; H244-F287 VanDerWaalsContact NE2-CA 3.28Å; H244-F287 WeakPolarHBondContact NE2-CA 3.5Å; H244-F287 VanDerWaalsContact NE2-CB 3.34Å; H244-F287 WeakPolarHBondContact NE2-CB 3.38Å; H244-F287 AromaticContact NE2-CD2 3.92Å; H244-F287 PolarHBondContact NE2-N 3.12Å; F248-F287 HydrophobicContact CZ-CB 4.45Å; F248-F287 HydrophobicContact CZ-CD1 4.35Å; F248-F287 HydrophobicContact CZ-CG 4.29Å; V267-F287 HydrophobicContact CB-CE1 4.04Å; V267-F287 HydrophobicContact CG1-CE1 3.84Å; V267-F287 HydrophobicContact CG1-CZ 4.46Å; V267-F287 HydrophobicContact CG2-CE1 4.16Å; I283-F287 WeakPolarHBondContact O-CB 3.39Å; I283-F287 PolarHBondContact O-N 3.38Å; S284-F287 WeakPolarHBondContact O-CB 3.35Å; S284-F287 PolarHBondContact O-N 3.39Å; E285-F287 VanDerWaalsContact C-N 3.27Å; E285-F287 PolarHBondContact O-N 3.29Å; F287-R289 VanDerWaalsContact C-N 3.31Å; F287-R289 PolarHBondContact O-N 2.9Å; F287-K290 WeakPolarHBondContact O-CA 3.09Å; F287-K290 WeakPolarHBondContact O-CB 3.48Å; F287-K290 PolarHBondContact O-N 3.47Å; F287-I291 HydrophobicContact CD2-CG1 4.14Å; F287-I291 HydrophobicContact CE1-CG1 4.26Å; F287-I291 HydrophobicContact CE2-CD1 3.73Å; F287-I291 HydrophobicContact CE2-CG1 3.68Å; F287-I291 HydrophobicContact CZ-CD1 3.88Å; F287-I291 HydrophobicContact CZ-CG1 3.73Å; F287-I291 PolarHBondContact O-N 3.49Å; F287-V302 HydrophobicContact CD1-CB 4.4Å; F287-V302 HydrophobicContact CD1-CG1 3.88Å; F287-V302 HydrophobicContact CD1-CG2 3.56Å; F287-V302 HydrophobicContact CE1-CG2 4.15Å; F287-V302 HydrophobicContact CG-CG2 4.4Å
288	Q	95	Very high	92.7	Very high	47 Å²	47	53.7 Å²	53.7	22%	0.22	26%	0.258	C	S	.	.	H	α-helix	trans	-55.9	-49.1	177.8	-171	-164.5	-46.7	0	0	110	S284 E285 K290 I291 E292 A300 V302	S284-Q288 WeakPolarHBondContact O-CB 3.39Å; S284-Q288 PolarHBondContact O-N 2.95Å; E285-Q288 PolarHBondContact O-N 2.95Å; Q288-K290 VanDerWaalsContact C-N 3.33Å; Q288-K290 PolarHBondContact O-N 3.27Å; Q288-I291 PolarHBondContact O-N 3.06Å; Q288-E292 HydrophobicContact CG-CG 4.49Å; Q288-E292 PolarHBondContact NE2-OE1 2.8Å; Q288-E292 WeakPolarHBondContact O-CB 3.37Å; Q288-E292 WeakPolarHBondContact O-CG 3.16Å; Q288-E292 PolarHBondContact O-N 3.26Å; Q288-A300 HydrophobicContact CG-CB 4.14Å; Q288-A300 WeakPolarHBondContact CG-O 3.37Å; Q288-V302 HydrophobicContact CB-CG2 3.82Å; Q288-V302 HydrophobicContact CG-CG2 4.36Å
289	R	93	Very high	92.5	Very high	126 Å²	126	51.1 Å²	51.1	48%	0.475	24%	0.244	S	C	.	.	H	α-helix	trans	-58.3	-46.1	175.5	-68.5	-171.4	-132.2	134.2	-10.8	110.3	E285 F287 I291 E292 H293	E285-R289 WeakPolarHBondContact O-CB 3.4Å; E285-R289 VanDerWaalsContact O-CG 3.29Å; E285-R289 WeakPolarHBondContact O-CG 3.34Å; E285-R289 PolarHBondContact O-N 3.44Å; E285-R289 IonicContact OE1-CZ 3.81Å; E285-R289 VanDerWaalsContact OE1-CZ 3.26Å; E285-R289 IonicContact OE1-NE 2.78Å; E285-R289 PolarHBondContact OE1-NE 3Å; E285-R289 IonicContact OE1-NH2 2.85Å; E285-R289 PolarHBondContact OE1-NH2 3.47Å; E285-R289 IonicContact OE2-CZ 3.02Å; E285-R289 IonicContact OE2-NH2 3.26Å; E285-R289 PolarHBondContact OE2-NH2 3.31Å; F287-R289 VanDerWaalsContact C-N 3.31Å; F287-R289 PolarHBondContact O-N 2.9Å; R289-I291 VanDerWaalsContact C-N 3.33Å; R289-I291 PolarHBondContact O-N 3.33Å; R289-E292 PolarHBondContact O-N 3.5Å; R289-H293 PolarHBondContact O-N 3.12Å; R289-H293 PolarHBondContact O-ND1 3.44Å
290	K	91.8	Very high	92.6	Very high	52 Å²	52	47.2 Å²	47.2	23%	0.226	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-43.2	179.5	-172.5	-176.2	-179.8	-167.5	0	112.3	I240 G286 F287 Q288 H293	I240-K290 HydrophobicContact CG2-CD 4.13Å; I240-K290 HydrophobicContact CG2-CG 4.47Å; I240-K290 PolarHBondContact O-NZ 2.97Å; G286-K290 WeakPolarHBondContact O-CB 3.15Å; G286-K290 PolarHBondContact O-N 3.41Å; F287-K290 WeakPolarHBondContact O-CA 3.09Å; F287-K290 WeakPolarHBondContact O-CB 3.48Å; F287-K290 PolarHBondContact O-N 3.47Å; Q288-K290 VanDerWaalsContact C-N 3.33Å; Q288-K290 PolarHBondContact O-N 3.27Å; K290-H293 PolarHBondContact O-N 3.08Å
291	I	93.2	Very high	92.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-71.9	-43.1	178.8	-61.6	-61.6	0	0	0	111.6	I237 I240 V265 F287 Q288 R289 H293 L294 V297 A300	I237-I291 HydrophobicContact CG2-CD1 4.32Å; I240-I291 HydrophobicContact CB-CD1 4.22Å; I240-I291 HydrophobicContact CG2-CD1 3.6Å; V265-I291 HydrophobicContact CB-CG2 4.23Å; V265-I291 HydrophobicContact CG1-CG2 4.18Å; V265-I291 HydrophobicContact CG2-CG2 4.38Å; F287-I291 HydrophobicContact CD2-CG1 4.14Å; F287-I291 HydrophobicContact CE1-CG1 4.26Å; F287-I291 HydrophobicContact CE2-CD1 3.73Å; F287-I291 HydrophobicContact CE2-CG1 3.68Å; F287-I291 HydrophobicContact CZ-CD1 3.88Å; F287-I291 HydrophobicContact CZ-CG1 3.73Å; F287-I291 PolarHBondContact O-N 3.49Å; Q288-I291 PolarHBondContact O-N 3.06Å; R289-I291 VanDerWaalsContact C-N 3.33Å; R289-I291 PolarHBondContact O-N 3.33Å; I291-H293 PolarHBondContact O-N 2.91Å; I291-H293 VanDerWaalsContact O-N 3.17Å; I291-L294 HydrophobicContact CD1-CD1 4.33Å; I291-L294 HydrophobicContact CG2-CD1 4.4Å; I291-L294 VanDerWaalsContact O-CB 3.25Å; I291-L294 WeakPolarHBondContact O-CB 3.49Å; I291-L294 WeakPolarHBondContact O-CG 3.41Å; I291-L294 PolarHBondContact O-N 3.43Å; I291-V297 HydrophobicContact CG2-CG1 4.17Å; I291-V297 HydrophobicContact CG2-CG2 4.22Å; I291-A300 HydrophobicContact CB-CB 3.9Å; I291-A300 HydrophobicContact CG2-CB 3.63Å
292	E	93.2	Very high	92.6	Very high	56 Å²	56	46.7 Å²	46.7	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-18.6	176.3	-72.7	-176.5	-179.7	0	0	113.5	Q288 R289 L294 R299 A300	Q288-E292 HydrophobicContact CG-CG 4.49Å; Q288-E292 PolarHBondContact NE2-OE1 2.8Å; Q288-E292 WeakPolarHBondContact O-CB 3.37Å; Q288-E292 WeakPolarHBondContact O-CG 3.16Å; Q288-E292 PolarHBondContact O-N 3.26Å; R289-E292 PolarHBondContact O-N 3.5Å; E292-L294 PolarHBondContact O-N 2.96Å; E292-R299 WeakPolarHBondContact OE1-CD 3.49Å; E292-R299 IonicContact OE1-NE 2.78Å; E292-R299 PolarHBondContact OE1-NE 3.03Å; E292-A300 HydrophobicContact CG-CB 3.87Å; E292-A300 PolarHBondContact OE1-N 3.16Å
293	H	92	Very high	92.5	Very high	112 Å²	112	46 Å²	46	52%	0.519	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.3	172.8	-82.1	79.6	0	0	0	113.3	R40 R289 K290 I291	R40-H293 PolarHBondContact NH2-O 2.99Å; R289-H293 PolarHBondContact O-N 3.12Å; R289-H293 PolarHBondContact O-ND1 3.44Å; K290-H293 PolarHBondContact O-N 3.08Å; I291-H293 PolarHBondContact O-N 2.91Å; I291-H293 VanDerWaalsContact O-N 3.17Å
294	L	90.2	Very high	92.6	Very high	16 Å²	16	47.2 Å²	47.2	8%	0.084	23%	0.225	C	C	.	.	S	Bend	trans	-65.1	135.3	176.6	-63.4	171.1	0	0	0	110.3	I240 I291 E292 Y296 V297	I240-L294 HydrophobicContact CD1-CD1 3.92Å; I240-L294 HydrophobicContact CD1-CD2 4.14Å; I291-L294 HydrophobicContact CD1-CD1 4.33Å; I291-L294 HydrophobicContact CG2-CD1 4.4Å; I291-L294 VanDerWaalsContact O-CB 3.25Å; I291-L294 WeakPolarHBondContact O-CB 3.49Å; I291-L294 WeakPolarHBondContact O-CG 3.41Å; I291-L294 PolarHBondContact O-N 3.43Å; E292-L294 PolarHBondContact O-N 2.96Å; L294-Y296 HydrophobicContact CB-CE1 4.42Å; L294-Y296 HydrophobicContact CB-CE2 4.16Å; L294-Y296 HydrophobicContact CD1-CE2 4.11Å; L294-Y296 PolarHBondContact O-N 3.46Å; L294-Y296 VanDerWaalsContact O-N 3.14Å; L294-V297 HydrophobicContact CB-CB 4.21Å; L294-V297 HydrophobicContact CB-CG2 3.81Å; L294-V297 HydrophobicContact CD1-CG2 4.08Å; L294-V297 PolarHBondContact O-N 3.4Å; L294-V297 VanDerWaalsContact O-N 3.16Å
295	P	86.5	Confident	92.4	Very high	46 Å²	46	47.5 Å²	47.5	30%	0.299	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.4	-169	27.3	-35	0	0	0	114.6
296	Y	88.9	Confident	92.2	Very high	58 Å²	58	51.2 Å²	51.2	23%	0.227	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-3.4	179.7	50.1	-101.2	0	0	0	113	I233 N262 Y263 L294	I233-Y296 HydrophobicContact CG2-CD2 4.39Å; I233-Y296 HydrophobicContact CG2-CE2 3.97Å; N262-Y296 CarbonylContact C-O 3.44Å; N262-Y296 WeakPolarHBondContact CA-O 3.3Å; N262-Y296 WeakPolarHBondContact CB-O 3.4Å; Y263-Y296 AromaticContact CD2-CD2 3.91Å; Y263-Y296 HydrophobicContact CD2-CD2 3.91Å; Y263-Y296 HydrophobicContact CD2-CG 4.42Å; Y263-Y296 WeakPolarHBondContact CD2-O 3.31Å; Y263-Y296 HydrophobicContact CE2-CD2 4.47Å; Y263-Y296 PolarHBondContact N-O 3.15Å; L294-Y296 HydrophobicContact CB-CE1 4.42Å; L294-Y296 HydrophobicContact CB-CE2 4.16Å; L294-Y296 HydrophobicContact CD1-CE2 4.11Å; L294-Y296 PolarHBondContact O-N 3.46Å; L294-Y296 VanDerWaalsContact O-N 3.14Å
297	V	92.5	Very high	91.8	Very high	10 Å²	10	54 Å²	54	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.2	175.2	177.3	0	0	0	0	108.2	V265 I291 L294 R299	V265-V297 HydrophobicContact CG2-CB 4.49Å; V265-V297 HydrophobicContact CG2-CG1 3.95Å; V265-V297 HydrophobicContact CG2-CG2 3.77Å; I291-V297 HydrophobicContact CG2-CG1 4.17Å; I291-V297 HydrophobicContact CG2-CG2 4.22Å; L294-V297 HydrophobicContact CB-CB 4.21Å; L294-V297 HydrophobicContact CB-CG2 3.81Å; L294-V297 HydrophobicContact CD1-CG2 4.08Å; L294-V297 PolarHBondContact O-N 3.4Å; L294-V297 VanDerWaalsContact O-N 3.16Å; V297-R299 WeakPolarHBondContact CG1-O 3.34Å
298	E	89.6	Confident	91.2	Very high	50 Å²	50	58.5 Å²	58.5	23%	0.234	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-38.1	175.3	-176.5	157.1	174.7	0	0	111.5	R114 T117 N262 Y263	R114-E298 VanDerWaalsContact O-OE1 3.11Å; T117-E298 PolarHBondContact OG1-OE1 3.3Å; T117-E298 VanDerWaalsContact OG1-OE1 3.07Å; T117-E298 PolarHBondContact OG1-OE2 3.06Å; N262-E298 HydrophobicContact CB-CB 3.77Å; Y263-E298 PolarHBondContact O-N 3.49Å
299	R	92.3	Very high	90.3	Very high	99 Å²	99	63.3 Å²	63.3	37%	0.374	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	147.7	176.6	-169.4	80	-173.4	-127.1	-6.7	109.4	L264 V265 E292 V297	L264-R299 HydrophobicContact CD1-CB 3.67Å; L264-R299 HydrophobicContact CD1-CG 4.29Å; V265-R299 PolarHBondContact N-O 2.95Å; V265-R299 VanDerWaalsContact N-O 3.08Å; E292-R299 WeakPolarHBondContact OE1-CD 3.49Å; E292-R299 IonicContact OE1-NE 2.78Å; E292-R299 PolarHBondContact OE1-NE 3.03Å; V297-R299 WeakPolarHBondContact CG1-O 3.34Å
300	A	95.3	Very high	89.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.2	168.2	0	0	0	0	0	110	V265 Q288 I291 E292	V265-A300 HydrophobicContact CB-CB 4.42Å; V265-A300 CarbonylContact O-C 3.34Å; V265-A300 WeakPolarHBondContact O-CA 3.47Å; Q288-A300 HydrophobicContact CG-CB 4.14Å; Q288-A300 WeakPolarHBondContact CG-O 3.37Å; I291-A300 HydrophobicContact CB-CB 3.9Å; I291-A300 HydrophobicContact CG2-CB 3.63Å; E292-A300 HydrophobicContact CG-CB 3.87Å; E292-A300 PolarHBondContact OE1-N 3.16Å
301	F	94.9	Very high	88.4	Confident	73 Å²	73	64.4 Å²	64.4	32%	0.32	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.8	166	-61.1	-72.8	0	0	0	107.7	L264 V265 E266 V267	L264-F301 HydrophobicContact CD1-CD2 3.97Å; L264-F301 HydrophobicContact CD1-CE2 3.62Å; L264-F301 HydrophobicContact CD2-CE2 4.02Å; L264-F301 HydrophobicContact CG-CD2 4.3Å; L264-F301 HydrophobicContact CG-CE2 4.1Å; V265-F301 PolarHBondContact O-N 3.46Å; E266-F301 WeakPolarHBondContact CA-O 3.16Å; E266-F301 HydrophobicContact CG-CB 4.21Å; E266-F301 HydrophobicContact CG-CD2 3.86Å; V267-F301 PolarHBondContact N-O 3.47Å
302	V	95	Very high	87.1	Confident	26 Å²	26	67.3 Å²	67.3	16%	0.158	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.7	176.3	-178.2	0	0	0	0	105.9	V267 V269 F287 Q288 V304	V267-V302 CarbonylContact O-C 3.55Å; V267-V302 VanDerWaalsContact O-CA 3.31Å; V267-V302 WeakPolarHBondContact O-CA 3.21Å; V269-V302 HydrophobicContact CG2-CG1 4.16Å; F287-V302 HydrophobicContact CD1-CB 4.4Å; F287-V302 HydrophobicContact CD1-CG1 3.88Å; F287-V302 HydrophobicContact CD1-CG2 3.56Å; F287-V302 HydrophobicContact CE1-CG2 4.15Å; F287-V302 HydrophobicContact CG-CG2 4.4Å; Q288-V302 HydrophobicContact CB-CG2 3.82Å; Q288-V302 HydrophobicContact CG-CG2 4.36Å; V302-V304 HydrophobicContact CG1-CG2 4.3Å
303	H	93.6	Very high	85.9	Confident	71 Å²	71	70.1 Å²	70.1	33%	0.329	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.1	169.1	-166.9	72.4	0	0	0	108.4	V267 H268 V269 D305 E315	V267-H303 PolarHBondContact O-N 2.79Å; H268-H303 WeakPolarHBondContact CA-O 3.47Å; H268-H303 HydrophobicContact CB-CB 4.38Å; H268-H303 VanDerWaalsContact CD2-CB 3.47Å; H268-H303 WeakPolarHBondContact CD2-CB 3.5Å; V269-H303 PolarHBondContact N-O 3.3Å; H303-D305 IonicContact CD2-OD1 3.77Å; H303-D305 IonicContact CD2-OD2 2.99Å; H303-D305 PolarHBondContact CD2-OD2 3.01Å; H303-D305 IonicContact NE2-OD1 3.74Å; H303-D305 PolarHBondContact NE2-OD1 2.88Å; H303-D305 IonicContact NE2-OD2 3.65Å; H303-E315 IonicContact CD2-OE1 3.81Å; H303-E315 PolarHBondContact CD2-OE1 2.86Å; H303-E315 VanDerWaalsContact CD2-OE1 3.3Å; H303-E315 IonicContact CE1-OE1 3.71Å; H303-E315 IonicContact CG-OE1 3.17Å; H303-E315 IonicContact ND1-OE1 3.75Å; H303-E315 IonicContact NE2-OE1 3.17Å; H303-E315 PolarHBondContact NE2-OE1 3.28Å
304	V	92.9	Very high	84.9	Confident	45 Å²	45	73.5 Å²	73.5	27%	0.273	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	119.9	-177.5	178.9	0	0	0	0	107.9	V269 L271 V302	V269-V304 HydrophobicContact CG2-CG2 4.04Å; V269-V304 WeakPolarHBondContact O-CA 3.27Å; L271-V304 HydrophobicContact CB-CG1 4.14Å; L271-V304 HydrophobicContact CD1-CG1 3.51Å; L271-V304 HydrophobicContact CG-CG1 3.81Å; V302-V304 HydrophobicContact CG1-CG2 4.3Å
305	D	91.2	Very high	83.9	Confident	26 Å²	26	75.8 Å²	75.8	14%	0.139	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	161.7	175.2	-76.1	-49.1	0	0	0	111.2	V269 V270 L271 H303 H310	V269-D305 PolarHBondContact O-N 3.43Å; V270-D305 CarbonylContact C-O 3.55Å; V270-D305 VanDerWaalsContact CA-O 3.28Å; V270-D305 WeakPolarHBondContact CA-O 3.46Å; V270-D305 HydrophobicContact CG2-CB 4.45Å; L271-D305 PolarHBondContact N-O 3.46Å; H303-D305 IonicContact CD2-OD1 3.77Å; H303-D305 IonicContact CD2-OD2 2.99Å; H303-D305 PolarHBondContact CD2-OD2 3.01Å; H303-D305 IonicContact NE2-OD1 3.74Å; H303-D305 PolarHBondContact NE2-OD1 2.88Å; H303-D305 IonicContact NE2-OD2 3.65Å; D305-H310 IonicContact OD2-NE2 2.72Å
306	Y	89.7	Confident	83.2	Confident	140 Å²	140	77.2 Å²	77.2	55%	0.549	35%	0.345	S	S	.	.	S	Bend	trans	-109.9	-18.4	169.8	67.8	-91	0	0	0	112.3	L271 E273	L271-Y306 WeakPolarHBondContact O-CA 3.36Å; E273-Y306 HydrophobicContact CB-CD2 4.49Å; E273-Y306 HydrophobicContact CG-CD2 4.15Å; E273-Y306 HydrophobicContact CG-CG 4.44Å
307	E	84.1	Confident	82.7	Confident	82 Å²	82	83.5 Å²	83.5	38%	0.383	37%	0.374	S	S	.	.			trans	-106.3	155.9	179.8	-171.7	168.9	-170.5	0	0	109.9	E309 H310	E307-E309 HydrophobicContact CG-CB 4.46Å; E307-H310 PolarHBondContact O-CE1 2.86Å
308	F	79.5	Confident	81.6	Confident	93 Å²	93	89.1 Å²	89.1	41%	0.408	40%	0.402	S	S	.	.			trans	-132.7	1.2	-179.3	59.5	-98.7	0	0	0	113.6	V270	V270-F308 HydrophobicContact CG2-CB 4.35Å
309	E	77	Confident	80.5	Confident	149 Å²	149	95.9 Å²	95.9	70%	0.696	45%	0.446	S	S	*	.	S	Bend	trans	-87.2	-18.9	-174.2	-63.4	-166.9	175.1	0	0	112.5	E307	E307-E309 HydrophobicContact CG-CB 4.46Å
310	H	75.4	Confident	79.9	Confident	47 Å²	47	95.8 Å²	95.8	22%	0.218	45%	0.45	C	S	.	.	S	Bend	trans	-71.8	145.5	175.5	60.7	-72.5	0	0	0	111.3	E252 D305 E307	E252-H310 IonicContact OE1-CE1 3.98Å; E252-H310 IonicContact OE2-NE2 3.34Å; D305-H310 IonicContact OD2-NE2 2.72Å; E307-H310 PolarHBondContact O-CE1 2.86Å
311	R	69.1	Low	79.1	Confident	154 Å²	154	100.8 Å²	100.8	58%	0.581	47%	0.474	S	S	*	.			trans	-78	142.1	167.5	-59.7	-173.9	176.4	-171.6	0.1	109.3	E313 Y314	R311-E313 PolarHBondContact O-N 2.97Å; R311-Y314 HydrophobicContact CB-CD2 3.63Å; R311-Y314 HydrophobicContact CB-CE2 3.77Å; R311-Y314 HydrophobicContact CG-CD2 4.27Å; R311-Y314 HydrophobicContact CG-CE2 3.95Å; R311-Y314 PolarHBondContact O-N 2.87Å
312	P	66.4	Low	78.2	Confident	60 Å²	60	102.3 Å²	102.3	39%	0.39	48%	0.482	S	S	.	.	H	α-helix	trans	-53.1	-28.4	175.6	-26.1	32.9	0	0	0	113.9	Y314 E315 H316	P312-Y314 PolarHBondContact O-N 3.2Å; P312-E315 PolarHBondContact O-N 2.99Å; P312-H316 PolarHBondContact O-N 3.25Å; P312-H316 VanDerWaalsContact O-N 3.07Å
313	E	68.2	Low	77.2	Confident	115 Å²	115	106.8 Å²	106.8	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-21.7	178.9	-56.6	170.9	176	0	0	113.9	R311 I318	R311-E313 PolarHBondContact O-N 2.97Å; E313-I318 HydrophobicContact CB-CD1 4.14Å; E313-I318 HydrophobicContact CG-CD1 4.02Å
314	Y	70.6	Confident	76.2	Confident	183 Å²	183	109.1 Å²	109.1	72%	0.718	51%	0.512	S	S	*	.	H	α-helix	trans	-86	-29.9	178	-67	-69.7	0	0	0	112.6	R311 P312	R311-Y314 HydrophobicContact CB-CD2 3.63Å; R311-Y314 HydrophobicContact CB-CE2 3.77Å; R311-Y314 HydrophobicContact CG-CD2 4.27Å; R311-Y314 HydrophobicContact CG-CE2 3.95Å; R311-Y314 PolarHBondContact O-N 2.87Å; P312-Y314 PolarHBondContact O-N 3.2Å
315	E	70.3	Confident	75.1	Confident	64 Å²	64	113.3 Å²	113.3	30%	0.299	53%	0.528	S	S	.	.	H	α-helix	trans	-82.9	-39.1	179.7	-161.9	-150.2	143.5	0	0	110.9	H268 H303 P312	H268-E315 IonicContact CE1-OE2 3.56Å; H268-E315 IonicContact ND1-OE2 3.52Å; H303-E315 IonicContact CD2-OE1 3.81Å; H303-E315 PolarHBondContact CD2-OE1 2.86Å; H303-E315 VanDerWaalsContact CD2-OE1 3.3Å; H303-E315 IonicContact CE1-OE1 3.71Å; H303-E315 IonicContact CG-OE1 3.17Å; H303-E315 IonicContact ND1-OE1 3.75Å; H303-E315 IonicContact NE2-OE1 3.17Å; H303-E315 PolarHBondContact NE2-OE1 3.28Å; P312-E315 PolarHBondContact O-N 2.99Å
316	H	71.4	Confident	73.9	Confident	77 Å²	77	119.6 Å²	119.6	36%	0.356	56%	0.556	S	S	.	*	S	Bend	trans	-109.9	125.9	-178.1	-64.9	-75.5	0	0	0	111.4	H268 P312 I318	H268-H316 AromaticContact CE1-CD2 3.52Å; H268-H316 AromaticContact CE1-CE1 3.7Å; H268-H316 AromaticContact CE1-NE2 2.98Å; H268-H316 PolarHBondContact CE1-NE2 3.16Å; H268-H316 AromaticContact ND1-NE2 3.81Å; H268-H316 AromaticContact NE2-NE2 3.78Å; P312-H316 PolarHBondContact O-N 3.25Å; P312-H316 VanDerWaalsContact O-N 3.07Å; H316-I318 PolarHBondContact O-N 2.94Å; H316-I318 VanDerWaalsContact O-N 3.09Å
317	K	78.6	Confident	72.7	Confident	190 Å²	190	118 Å²	118	83%	0.826	56%	0.556	S	S	*	*			trans	-61.5	115.2	168.4	-177.3	179.5	179.5	-179	0	109.2	V319	K317-V319 PolarHBondContact O-N 3.49Å
318	I	69	Low	71.8	Confident	128 Å²	128	121 Å²	121	66%	0.656	57%	0.571	S	S	*	*			trans	-64.7	120.7	169	-52.2	171.8	0	0	0	107.5	E313 H316	E313-I318 HydrophobicContact CB-CD1 4.14Å; E313-I318 HydrophobicContact CG-CD1 4.02Å; H316-I318 PolarHBondContact O-N 2.94Å; H316-I318 VanDerWaalsContact O-N 3.09Å
319	V	66	Low	71.1	Confident	192 Å²	192	123.5 Å²	123.5	100%	1.164	59%	0.586	S	S	*	*			trans	-100.2	0	175.8	-173.2	0	0	0	0	110	K317	K317-V319 PolarHBondContact O-N 3.49Å

Retrieved 319 of 319 residues in 215.1 ms (Link to these results)

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