A0A077Z4P0_TRITR Loading...

Ion transport domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z4P0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 175 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	45.6	Very low	52	Low	230 Å²	230	116.2 Å²	116.2	100%	1.133	70%	0.703	S	S	*	*				0	89.4	0	-60.2	163.7	98.9	0	0	106.2
2	N	53.3	Low	51.7	Low	120 Å²	120	118.7 Å²	118.7	64%	0.642	70%	0.702	S	S	*	*				-177.7	41.1	99.6	-82.1	-12.5	0	0	0	112.4	T4 A5	N2-T4 PolarHBondContact O-N 3.04Å; N2-A5 PolarHBondContact O-N 3Å
3	S	53.9	Low	51.4	Low	105 Å²	105	124.5 Å²	124.5	73%	0.734	71%	0.713	S	S	*	*	H	α-helix	trans	-73.1	-14.9	172.8	-65.6	0	0	0	0	113.5	A5	S3-A5 VanDerWaalsContact C-N 3.35Å
4	T	56.7	Low	51.3	Low	119 Å²	119	125.9 Å²	125.9	73%	0.73	72%	0.716	S	S	*	*	H	α-helix	trans	-78.6	-16.3	176.1	48.6	0	0	0	0	113.5	N2 S8	N2-T4 PolarHBondContact O-N 3.04Å; T4-S8 PolarHBondContact O-N 3.15Å
5	A	52.9	Low	51.4	Low	56 Å²	56	123.1 Å²	123.1	46%	0.463	71%	0.705	S	S	.	*	H	α-helix	trans	-75.3	-32.9	178.5	0	0	0	0	0	112.5	N2 S3 L7 S8 S9	N2-A5 PolarHBondContact O-N 3Å; S3-A5 VanDerWaalsContact C-N 3.35Å; A5-L7 PolarHBondContact O-N 3.46Å; A5-S8 PolarHBondContact O-N 2.72Å; A5-S9 PolarHBondContact O-N 3.12Å
6	I	51.4	Low	51.5	Low	129 Å²	129	122.6 Å²	122.6	66%	0.662	71%	0.707	S	S	*	*	H	α-helix	trans	-69.7	-37.5	-175.4	-50.2	179.4	0	0	0	110.5	S9	I6-S9 PolarHBondContact O-OG 2.71Å
7	L	52.5	Low	51.7	Low	145 Å²	145	121.9 Å²	121.9	76%	0.759	71%	0.708	S	S	*	*	H	α-helix	trans	-81.2	-26.3	177.5	-75.1	166	0	0	0	113.5	A5 S9	A5-L7 PolarHBondContact O-N 3.46Å; L7-S9 VanDerWaalsContact C-N 3.35Å
8	S	52.9	Low	51.9	Low	69 Å²	69	119.3 Å²	119.3	48%	0.483	70%	0.703	S	S	.	*	H	α-helix	trans	-72.8	-27.9	175.6	-160.9	0	0	0	0	112.6	T4 A5 S10 S11	T4-S8 PolarHBondContact O-N 3.15Å; A5-S8 PolarHBondContact O-N 2.72Å; S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 2.77Å; S8-S11 PolarHBondContact O-N 3.42Å
9	S	51.7	Low	52	Low	94 Å²	94	124.8 Å²	124.8	66%	0.657	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-15.9	179.7	85.4	0	0	0	0	114.1	A5 I6 L7	A5-S9 PolarHBondContact O-N 3.12Å; I6-S9 PolarHBondContact O-OG 2.71Å; L7-S9 VanDerWaalsContact C-N 3.35Å
10	S	51	Low	52	Low	108 Å²	108	124.8 Å²	124.8	76%	0.755	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-9.5	179.8	-161.5	0	0	0	0	113.8	S8	S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 2.77Å
11	S	50.7	Low	52.4	Low	103 Å²	103	121.8 Å²	121.8	72%	0.72	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-24.4	-174.6	-169.1	0	0	0	0	113.3	S8	S8-S11 PolarHBondContact O-N 3.42Å
12	E	48.1	Very low	54	Low	146 Å²	146	116.9 Å²	116.9	68%	0.682	67%	0.672	S	S	*	*	S	Bend	trans	-99.5	126.2	179.6	-83.5	-176.3	120.3	0	0	111.3
13	K	47.8	Very low	55.6	Low	194 Å²	194	115.9 Å²	115.9	84%	0.843	67%	0.672	S	S	*	*			trans	93.5	59.6	178.1	-51.7	170.4	-175	-177.3	0	114.3	P15	K13-P15 WeakPolarHBondContact O-CD 3.33Å
14	L	50.2	Low	57.1	Low	144 Å²	144	117.3 Å²	117.3	75%	0.754	67%	0.671	S	S	*	*			trans	-61.9	111.7	134.1	-166.3	72.5	0	0	0	105.4
15	P	52.2	Low	58.4	Low	85 Å²	85	115.2 Å²	115.2	55%	0.552	65%	0.652	S	S	*	*			trans	-57.3	151.7	-174.2	23	-32.6	0	0	0	110.3	K13	K13-P15 WeakPolarHBondContact O-CD 3.33Å
16	P	53.3	Low	59.8	Low	114 Å²	114	113.9 Å²	113.9	74%	0.74	64%	0.641	S	S	*	*	S	Bend	trans	-48.6	131.1	175.1	22.1	-33	0	0	0	108.2	A18	P16-A18 PolarHBondContact O-N 3.29Å
17	P	55.1	Low	61.4	Low	111 Å²	111	113.7 Å²	113.7	72%	0.721	64%	0.639	S	S	*	*			trans	-56.1	103.9	-161	21.5	-33.2	0	0	0	109.2	R19	P17-R19 PolarHBondContact O-N 3.42Å
18	A	55.1	Low	63	Low	75 Å²	75	109 Å²	109	62%	0.62	62%	0.622	S	S	*	*			trans	-67.8	83.6	172.2	0	0	0	0	0	106.7	P16 L20 A21	P16-A18 PolarHBondContact O-N 3.29Å; A18-L20 PolarHBondContact O-N 3.48Å; A18-L20 VanDerWaalsContact O-N 3.12Å; A18-A21 PolarHBondContact O-N 3.06Å
19	R	52.8	Low	64.4	Low	225 Å²	225	109.5 Å²	109.5	85%	0.849	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.1	45.8	161.3	-69.3	-173.9	-91.4	172.3	-11	116.7	P17 A21	P17-R19 PolarHBondContact O-N 3.42Å; R19-A21 WeakPolarHBondContact O-CA 3.43Å; R19-A21 PolarHBondContact O-N 3.22Å
20	L	52.5	Low	66	Low	124 Å²	124	110 Å²	110	65%	0.649	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.3	30.2	171.1	-74.1	148.2	0	0	0	112.5	A18 H22 A26	A18-L20 PolarHBondContact O-N 3.48Å; A18-L20 VanDerWaalsContact O-N 3.12Å; L20-H22 PolarHBondContact O-N 2.96Å; L20-H22 VanDerWaalsContact O-N 3.12Å; L20-A26 HydrophobicContact CD2-CB 4.3Å
21	A	60.4	Low	67.6	Low	61 Å²	61	111.7 Å²	111.7	50%	0.504	60%	0.602	S	S	.	*			trans	-72.9	-25.1	-146.6	0	0	0	0	0	111.9	A18 R19	A18-A21 PolarHBondContact O-N 3.06Å; R19-A21 WeakPolarHBondContact O-CA 3.43Å; R19-A21 PolarHBondContact O-N 3.22Å
22	H	79.3	Confident	69.3	Low	128 Å²	128	111 Å²	111	59%	0.593	59%	0.588	S	S	*	*			trans	-103.8	119	177	-60.8	-62.4	0	0	0	109.7	L20 L24 E25 A26	L20-H22 PolarHBondContact O-N 2.96Å; L20-H22 VanDerWaalsContact O-N 3.12Å; H22-L24 PolarHBondContact O-N 2.98Å; H22-L24 VanDerWaalsContact O-N 3.1Å; H22-E25 HydrophobicContact CB-CB 4.44Å; H22-E25 WeakPolarHBondContact O-CB 3.09Å; H22-E25 PolarHBondContact O-N 3.48Å; H22-A26 PolarHBondContact O-N 2.93Å
23	P	86.2	Confident	71	Confident	99 Å²	99	104.7 Å²	104.7	64%	0.643	56%	0.56	S	S	*	*	H	α-helix	trans	-56.5	-30.3	178.3	22.5	-33.2	0	0	0	111.9	E25 A26 M27	P23-E25 PolarHBondContact O-N 3.17Å; P23-A26 PolarHBondContact O-N 3.07Å; P23-M27 VanDerWaalsContact O-CG 3.28Å; P23-M27 WeakPolarHBondContact O-CG 3.16Å; P23-M27 PolarHBondContact O-N 3.37Å
24	L	85.7	Confident	72.7	Confident	134 Å²	134	99.3 Å²	99.3	70%	0.702	54%	0.54	S	S	*	.	H	α-helix	trans	-60.3	-40.5	175.3	-169.4	80.1	0	0	0	113	H22 M27 A28	H22-L24 PolarHBondContact O-N 2.98Å; H22-L24 VanDerWaalsContact O-N 3.1Å; L24-M27 PolarHBondContact O-N 2.83Å; L24-A28 WeakPolarHBondContact O-CB 3.46Å; L24-A28 PolarHBondContact O-N 3.34Å
25	E	83.6	Confident	74.4	Confident	75 Å²	75	97.4 Å²	97.4	35%	0.35	53%	0.534	S	S	.	.	H	α-helix	trans	-69.4	-38.6	-179.7	-170.6	-173.8	163.3	0	0	110.8	H22 P23 A28 R29	H22-E25 HydrophobicContact CB-CB 4.44Å; H22-E25 WeakPolarHBondContact O-CB 3.09Å; H22-E25 PolarHBondContact O-N 3.48Å; P23-E25 PolarHBondContact O-N 3.17Å; E25-A28 PolarHBondContact O-N 2.68Å; E25-R29 WeakPolarHBondContact O-CB 3.39Å; E25-R29 WeakPolarHBondContact O-CG 3.2Å; E25-R29 PolarHBondContact O-N 3.28Å; E25-R29 IonicContact OE1-CZ 2.86Å; E25-R29 IonicContact OE1-NH1 2.68Å; E25-R29 PolarHBondContact OE1-NH1 3.23Å; E25-R29 IonicContact OE1-NH2 2.98Å; E25-R29 PolarHBondContact OE1-NH2 3.5Å
26	A	83.2	Confident	75.8	Confident	28 Å²	28	95.2 Å²	95.2	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-63.9	-43.4	172.9	0	0	0	0	0	111.3	L20 H22 P23 R29 L30	L20-A26 HydrophobicContact CD2-CB 4.3Å; H22-A26 PolarHBondContact O-N 2.93Å; P23-A26 PolarHBondContact O-N 3.07Å; A26-R29 PolarHBondContact O-N 3.36Å; A26-L30 VanDerWaalsContact O-CG 3.3Å; A26-L30 WeakPolarHBondContact O-CG 3.4Å; A26-L30 PolarHBondContact O-N 2.86Å
27	M	85.8	Confident	77.3	Confident	126 Å²	126	94.9 Å²	94.9	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-45.1	175.2	-70.7	174.1	69.7	0	0	112.2	P23 L24 R29 L30 F31	P23-M27 VanDerWaalsContact O-CG 3.28Å; P23-M27 WeakPolarHBondContact O-CG 3.16Å; P23-M27 PolarHBondContact O-N 3.37Å; L24-M27 PolarHBondContact O-N 2.83Å; M27-R29 VanDerWaalsContact C-N 3.34Å; M27-R29 PolarHBondContact O-N 3.49Å; M27-L30 PolarHBondContact O-N 3.44Å; M27-F31 WeakPolarHBondContact O-CB 3.26Å; M27-F31 PolarHBondContact O-N 2.97Å
28	A	85.2	Confident	78.5	Confident	47 Å²	47	91.8 Å²	91.8	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-41.3	177.5	0	0	0	0	0	111.8	L24 E25 F31 M32	L24-A28 WeakPolarHBondContact O-CB 3.46Å; L24-A28 PolarHBondContact O-N 3.34Å; E25-A28 PolarHBondContact O-N 2.68Å; A28-F31 WeakPolarHBondContact O-CB 3.43Å; A28-F31 PolarHBondContact O-N 3.1Å; A28-M32 WeakPolarHBondContact O-CG 3.21Å; A28-M32 PolarHBondContact O-N 3.47Å
29	R	82.3	Confident	79.6	Confident	79 Å²	79	94.1 Å²	94.1	30%	0.298	49%	0.489	S	S	.	.	H	α-helix	trans	-62.6	-43.8	174.1	-76.8	178.9	173.6	128.9	4.5	112.2	E25 A26 M27 F31 M32 V33	E25-R29 WeakPolarHBondContact O-CB 3.39Å; E25-R29 WeakPolarHBondContact O-CG 3.2Å; E25-R29 PolarHBondContact O-N 3.28Å; E25-R29 IonicContact OE1-CZ 2.86Å; E25-R29 IonicContact OE1-NH1 2.68Å; E25-R29 PolarHBondContact OE1-NH1 3.23Å; E25-R29 IonicContact OE1-NH2 2.98Å; E25-R29 PolarHBondContact OE1-NH2 3.5Å; A26-R29 PolarHBondContact O-N 3.36Å; M27-R29 VanDerWaalsContact C-N 3.34Å; M27-R29 PolarHBondContact O-N 3.49Å; R29-F31 VanDerWaalsContact C-N 3.29Å; R29-F31 PolarHBondContact O-N 3.12Å; R29-M32 PolarHBondContact O-N 3.22Å; R29-V33 WeakPolarHBondContact O-CB 3.22Å; R29-V33 WeakPolarHBondContact O-CG2 3.34Å; R29-V33 PolarHBondContact O-N 3.44Å
30	L	84.6	Confident	80.7	Confident	105 Å²	105	88.2 Å²	88.2	55%	0.55	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-39.5	175.4	-70.6	171.2	0	0	0	111.1	A26 M27 V33 N34	A26-L30 VanDerWaalsContact O-CG 3.3Å; A26-L30 WeakPolarHBondContact O-CG 3.4Å; A26-L30 PolarHBondContact O-N 2.86Å; M27-L30 PolarHBondContact O-N 3.44Å; L30-V33 PolarHBondContact O-N 3.44Å; L30-N34 PolarHBondContact O-N 3.49Å; L30-N34 PolarHBondContact O-ND2 3.48Å
31	F	86.4	Confident	81.9	Confident	143 Å²	143	85.2 Å²	85.2	63%	0.627	46%	0.457	S	S	*	.	H	α-helix	trans	-63.6	-48.7	175.6	-176.5	-100.9	0	0	0	111.9	M27 A28 R29 V33 N34 V35	M27-F31 WeakPolarHBondContact O-CB 3.26Å; M27-F31 PolarHBondContact O-N 2.97Å; A28-F31 WeakPolarHBondContact O-CB 3.43Å; A28-F31 PolarHBondContact O-N 3.1Å; R29-F31 VanDerWaalsContact C-N 3.29Å; R29-F31 PolarHBondContact O-N 3.12Å; F31-V33 VanDerWaalsContact C-N 3.29Å; F31-V33 PolarHBondContact O-N 2.94Å; F31-N34 WeakPolarHBondContact O-CB 3.27Å; F31-N34 PolarHBondContact O-N 3.09Å; F31-N34 VanDerWaalsContact O-N 3.1Å; F31-V35 HydrophobicContact CD1-CG2 4.12Å; F31-V35 HydrophobicContact CE1-CG2 3.73Å; F31-V35 HydrophobicContact CE2-CG2 4.49Å; F31-V35 HydrophobicContact CZ-CG2 3.93Å; F31-V35 WeakPolarHBondContact O-CG2 3.46Å; F31-V35 PolarHBondContact O-N 3.34Å
32	M	85.9	Confident	82.8	Confident	87 Å²	87	85 Å²	85	43%	0.429	44%	0.444	S	S	.	.	H	α-helix	trans	-57.6	-41.7	176	-76.5	172.4	168.8	0	0	112.2	A28 R29 N34 V35 G36 E37	A28-M32 WeakPolarHBondContact O-CG 3.21Å; A28-M32 PolarHBondContact O-N 3.47Å; R29-M32 PolarHBondContact O-N 3.22Å; M32-N34 PolarHBondContact O-N 3.35Å; M32-V35 PolarHBondContact O-N 3.37Å; M32-V35 VanDerWaalsContact O-N 3.17Å; M32-G36 PolarHBondContact O-N 3.01Å; M32-E37 HydrophobicContact CB-CB 4.35Å; M32-E37 WeakPolarHBondContact O-CA 3.48Å; M32-E37 PolarHBondContact O-N 3.26Å
33	V	83.6	Confident	82.9	Confident	15 Å²	15	86.6 Å²	86.6	9%	0.091	45%	0.449	C	S	.	.	H	α-helix	trans	-59.6	-46.9	174.9	167.9	0	0	0	0	110.8	R29 L30 F31 V35 G36 F38 L41 F58	R29-V33 WeakPolarHBondContact O-CB 3.22Å; R29-V33 WeakPolarHBondContact O-CG2 3.34Å; R29-V33 PolarHBondContact O-N 3.44Å; L30-V33 PolarHBondContact O-N 3.44Å; F31-V33 VanDerWaalsContact C-N 3.29Å; F31-V33 PolarHBondContact O-N 2.94Å; V33-V35 VanDerWaalsContact C-N 3.29Å; V33-V35 PolarHBondContact O-N 3.38Å; V33-G36 PolarHBondContact O-N 2.89Å; V33-F38 HydrophobicContact CG1-CB 4.27Å; V33-F38 HydrophobicContact CG2-CB 4.29Å; V33-L41 HydrophobicContact CG2-CB 4.12Å; V33-L41 HydrophobicContact CG2-CD1 3.91Å; V33-F58 HydrophobicContact CG1-CE2 3.52Å; V33-F58 HydrophobicContact CG1-CZ 3.76Å
34	N	83.7	Confident	82.5	Confident	81 Å²	81	86.4 Å²	86.4	43%	0.433	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-28	176.1	-77.9	-77.5	0	0	0	113.6	L30 F31 M32 G36	L30-N34 PolarHBondContact O-N 3.49Å; L30-N34 PolarHBondContact O-ND2 3.48Å; F31-N34 WeakPolarHBondContact O-CB 3.27Å; F31-N34 PolarHBondContact O-N 3.09Å; F31-N34 VanDerWaalsContact O-N 3.1Å; M32-N34 PolarHBondContact O-N 3.35Å; N34-G36 PolarHBondContact O-N 3Å
35	V	84.6	Confident	82	Confident	104 Å²	104	81.9 Å²	81.9	63%	0.63	42%	0.422	S	S	*	.	H	α-helix	trans	-73	-16.4	174.5	172.3	0	0	0	0	111.6	F31 M32 V33	F31-V35 HydrophobicContact CD1-CG2 4.12Å; F31-V35 HydrophobicContact CE1-CG2 3.73Å; F31-V35 HydrophobicContact CE2-CG2 4.49Å; F31-V35 HydrophobicContact CZ-CG2 3.93Å; F31-V35 WeakPolarHBondContact O-CG2 3.46Å; F31-V35 PolarHBondContact O-N 3.34Å; M32-V35 PolarHBondContact O-N 3.37Å; M32-V35 VanDerWaalsContact O-N 3.17Å; V33-V35 VanDerWaalsContact C-N 3.29Å; V33-V35 PolarHBondContact O-N 3.38Å
36	G	82.7	Confident	81.8	Confident	38 Å²	38	83.1 Å²	83.1	39%	0.392	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.7	2.9	-177.3	0	0	0	0	0	113.9	M32 V33 N34 F38	M32-G36 PolarHBondContact O-N 3.01Å; V33-G36 PolarHBondContact O-N 2.89Å; N34-G36 PolarHBondContact O-N 3Å; G36-F38 WeakPolarHBondContact O-CD1 3.48Å; G36-F38 PolarHBondContact O-N 2.92Å
37	E	84.7	Confident	81.6	Confident	107 Å²	107	87.8 Å²	87.8	50%	0.5	46%	0.457	S	S	.	.			trans	-92.2	65.8	176.8	-162.1	-175.9	169.4	0	0	111.3	M32	M32-E37 HydrophobicContact CB-CB 4.35Å; M32-E37 WeakPolarHBondContact O-CA 3.48Å; M32-E37 PolarHBondContact O-N 3.26Å
38	F	79.5	Confident	81.2	Confident	47 Å²	47	85 Å²	85	21%	0.206	45%	0.449	C	S	.	.			trans	-96.7	2	-176.3	50.9	-114.1	0	0	0	114.5	V33 G36 I40 L41 Y42 F58	V33-F38 HydrophobicContact CG1-CB 4.27Å; V33-F38 HydrophobicContact CG2-CB 4.29Å; G36-F38 WeakPolarHBondContact O-CD1 3.48Å; G36-F38 PolarHBondContact O-N 2.92Å; F38-I40 PolarHBondContact O-N 3.33Å; F38-I40 VanDerWaalsContact O-N 3.08Å; F38-L41 WeakPolarHBondContact O-CA 3.35Å; F38-L41 WeakPolarHBondContact O-CB 3.3Å; F38-L41 PolarHBondContact O-N 2.61Å; F38-Y42 HydrophobicContact CB-CD2 4.02Å; F38-Y42 HydrophobicContact CB-CE2 3.95Å; F38-Y42 HydrophobicContact CD1-CE2 4.39Å; F38-Y42 AromaticContact CD2-CD2 3.18Å; F38-Y42 HydrophobicContact CD2-CD2 3.18Å; F38-Y42 AromaticContact CD2-CE2 2.89Å; F38-Y42 HydrophobicContact CD2-CE2 2.89Å; F38-Y42 HydrophobicContact CD2-CG 4.28Å; F38-Y42 AromaticContact CD2-CZ 3.84Å; F38-Y42 AromaticContact CE2-CD2 3.84Å; F38-Y42 HydrophobicContact CE2-CD2 3.84Å; F38-Y42 AromaticContact CE2-CE2 3.25Å; F38-Y42 HydrophobicContact CE2-CE2 3.25Å; F38-Y42 AromaticContact CE2-CZ 3.7Å; F38-Y42 AromaticContact CG-CD2 3.92Å; F38-Y42 HydrophobicContact CG-CD2 3.92Å; F38-Y42 AromaticContact CG-CE2 3.51Å; F38-Y42 HydrophobicContact CG-CE2 3.51Å; F38-Y42 HydrophobicContact CZ-CE2 4.17Å; F38-Y42 WeakPolarHBondContact O-CD2 3.28Å; F38-Y42 PolarHBondContact O-N 3.34Å; F38-F58 HydrophobicContact CB-CE1 4.12Å; F38-F58 HydrophobicContact CB-CZ 3.73Å; F38-F58 AromaticContact CD1-CE1 3.74Å; F38-F58 HydrophobicContact CD1-CE1 3.74Å; F38-F58 AromaticContact CD1-CZ 3.76Å; F38-F58 HydrophobicContact CD1-CZ 3.76Å; F38-F58 HydrophobicContact CD2-CE1 4.34Å; F38-F58 HydrophobicContact CE1-CE1 4.14Å; F38-F58 AromaticContact CG-CE1 3.81Å; F38-F58 HydrophobicContact CG-CE1 3.81Å; F38-F58 AromaticContact CG-CZ 3.85Å; F38-F58 HydrophobicContact CG-CZ 3.85Å
39	Q	78.3	Confident	80.9	Confident	124 Å²	124	94.4 Å²	94.4	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-53.3	-36.8	-174.3	-65.3	-62.1	-37.9	0	0	113.4	K43	Q39-K43 PolarHBondContact O-N 2.95Å
40	I	76.5	Confident	80.9	Confident	100 Å²	100	95.6 Å²	95.6	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-68.9	-41.3	178	-59	153.5	0	0	0	110.6	F38 K43 V44	F38-I40 PolarHBondContact O-N 3.33Å; F38-I40 VanDerWaalsContact O-N 3.08Å; I40-K43 PolarHBondContact O-N 3.33Å; I40-V44 WeakPolarHBondContact O-CG2 3.33Å; I40-V44 PolarHBondContact O-N 3.44Å
41	L	77.4	Confident	80.9	Confident	62 Å²	62	91.1 Å²	91.1	33%	0.325	46%	0.464	S	S	.	.	H	α-helix	trans	-67.6	-36.4	178.9	-171.5	134.6	0	0	0	111.5	V33 F38 K43 V44 L45 F58	V33-L41 HydrophobicContact CG2-CB 4.12Å; V33-L41 HydrophobicContact CG2-CD1 3.91Å; F38-L41 WeakPolarHBondContact O-CA 3.35Å; F38-L41 WeakPolarHBondContact O-CB 3.3Å; F38-L41 PolarHBondContact O-N 2.61Å; L41-K43 PolarHBondContact O-N 3.45Å; L41-V44 PolarHBondContact O-N 2.89Å; L41-L45 VanDerWaalsContact O-CB 3.26Å; L41-L45 WeakPolarHBondContact O-CB 3.32Å; L41-L45 PolarHBondContact O-N 3Å; L41-F58 HydrophobicContact CD2-CD2 4.45Å; L41-F58 HydrophobicContact CD2-CE2 4.46Å
42	Y	79.9	Confident	80.8	Confident	56 Å²	56	89.9 Å²	89.9	22%	0.22	47%	0.468	C	S	.	.	H	α-helix	trans	-62.5	-41.5	175.4	-87.5	-104.3	0	0	0	112.5	F38 V44 L45 D46 K55 F58	F38-Y42 HydrophobicContact CB-CD2 4.02Å; F38-Y42 HydrophobicContact CB-CE2 3.95Å; F38-Y42 HydrophobicContact CD1-CE2 4.39Å; F38-Y42 AromaticContact CD2-CD2 3.18Å; F38-Y42 HydrophobicContact CD2-CD2 3.18Å; F38-Y42 AromaticContact CD2-CE2 2.89Å; F38-Y42 HydrophobicContact CD2-CE2 2.89Å; F38-Y42 HydrophobicContact CD2-CG 4.28Å; F38-Y42 AromaticContact CD2-CZ 3.84Å; F38-Y42 AromaticContact CE2-CD2 3.84Å; F38-Y42 HydrophobicContact CE2-CD2 3.84Å; F38-Y42 AromaticContact CE2-CE2 3.25Å; F38-Y42 HydrophobicContact CE2-CE2 3.25Å; F38-Y42 AromaticContact CE2-CZ 3.7Å; F38-Y42 AromaticContact CG-CD2 3.92Å; F38-Y42 HydrophobicContact CG-CD2 3.92Å; F38-Y42 AromaticContact CG-CE2 3.51Å; F38-Y42 HydrophobicContact CG-CE2 3.51Å; F38-Y42 HydrophobicContact CZ-CE2 4.17Å; F38-Y42 WeakPolarHBondContact O-CD2 3.28Å; F38-Y42 PolarHBondContact O-N 3.34Å; Y42-V44 VanDerWaalsContact C-N 3.34Å; Y42-V44 PolarHBondContact O-N 3.28Å; Y42-L45 PolarHBondContact O-N 3.39Å; Y42-D46 PolarHBondContact O-N 3.47Å; Y42-K55 HydrophobicContact CD1-CG 4.47Å; Y42-K55 HydrophobicContact CE1-CG 4.36Å; Y42-F58 AromaticContact CE2-CD1 3.63Å; Y42-F58 HydrophobicContact CE2-CD1 3.63Å; Y42-F58 AromaticContact CE2-CE1 3.42Å; Y42-F58 HydrophobicContact CE2-CE1 3.42Å; Y42-F58 VanDerWaalsContact CE2-CE1 3.42Å; Y42-F58 HydrophobicContact CE2-CZ 4.26Å; Y42-F58 AromaticContact CZ-CD1 3.66Å; Y42-F58 AromaticContact CZ-CE1 3.83Å; Y42-F58 WeakPolarHBondContact OH-CD1 3.44Å; Y42-F58 WeakPolarHBondContact OH-CE1 3.41Å
43	K	81	Confident	80.9	Confident	162 Å²	162	90.5 Å²	90.5	70%	0.704	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-41.6	175.8	-70.2	178.3	-179.9	175.7	0	111.8	Q39 I40 L41 T47	Q39-K43 PolarHBondContact O-N 2.95Å; I40-K43 PolarHBondContact O-N 3.33Å; L41-K43 PolarHBondContact O-N 3.45Å; K43-T47 PolarHBondContact O-OG1 3.08Å
44	V	77.7	Confident	80.9	Confident	94 Å²	94	90.9 Å²	90.9	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-68.7	-42.1	177.8	176.5	0	0	0	0	110.9	I40 L41 Y42 D46 T47	I40-V44 WeakPolarHBondContact O-CG2 3.33Å; I40-V44 PolarHBondContact O-N 3.44Å; L41-V44 PolarHBondContact O-N 2.89Å; Y42-V44 VanDerWaalsContact C-N 3.34Å; Y42-V44 PolarHBondContact O-N 3.28Å; V44-D46 VanDerWaalsContact C-N 3.28Å; V44-D46 PolarHBondContact O-N 3.43Å; V44-T47 WeakPolarHBondContact O-CB 3.5Å; V44-T47 PolarHBondContact O-N 2.89Å
45	L	76.4	Confident	81	Confident	39 Å²	39	90 Å²	90	20%	0.204	47%	0.473	C	S	.	.	H	α-helix	trans	-66.9	-28.7	-178.3	-166.6	64.3	0	0	0	112.6	L41 Y42 T47 C48 A51 K55	L41-L45 VanDerWaalsContact O-CB 3.26Å; L41-L45 WeakPolarHBondContact O-CB 3.32Å; L41-L45 PolarHBondContact O-N 3Å; Y42-L45 PolarHBondContact O-N 3.39Å; L45-T47 PolarHBondContact O-N 2.91Å; L45-C48 WeakPolarHBondContact O-CB 3.47Å; L45-C48 PolarHBondContact O-N 2.9Å; L45-C48 VanDerWaalsContact O-N 3.15Å; L45-A51 WeakPolarHBondContact O-CB 3.44Å; L45-K55 HydrophobicContact CD2-CG 4.18Å
46	D	78.1	Confident	81.2	Confident	102 Å²	102	87.5 Å²	87.5	55%	0.545	46%	0.463	S	S	.	.	H	α-helix	trans	-67.4	-21.6	176.1	-148	34.2	0	0	0	113.5	Y42 V44 C48 K55	Y42-D46 PolarHBondContact O-N 3.47Å; V44-D46 VanDerWaalsContact C-N 3.28Å; V44-D46 PolarHBondContact O-N 3.43Å; D46-C48 PolarHBondContact O-N 2.77Å; D46-K55 IonicContact OD1-NZ 2.61Å; D46-K55 PolarHBondContact OD1-NZ 2.98Å
47	T	78.6	Confident	81.5	Confident	126 Å²	126	90 Å²	90	77%	0.773	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.3	176.1	-47.3	0	0	0	0	111.9	K43 V44 L45	K43-T47 PolarHBondContact O-OG1 3.08Å; V44-T47 WeakPolarHBondContact O-CB 3.5Å; V44-T47 PolarHBondContact O-N 2.89Å; L45-T47 PolarHBondContact O-N 2.91Å
48	C	77.2	Confident	81.6	Confident	67 Å²	67	86 Å²	86	45%	0.453	45%	0.452	S	S	.	.	S	Bend	trans	-89.2	144.9	-175	-67.7	0	0	0	0	112.4	L45 D46 L50 A51	L45-C48 WeakPolarHBondContact O-CB 3.47Å; L45-C48 PolarHBondContact O-N 2.9Å; L45-C48 VanDerWaalsContact O-N 3.15Å; D46-C48 PolarHBondContact O-N 2.77Å; C48-L50 PolarHBondContact O-N 3.49Å; C48-A51 WeakPolarHBondContact O-CB 3.44Å; C48-A51 PolarHBondContact O-N 3.03Å
49	R	79.7	Confident	82	Confident	245 Å²	245	87.8 Å²	87.8	93%	0.925	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.8	178.7	-162.4	172.2	78.8	165.9	3.8	114
50	L	81.9	Confident	82.7	Confident	104 Å²	104	86 Å²	86	55%	0.545	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	27.3	179.3	-107.9	69.9	0	0	0	112.9	C48 T52 L53 G54	C48-L50 PolarHBondContact O-N 3.49Å; L50-T52 VanDerWaalsContact C-N 3.28Å; L50-T52 PolarHBondContact O-N 3.03Å; L50-L53 HydrophobicContact CD2-CD2 3.83Å; L50-L53 HydrophobicContact CG-CB 4.44Å; L50-L53 HydrophobicContact CG-CD2 4.44Å; L50-L53 PolarHBondContact O-N 2.95Å; L50-G54 PolarHBondContact O-N 3.46Å
51	A	84	Confident	83.4	Confident	11 Å²	11	85.7 Å²	85.7	9%	0.091	46%	0.455	C	S	.	.	H	α-helix	trans	-51.8	-43.1	-177.7	0	0	0	0	0	113.4	L45 C48 G54 K55	L45-A51 WeakPolarHBondContact O-CB 3.44Å; C48-A51 WeakPolarHBondContact O-CB 3.44Å; C48-A51 PolarHBondContact O-N 3.03Å; A51-G54 PolarHBondContact O-N 3.26Å; A51-K55 WeakPolarHBondContact O-CB 3.18Å; A51-K55 WeakPolarHBondContact O-CG 3.4Å; A51-K55 PolarHBondContact O-N 3.1Å
52	T	84.4	Confident	83.9	Confident	116 Å²	116	84.2 Å²	84.2	71%	0.712	45%	0.446	S	S	*	.	H	α-helix	trans	-65.1	-47.8	-178.2	51.5	0	0	0	0	112.5	L50 K55 A56	L50-T52 VanDerWaalsContact C-N 3.28Å; L50-T52 PolarHBondContact O-N 3.03Å; T52-K55 PolarHBondContact O-N 3.36Å; T52-A56 PolarHBondContact O-N 3.35Å
53	L	88.4	Confident	84.4	Confident	100 Å²	100	86.6 Å²	86.6	52%	0.524	46%	0.462	S	S	.	.	H	α-helix	trans	-64.7	-42.8	177.1	-176.1	66.8	0	0	0	111.2	L50 K55 A56 V57	L50-L53 HydrophobicContact CD2-CD2 3.83Å; L50-L53 HydrophobicContact CG-CB 4.44Å; L50-L53 HydrophobicContact CG-CD2 4.44Å; L50-L53 PolarHBondContact O-N 2.95Å; L53-K55 PolarHBondContact O-N 3.44Å; L53-A56 PolarHBondContact O-N 3.39Å; L53-V57 HydrophobicContact CD1-CG2 4.5Å; L53-V57 WeakPolarHBondContact O-CG2 3.27Å; L53-V57 PolarHBondContact O-N 2.86Å
54	G	85.1	Confident	85	Confident	24 Å²	24	83.7 Å²	83.7	25%	0.247	45%	0.453	C	S	.	.	H	α-helix	trans	-60.4	-44.2	177	0	0	0	0	0	112.3	L50 A51 A56 V57 F58	L50-G54 PolarHBondContact O-N 3.46Å; A51-G54 PolarHBondContact O-N 3.26Å; G54-A56 VanDerWaalsContact C-N 3.35Å; G54-A56 PolarHBondContact O-N 2.87Å; G54-V57 PolarHBondContact O-N 3.35Å; G54-F58 VanDerWaalsContact O-CB 3.22Å; G54-F58 WeakPolarHBondContact O-CB 3.44Å; G54-F58 PolarHBondContact O-N 3.48Å
55	K	85.9	Confident	85.7	Confident	62 Å²	62	80.6 Å²	80.6	27%	0.27	44%	0.435	S	S	.	.	H	α-helix	trans	-59.8	-43.9	174.6	-72.9	169.1	-171.9	179.2	0	111.4	Y42 L45 D46 A51 T52 L53 F58 I59	Y42-K55 HydrophobicContact CD1-CG 4.47Å; Y42-K55 HydrophobicContact CE1-CG 4.36Å; L45-K55 HydrophobicContact CD2-CG 4.18Å; D46-K55 IonicContact OD1-NZ 2.61Å; D46-K55 PolarHBondContact OD1-NZ 2.98Å; A51-K55 WeakPolarHBondContact O-CB 3.18Å; A51-K55 WeakPolarHBondContact O-CG 3.4Å; A51-K55 PolarHBondContact O-N 3.1Å; T52-K55 PolarHBondContact O-N 3.36Å; L53-K55 PolarHBondContact O-N 3.44Å; K55-F58 PolarHBondContact O-N 3.14Å; K55-I59 VanDerWaalsContact O-CG1 3.27Å; K55-I59 WeakPolarHBondContact O-CG1 3.46Å; K55-I59 PolarHBondContact O-N 3.47Å
56	A	87.8	Confident	86.4	Confident	51 Å²	51	81.2 Å²	81.2	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-63.7	-48.9	179.5	0	0	0	0	0	112.6	T52 L53 G54 F58 I59 V60	T52-A56 PolarHBondContact O-N 3.35Å; L53-A56 PolarHBondContact O-N 3.39Å; G54-A56 VanDerWaalsContact C-N 3.35Å; G54-A56 PolarHBondContact O-N 2.87Å; A56-F58 VanDerWaalsContact C-N 3.31Å; A56-F58 PolarHBondContact O-N 2.99Å; A56-I59 PolarHBondContact O-N 2.97Å; A56-V60 WeakPolarHBondContact O-CG2 3.41Å; A56-V60 PolarHBondContact O-N 3.49Å; A56-V60 VanDerWaalsContact O-N 3.09Å
57	V	88.7	Confident	87.2	Confident	91 Å²	91	81.9 Å²	81.9	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-63.4	-39.5	178	174.2	0	0	0	0	111.1	L53 G54 V60 F61	L53-V57 HydrophobicContact CD1-CG2 4.5Å; L53-V57 WeakPolarHBondContact O-CG2 3.27Å; L53-V57 PolarHBondContact O-N 2.86Å; G54-V57 PolarHBondContact O-N 3.35Å; V57-V60 PolarHBondContact O-N 3.37Å; V57-F61 WeakPolarHBondContact O-CB 3.33Å; V57-F61 PolarHBondContact O-N 3.23Å
58	F	87.1	Confident	87.8	Confident	24 Å²	24	81.4 Å²	81.4	11%	0.105	44%	0.438	C	S	.	.	H	α-helix	trans	-62.7	-44.9	177.2	-175.9	-93.2	0	0	0	112.2	V33 F38 L41 Y42 G54 K55 A56 V60 F61 E62	V33-F58 HydrophobicContact CG1-CE2 3.52Å; V33-F58 HydrophobicContact CG1-CZ 3.76Å; F38-F58 HydrophobicContact CB-CE1 4.12Å; F38-F58 HydrophobicContact CB-CZ 3.73Å; F38-F58 AromaticContact CD1-CE1 3.74Å; F38-F58 HydrophobicContact CD1-CE1 3.74Å; F38-F58 AromaticContact CD1-CZ 3.76Å; F38-F58 HydrophobicContact CD1-CZ 3.76Å; F38-F58 HydrophobicContact CD2-CE1 4.34Å; F38-F58 HydrophobicContact CE1-CE1 4.14Å; F38-F58 AromaticContact CG-CE1 3.81Å; F38-F58 HydrophobicContact CG-CE1 3.81Å; F38-F58 AromaticContact CG-CZ 3.85Å; F38-F58 HydrophobicContact CG-CZ 3.85Å; L41-F58 HydrophobicContact CD2-CD2 4.45Å; L41-F58 HydrophobicContact CD2-CE2 4.46Å; Y42-F58 AromaticContact CE2-CD1 3.63Å; Y42-F58 HydrophobicContact CE2-CD1 3.63Å; Y42-F58 AromaticContact CE2-CE1 3.42Å; Y42-F58 HydrophobicContact CE2-CE1 3.42Å; Y42-F58 VanDerWaalsContact CE2-CE1 3.42Å; Y42-F58 HydrophobicContact CE2-CZ 4.26Å; Y42-F58 AromaticContact CZ-CD1 3.66Å; Y42-F58 AromaticContact CZ-CE1 3.83Å; Y42-F58 WeakPolarHBondContact OH-CD1 3.44Å; Y42-F58 WeakPolarHBondContact OH-CE1 3.41Å; G54-F58 VanDerWaalsContact O-CB 3.22Å; G54-F58 WeakPolarHBondContact O-CB 3.44Å; G54-F58 PolarHBondContact O-N 3.48Å; K55-F58 PolarHBondContact O-N 3.14Å; A56-F58 VanDerWaalsContact C-N 3.31Å; A56-F58 PolarHBondContact O-N 2.99Å; F58-V60 PolarHBondContact O-N 2.89Å; F58-F61 PolarHBondContact O-N 3.21Å; F58-E62 HydrophobicContact CD1-CG 4.02Å; F58-E62 HydrophobicContact CE1-CG 3.46Å; F58-E62 VanDerWaalsContact CE1-CG 3.46Å; F58-E62 HydrophobicContact CE2-CG 4.26Å; F58-E62 HydrophobicContact CZ-CG 3.6Å; F58-E62 VanDerWaalsContact CZ-OE1 3.27Å; F58-E62 WeakPolarHBondContact CZ-OE1 3.39Å; F58-E62 WeakPolarHBondContact O-CB 3.19Å; F58-E62 WeakPolarHBondContact O-CG 3.45Å; F58-E62 PolarHBondContact O-N 3.37Å
59	I	87.6	Confident	88.5	Confident	84 Å²	84	83.5 Å²	83.5	43%	0.431	44%	0.444	S	S	.	.	H	α-helix	trans	-62.1	-43.8	176.8	-69.5	165	0	0	0	111.1	K55 A56 F61 E62 L63	K55-I59 VanDerWaalsContact O-CG1 3.27Å; K55-I59 WeakPolarHBondContact O-CG1 3.46Å; K55-I59 PolarHBondContact O-N 3.47Å; A56-I59 PolarHBondContact O-N 2.97Å; I59-F61 VanDerWaalsContact C-N 3.34Å; I59-E62 PolarHBondContact O-N 3.39Å; I59-L63 HydrophobicContact CG2-CD1 4.13Å; I59-L63 WeakPolarHBondContact O-CB 3.47Å; I59-L63 VanDerWaalsContact O-CG 3.32Å; I59-L63 WeakPolarHBondContact O-CG 3.48Å; I59-L63 PolarHBondContact O-N 3.47Å
60	V	92.6	Very high	89.2	Confident	85 Å²	85	76.1 Å²	76.1	52%	0.515	42%	0.421	S	S	.	.	H	α-helix	trans	-63	-43.1	177.1	173	0	0	0	0	110.8	A56 V57 F58 L63 L64	A56-V60 WeakPolarHBondContact O-CG2 3.41Å; A56-V60 PolarHBondContact O-N 3.49Å; A56-V60 VanDerWaalsContact O-N 3.09Å; V57-V60 PolarHBondContact O-N 3.37Å; F58-V60 PolarHBondContact O-N 2.89Å; V60-L63 PolarHBondContact O-N 2.91Å; V60-L64 HydrophobicContact CG1-CD1 4.23Å; V60-L64 WeakPolarHBondContact O-CG 3.49Å; V60-L64 PolarHBondContact O-N 3.43Å
61	F	91	Very high	89.8	Confident	95 Å²	95	75.8 Å²	75.8	42%	0.417	42%	0.42	S	S	.	.	H	α-helix	trans	-59.9	-49.7	176	170.7	-98.8	0	0	0	112.1	V57 F58 I59 L63 L64 V65	V57-F61 WeakPolarHBondContact O-CB 3.33Å; V57-F61 PolarHBondContact O-N 3.23Å; F58-F61 PolarHBondContact O-N 3.21Å; I59-F61 VanDerWaalsContact C-N 3.34Å; F61-L63 VanDerWaalsContact C-N 3.31Å; F61-L63 PolarHBondContact O-N 3.02Å; F61-L64 PolarHBondContact O-N 3.46Å; F61-L64 VanDerWaalsContact O-N 3.14Å; F61-V65 HydrophobicContact CD1-CG2 4.36Å; F61-V65 HydrophobicContact CD2-CG2 4.25Å; F61-V65 HydrophobicContact CE1-CG2 3.9Å; F61-V65 HydrophobicContact CE2-CG2 3.78Å; F61-V65 HydrophobicContact CZ-CG2 3.58Å; F61-V65 WeakPolarHBondContact O-CG2 3.34Å; F61-V65 PolarHBondContact O-N 3.47Å
62	E	88.7	Confident	90.1	Very high	30 Å²	30	81 Å²	81	14%	0.14	44%	0.444	C	S	.	.	H	α-helix	trans	-59.7	-40.2	177.5	-77.9	-64.7	154.8	0	0	112.3	F58 I59 V65 S66	F58-E62 HydrophobicContact CD1-CG 4.02Å; F58-E62 HydrophobicContact CE1-CG 3.46Å; F58-E62 VanDerWaalsContact CE1-CG 3.46Å; F58-E62 HydrophobicContact CE2-CG 4.26Å; F58-E62 HydrophobicContact CZ-CG 3.6Å; F58-E62 VanDerWaalsContact CZ-OE1 3.27Å; F58-E62 WeakPolarHBondContact CZ-OE1 3.39Å; F58-E62 WeakPolarHBondContact O-CB 3.19Å; F58-E62 WeakPolarHBondContact O-CG 3.45Å; F58-E62 PolarHBondContact O-N 3.37Å; I59-E62 PolarHBondContact O-N 3.39Å; E62-V65 PolarHBondContact O-N 3.17Å; E62-S66 VanDerWaalsContact O-CB 3.29Å; E62-S66 WeakPolarHBondContact O-CB 3.35Å; E62-S66 PolarHBondContact O-N 3.48Å; E62-S66 PolarHBondContact O-OG 3.29Å
63	L	91.4	Very high	90.5	Very high	106 Å²	106	81.3 Å²	81.3	56%	0.555	44%	0.436	S	S	*	.	H	α-helix	trans	-63.1	-43.4	174.5	-75.3	173.3	0	0	0	112	I59 V60 F61 S66 L67	I59-L63 HydrophobicContact CG2-CD1 4.13Å; I59-L63 WeakPolarHBondContact O-CB 3.47Å; I59-L63 VanDerWaalsContact O-CG 3.32Å; I59-L63 WeakPolarHBondContact O-CG 3.48Å; I59-L63 PolarHBondContact O-N 3.47Å; V60-L63 PolarHBondContact O-N 2.91Å; F61-L63 VanDerWaalsContact C-N 3.31Å; F61-L63 PolarHBondContact O-N 3.02Å; L63-S66 PolarHBondContact O-N 2.76Å; L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 3.22Å
64	L	93.4	Very high	90.7	Very high	101 Å²	101	81.6 Å²	81.6	53%	0.529	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-44.3	177.5	-70.5	175	0	0	0	111.9	V60 F61 S66 L67 L68	V60-L64 HydrophobicContact CG1-CD1 4.23Å; V60-L64 WeakPolarHBondContact O-CG 3.49Å; V60-L64 PolarHBondContact O-N 3.43Å; F61-L64 PolarHBondContact O-N 3.46Å; F61-L64 VanDerWaalsContact O-N 3.14Å; L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 3.4Å; L64-L67 PolarHBondContact O-N 2.87Å; L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 3.25Å
65	V	91.7	Very high	91.1	Very high	30 Å²	30	82.5 Å²	82.5	18%	0.182	44%	0.442	C	S	.	.	H	α-helix	trans	-60.1	-44.4	175.2	172	0	0	0	0	110.4	F61 E62 L67 L68 L69	F61-V65 HydrophobicContact CD1-CG2 4.36Å; F61-V65 HydrophobicContact CD2-CG2 4.25Å; F61-V65 HydrophobicContact CE1-CG2 3.9Å; F61-V65 HydrophobicContact CE2-CG2 3.78Å; F61-V65 HydrophobicContact CZ-CG2 3.58Å; F61-V65 WeakPolarHBondContact O-CG2 3.34Å; F61-V65 PolarHBondContact O-N 3.47Å; E62-V65 PolarHBondContact O-N 3.17Å; V65-L67 PolarHBondContact O-N 2.95Å; V65-L68 PolarHBondContact O-N 3.33Å; V65-L69 HydrophobicContact CG1-CD1 4.02Å; V65-L69 HydrophobicContact CG1-CG 4.34Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 3.41Å
66	S	91.5	Very high	91.4	Very high	52 Å²	52	83.1 Å²	83.1	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-59.2	-44.4	177	-62.5	0	0	0	0	112	E62 L63 L64 L68 L69 I70	E62-S66 VanDerWaalsContact O-CB 3.29Å; E62-S66 WeakPolarHBondContact O-CB 3.35Å; E62-S66 PolarHBondContact O-N 3.48Å; E62-S66 PolarHBondContact O-OG 3.29Å; L63-S66 PolarHBondContact O-N 2.76Å; L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 3.4Å; S66-L68 PolarHBondContact O-N 3.5Å; S66-L69 PolarHBondContact O-N 2.95Å; S66-I70 WeakPolarHBondContact O-CB 3.4Å; S66-I70 VanDerWaalsContact O-CG1 3.25Å; S66-I70 WeakPolarHBondContact O-CG1 3.25Å; S66-I70 PolarHBondContact O-N 3.39Å
67	L	94.6	Very high	91.5	Very high	116 Å²	116	84.1 Å²	84.1	61%	0.607	45%	0.448	S	S	*	.	H	α-helix	trans	-63.6	-40.3	176.5	-71	174.5	0	0	0	112.4	L63 L64 V65 I70 N71	L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 3.22Å; L64-L67 PolarHBondContact O-N 2.87Å; V65-L67 PolarHBondContact O-N 2.95Å; L67-I70 PolarHBondContact O-N 3.33Å; L67-N71 PolarHBondContact O-N 3.14Å
68	L	92.2	Very high	91.4	Very high	116 Å²	116	81.2 Å²	81.2	61%	0.607	44%	0.436	S	S	*	.	H	α-helix	trans	-65.7	-42.3	176.8	-70.6	171.3	0	0	0	112	L64 V65 S66 N71 M72	L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 3.25Å; V65-L68 PolarHBondContact O-N 3.33Å; S66-L68 PolarHBondContact O-N 3.5Å; L68-N71 PolarHBondContact O-N 3.04Å; L68-M72 PolarHBondContact O-N 3.49Å; L68-M72 VanDerWaalsContact O-N 3.14Å
69	L	91.5	Very high	91.4	Very high	111 Å²	111	88.8 Å²	88.8	58%	0.581	46%	0.464	S	S	*	.	H	α-helix	trans	-65	-42.7	176.7	-71.6	176.9	0	0	0	111.6	V65 S66 N71 M72 F73	V65-L69 HydrophobicContact CG1-CD1 4.02Å; V65-L69 HydrophobicContact CG1-CG 4.34Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 3.41Å; S66-L69 PolarHBondContact O-N 2.95Å; L69-N71 VanDerWaalsContact C-N 3.3Å; L69-N71 PolarHBondContact O-N 3.5Å; L69-M72 PolarHBondContact O-N 3.48Å; L69-F73 VanDerWaalsContact O-CB 3.24Å; L69-F73 WeakPolarHBondContact O-CB 3.24Å; L69-F73 PolarHBondContact O-N 3.49Å
70	I	94.1	Very high	91.3	Very high	89 Å²	89	88.4 Å²	88.4	46%	0.456	47%	0.466	S	S	.	.	H	α-helix	trans	-61.4	-40.5	175.7	-70	166	0	0	0	110.8	S66 L67 M72 F73 I74	S66-I70 WeakPolarHBondContact O-CB 3.4Å; S66-I70 VanDerWaalsContact O-CG1 3.25Å; S66-I70 WeakPolarHBondContact O-CG1 3.25Å; S66-I70 PolarHBondContact O-N 3.39Å; L67-I70 PolarHBondContact O-N 3.33Å; I70-M72 PolarHBondContact O-N 2.85Å; I70-F73 WeakPolarHBondContact O-CB 3.42Å; I70-F73 PolarHBondContact O-N 3.05Å; I70-I74 HydrophobicContact CG2-CD1 3.6Å; I70-I74 HydrophobicContact CG2-CG1 4.22Å; I70-I74 VanDerWaalsContact O-CG1 3.28Å; I70-I74 WeakPolarHBondContact O-CG1 3.28Å; I70-I74 PolarHBondContact O-N 3.29Å
71	N	93.9	Very high	90.7	Very high	97 Å²	97	92.1 Å²	92.1	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-61.2	-45.3	177.1	-172.4	30	0	0	0	112.1	L67 L68 L69 F73 A75	L67-N71 PolarHBondContact O-N 3.14Å; L68-N71 PolarHBondContact O-N 3.04Å; L69-N71 VanDerWaalsContact C-N 3.3Å; L69-N71 PolarHBondContact O-N 3.5Å; N71-F73 VanDerWaalsContact C-N 3.33Å; N71-F73 PolarHBondContact O-N 3.42Å; N71-A75 WeakPolarHBondContact O-CB 3.48Å; N71-A75 PolarHBondContact O-N 3.23Å
72	M	91.6	Very high	90.3	Very high	121 Å²	121	93.9 Å²	93.9	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-68.6	-32.6	175.7	-69.1	-64.2	131.5	0	0	112.7	L68 L69 I70 A75 T76	L68-M72 PolarHBondContact O-N 3.49Å; L68-M72 VanDerWaalsContact O-N 3.14Å; L69-M72 PolarHBondContact O-N 3.48Å; I70-M72 PolarHBondContact O-N 2.85Å; M72-A75 PolarHBondContact O-N 2.82Å; M72-T76 WeakPolarHBondContact O-CG2 3.41Å; M72-T76 PolarHBondContact O-N 3.08Å; M72-T76 PolarHBondContact O-OG1 3.01Å; M72-T76 VanDerWaalsContact O-OG1 3.08Å
73	F	91.4	Very high	90.1	Very high	122 Å²	122	94.8 Å²	94.8	54%	0.535	49%	0.494	S	S	.	.	H	α-helix	trans	-67.6	-46.5	176	-178.8	-110.2	0	0	0	111.7	L69 I70 N71 A75 T76 M77	L69-F73 VanDerWaalsContact O-CB 3.24Å; L69-F73 WeakPolarHBondContact O-CB 3.24Å; L69-F73 PolarHBondContact O-N 3.49Å; I70-F73 WeakPolarHBondContact O-CB 3.42Å; I70-F73 PolarHBondContact O-N 3.05Å; N71-F73 VanDerWaalsContact C-N 3.33Å; N71-F73 PolarHBondContact O-N 3.42Å; F73-A75 VanDerWaalsContact C-N 3.3Å; F73-A75 PolarHBondContact O-N 3.17Å; F73-T76 PolarHBondContact O-N 3.35Å; F73-T76 PolarHBondContact O-OG1 3.45Å; F73-M77 HydrophobicContact CE1-CE 4.08Å; F73-M77 HydrophobicContact CE1-CG 4.28Å; F73-M77 HydrophobicContact CE2-CE 3.61Å; F73-M77 HydrophobicContact CE2-CG 4.42Å; F73-M77 HydrophobicContact CZ-CE 3.27Å; F73-M77 HydrophobicContact CZ-CG 4.22Å; F73-M77 WeakPolarHBondContact O-CB 3.34Å; F73-M77 WeakPolarHBondContact O-CG 3.46Å; F73-M77 PolarHBondContact O-N 3.49Å
74	I	93.7	Very high	89.6	Confident	106 Å²	106	93.8 Å²	93.8	54%	0.544	49%	0.492	S	S	.	.	H	α-helix	trans	-62.8	-40.3	175.6	-65.6	162.9	0	0	0	110.2	I70 T76 M77 G78	I70-I74 HydrophobicContact CG2-CD1 3.6Å; I70-I74 HydrophobicContact CG2-CG1 4.22Å; I70-I74 VanDerWaalsContact O-CG1 3.28Å; I70-I74 WeakPolarHBondContact O-CG1 3.28Å; I70-I74 PolarHBondContact O-N 3.29Å; I74-T76 PolarHBondContact O-N 2.93Å; I74-M77 PolarHBondContact O-N 3.31Å; I74-G78 PolarHBondContact O-N 3.03Å
75	A	93.4	Very high	88.8	Confident	43 Å²	43	93.6 Å²	93.6	36%	0.355	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-41.7	177.6	0	0	0	0	0	112.8	N71 M72 F73 G78 R79	N71-A75 WeakPolarHBondContact O-CB 3.48Å; N71-A75 PolarHBondContact O-N 3.23Å; M72-A75 PolarHBondContact O-N 2.82Å; F73-A75 VanDerWaalsContact C-N 3.3Å; F73-A75 PolarHBondContact O-N 3.17Å; A75-G78 PolarHBondContact O-N 3.41Å; A75-R79 WeakPolarHBondContact O-CG 3.44Å; A75-R79 PolarHBondContact O-N 2.81Å
76	T	91	Very high	88.3	Confident	76 Å²	76	98.4 Å²	98.4	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-70.9	-36.6	176.8	51.2	0	0	0	0	112.1	M72 F73 I74 R79 T80	M72-T76 WeakPolarHBondContact O-CG2 3.41Å; M72-T76 PolarHBondContact O-N 3.08Å; M72-T76 PolarHBondContact O-OG1 3.01Å; M72-T76 VanDerWaalsContact O-OG1 3.08Å; F73-T76 PolarHBondContact O-N 3.35Å; F73-T76 PolarHBondContact O-OG1 3.45Å; I74-T76 PolarHBondContact O-N 2.93Å; T76-R79 PolarHBondContact O-N 2.95Å; T76-T80 PolarHBondContact O-N 3.23Å; T76-T80 VanDerWaalsContact O-N 3.13Å; T76-T80 PolarHBondContact O-OG1 3.13Å
77	M	90.4	Very high	87.9	Confident	71 Å²	71	99.4 Å²	99.4	35%	0.35	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-44	169.9	-75	-69.1	-174	0	0	111.8	F73 I74 R79 T80 Y81	F73-M77 HydrophobicContact CE1-CE 4.08Å; F73-M77 HydrophobicContact CE1-CG 4.28Å; F73-M77 HydrophobicContact CE2-CE 3.61Å; F73-M77 HydrophobicContact CE2-CG 4.42Å; F73-M77 HydrophobicContact CZ-CE 3.27Å; F73-M77 HydrophobicContact CZ-CG 4.22Å; F73-M77 WeakPolarHBondContact O-CB 3.34Å; F73-M77 WeakPolarHBondContact O-CG 3.46Å; F73-M77 PolarHBondContact O-N 3.49Å; I74-M77 PolarHBondContact O-N 3.31Å; M77-R79 PolarHBondContact O-N 3.45Å; M77-T80 WeakPolarHBondContact CA-OG1 3.47Å; M77-T80 PolarHBondContact O-N 3.42Å; M77-T80 PolarHBondContact O-OG1 2.88Å; M77-Y81 VanDerWaalsContact C-CD2 3.48Å; M77-Y81 HydrophobicContact CB-CD2 4.3Å; M77-Y81 HydrophobicContact CB-CE2 3.94Å; M77-Y81 WeakPolarHBondContact O-CD2 3.46Å; M77-Y81 PolarHBondContact O-N 2.92Å
78	G	86.8	Confident	87.3	Confident	30 Å²	30	98.4 Å²	98.4	31%	0.309	51%	0.508	S	S	.	.	H	α-helix	trans	-56.5	-47.3	176.2	0	0	0	0	0	112.8	I74 A75 T80 Y81 E82	I74-G78 PolarHBondContact O-N 3.03Å; A75-G78 PolarHBondContact O-N 3.41Å; G78-T80 PolarHBondContact O-N 3.49Å; G78-Y81 WeakPolarHBondContact O-CB 3.5Å; G78-Y81 PolarHBondContact O-N 3.41Å; G78-E82 PolarHBondContact O-N 3.03Å
79	R	86.6	Confident	86.9	Confident	183 Å²	183	98.6 Å²	98.6	69%	0.691	51%	0.508	S	S	*	.	H	α-helix	trans	-62.8	-40	177.6	-69.2	176.3	-176.7	-174.5	1.3	112.8	A75 T76 M77 E82 A83	A75-R79 WeakPolarHBondContact O-CG 3.44Å; A75-R79 PolarHBondContact O-N 2.81Å; T76-R79 PolarHBondContact O-N 2.95Å; M77-R79 PolarHBondContact O-N 3.45Å; R79-E82 PolarHBondContact O-N 3.15Å; R79-A83 WeakPolarHBondContact O-CB 2.9Å; R79-A83 PolarHBondContact O-N 3.24Å
80	T	85.3	Confident	86.7	Confident	76 Å²	76	99 Å²	99	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-72.5	-31.9	177.2	54.2	0	0	0	0	111.8	T76 M77 G78 A83 V84	T76-T80 PolarHBondContact O-N 3.23Å; T76-T80 VanDerWaalsContact O-N 3.13Å; T76-T80 PolarHBondContact O-OG1 3.13Å; M77-T80 WeakPolarHBondContact CA-OG1 3.47Å; M77-T80 PolarHBondContact O-N 3.42Å; M77-T80 PolarHBondContact O-OG1 2.88Å; G78-T80 PolarHBondContact O-N 3.49Å; T80-A83 PolarHBondContact O-N 2.93Å; T80-V84 WeakPolarHBondContact O-CB 3.48Å; T80-V84 WeakPolarHBondContact O-CG2 3.2Å; T80-V84 PolarHBondContact O-N 3.42Å
81	Y	80.8	Confident	86.5	Confident	163 Å²	163	101 Å²	101	64%	0.639	51%	0.509	S	S	*	.	H	α-helix	trans	-63	-42.8	171.5	-75.2	-57.8	0	0	0	112.4	M77 G78 V84 N85	M77-Y81 VanDerWaalsContact C-CD2 3.48Å; M77-Y81 HydrophobicContact CB-CD2 4.3Å; M77-Y81 HydrophobicContact CB-CE2 3.94Å; M77-Y81 WeakPolarHBondContact O-CD2 3.46Å; M77-Y81 PolarHBondContact O-N 2.92Å; G78-Y81 WeakPolarHBondContact O-CB 3.5Å; G78-Y81 PolarHBondContact O-N 3.41Å; Y81-V84 PolarHBondContact O-N 3.25Å; Y81-N85 PolarHBondContact O-N 3.37Å; Y81-N85 VanDerWaalsContact O-N 3.09Å
82	E	83.4	Confident	86.3	Confident	133 Å²	133	103.3 Å²	103.3	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-62.3	-49.1	174.5	-71.6	172.7	-178.8	0	0	111.2	G78 R79 V84 N85 E86	G78-E82 PolarHBondContact O-N 3.03Å; R79-E82 PolarHBondContact O-N 3.15Å; E82-V84 VanDerWaalsContact C-N 3.34Å; E82-V84 PolarHBondContact O-N 3.07Å; E82-N85 WeakPolarHBondContact O-CB 3.42Å; E82-N85 PolarHBondContact O-N 2.9Å; E82-E86 PolarHBondContact O-N 3.28Å
83	A	83	Confident	86.2	Confident	49 Å²	49	107 Å²	107	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-59.5	-42	178.2	0	0	0	0	0	112.4	R79 T80 N85 E86 T87	R79-A83 WeakPolarHBondContact O-CB 2.9Å; R79-A83 PolarHBondContact O-N 3.24Å; T80-A83 PolarHBondContact O-N 2.93Å; A83-N85 VanDerWaalsContact C-N 3.3Å; A83-N85 PolarHBondContact O-N 3.09Å; A83-E86 PolarHBondContact O-N 2.81Å; A83-T87 WeakPolarHBondContact O-CG2 3.37Å; A83-T87 PolarHBondContact O-N 3.09Å; A83-T87 VanDerWaalsContact O-N 3.09Å
84	V	81.6	Confident	86.4	Confident	85 Å²	85	106.6 Å²	106.6	52%	0.515	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-38.7	175.7	169.9	0	0	0	0	111.1	T80 Y81 E82 T87 Q88	T80-V84 WeakPolarHBondContact O-CB 3.48Å; T80-V84 WeakPolarHBondContact O-CG2 3.2Å; T80-V84 PolarHBondContact O-N 3.42Å; Y81-V84 PolarHBondContact O-N 3.25Å; E82-V84 VanDerWaalsContact C-N 3.34Å; E82-V84 PolarHBondContact O-N 3.07Å; V84-T87 PolarHBondContact O-OG1 3.49Å; V84-Q88 WeakPolarHBondContact O-CG 3.37Å; V84-Q88 PolarHBondContact O-N 2.8Å
85	N	76.7	Confident	86.5	Confident	96 Å²	96	107.1 Å²	107.1	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-69.1	-38.4	177.4	-173.3	45.6	0	0	0	112.7	Y81 E82 A83 Q88 M89	Y81-N85 PolarHBondContact O-N 3.37Å; Y81-N85 VanDerWaalsContact O-N 3.09Å; E82-N85 WeakPolarHBondContact O-CB 3.42Å; E82-N85 PolarHBondContact O-N 2.9Å; A83-N85 VanDerWaalsContact C-N 3.3Å; A83-N85 PolarHBondContact O-N 3.09Å; N85-Q88 WeakPolarHBondContact O-CB 3.25Å; N85-Q88 PolarHBondContact O-N 3.01Å; N85-M89 PolarHBondContact O-N 3.33Å
86	E	80.8	Confident	86.6	Confident	132 Å²	132	108 Å²	108	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-61.4	-44.5	175	-70.8	-176.1	165	0	0	111.6	E82 A83 Q88 M89 E90	E82-E86 PolarHBondContact O-N 3.28Å; A83-E86 PolarHBondContact O-N 2.81Å; E86-Q88 VanDerWaalsContact C-N 3.26Å; E86-Q88 PolarHBondContact O-N 2.85Å; E86-M89 WeakPolarHBondContact O-CA 3.38Å; E86-M89 WeakPolarHBondContact O-CB 3.31Å; E86-M89 PolarHBondContact O-N 3.44Å; E86-E90 PolarHBondContact O-N 2.98Å; E86-E90 VanDerWaalsContact O-N 3.12Å
87	T	82.8	Confident	86.8	Confident	72 Å²	72	109.5 Å²	109.5	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-31.1	176.8	63.6	0	0	0	0	112.9	A83 V84 M89 E90 W91	A83-T87 WeakPolarHBondContact O-CG2 3.37Å; A83-T87 PolarHBondContact O-N 3.09Å; A83-T87 VanDerWaalsContact O-N 3.09Å; V84-T87 PolarHBondContact O-OG1 3.49Å; T87-M89 VanDerWaalsContact C-N 3.26Å; T87-M89 PolarHBondContact O-N 2.92Å; T87-E90 PolarHBondContact O-N 2.71Å; T87-W91 WeakPolarHBondContact O-CB 3.12Å; T87-W91 PolarHBondContact O-N 2.92Å
88	Q	81.7	Confident	87.1	Confident	95 Å²	95	110 Å²	110	44%	0.444	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-31.3	173.1	-72	-67.2	-37.3	0	0	112.3	V84 N85 E86 K92	V84-Q88 WeakPolarHBondContact O-CG 3.37Å; V84-Q88 PolarHBondContact O-N 2.8Å; N85-Q88 WeakPolarHBondContact O-CB 3.25Å; N85-Q88 PolarHBondContact O-N 3.01Å; E86-Q88 VanDerWaalsContact C-N 3.26Å; E86-Q88 PolarHBondContact O-N 2.85Å; Q88-K92 WeakPolarHBondContact O-CG 3.38Å; Q88-K92 PolarHBondContact O-N 3.44Å
89	M	83.7	Confident	87.3	Confident	121 Å²	121	112.8 Å²	112.8	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-72.3	-41	173.4	-58	-165.3	-176.6	0	0	111.3	N85 E86 T87 K92 R93	N85-M89 PolarHBondContact O-N 3.33Å; E86-M89 WeakPolarHBondContact O-CA 3.38Å; E86-M89 WeakPolarHBondContact O-CB 3.31Å; E86-M89 PolarHBondContact O-N 3.44Å; T87-M89 VanDerWaalsContact C-N 3.26Å; T87-M89 PolarHBondContact O-N 2.92Å; M89-K92 PolarHBondContact O-N 2.7Å; M89-R93 PolarHBondContact O-N 3.46Å
90	E	87.9	Confident	87.5	Confident	119 Å²	119	108.4 Å²	108.4	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-62.2	-43.1	174.9	-64.4	-172	151.4	0	0	111.9	E86 T87 K92 R93 Q94	E86-E90 PolarHBondContact O-N 2.98Å; E86-E90 VanDerWaalsContact O-N 3.12Å; T87-E90 PolarHBondContact O-N 2.71Å; E90-K92 PolarHBondContact O-N 2.97Å; E90-R93 WeakPolarHBondContact O-CB 3.18Å; E90-R93 PolarHBondContact O-N 2.86Å; E90-R93 VanDerWaalsContact O-N 3.12Å; E90-Q94 WeakPolarHBondContact O-CG 3.39Å; E90-Q94 PolarHBondContact O-N 3.36Å
91	W	89.6	Confident	87.9	Confident	132 Å²	132	110.1 Å²	110.1	50%	0.5	53%	0.533	S	S	.	.	H	α-helix	trans	-54.9	-51	172.7	171.3	-111.6	0	0	0	111.4	T87 R93 Q94 W95	T87-W91 WeakPolarHBondContact O-CB 3.12Å; T87-W91 PolarHBondContact O-N 2.92Å; W91-R93 VanDerWaalsContact C-N 3.26Å; W91-R93 PolarHBondContact O-N 2.83Å; W91-Q94 PolarHBondContact O-N 3.25Å; W91-Q94 VanDerWaalsContact O-N 3.16Å; W91-W95 AromaticContact CD1-CD1 3.89Å; W91-W95 AromaticContact CD2-CD1 3.38Å; W91-W95 AromaticContact CD2-NE1 3.19Å; W91-W95 AromaticContact CE2-CD1 3.32Å; W91-W95 AromaticContact CE2-CE2 3.95Å; W91-W95 AromaticContact CE2-NE1 2.85Å; W91-W95 AromaticContact CE3-CD1 3.77Å; W91-W95 AromaticContact CE3-NE1 3.35Å; W91-W95 AromaticContact CG-CD1 3.85Å; W91-W95 AromaticContact CH2-CE2 3.61Å; W91-W95 AromaticContact CH2-CZ2 3.66Å; W91-W95 HydrophobicContact CH2-CZ2 3.66Å; W91-W95 AromaticContact CH2-NE1 2.99Å; W91-W95 AromaticContact CZ2-CD1 3.77Å; W91-W95 AromaticContact CZ2-CE2 3.53Å; W91-W95 AromaticContact CZ2-CZ2 3.76Å; W91-W95 HydrophobicContact CZ2-CZ2 3.76Å; W91-W95 AromaticContact CZ2-NE1 2.79Å; W91-W95 HydrophobicContact CZ3-CZ2 4.45Å; W91-W95 AromaticContact CZ3-NE1 3.24Å; W91-W95 AromaticContact NE1-CD1 3.55Å; W91-W95 AromaticContact NE1-NE1 3.49Å; W91-W95 PolarHBondContact O-N 3.39Å
92	K	90.1	Very high	88.4	Confident	145 Å²	145	107.9 Å²	107.9	63%	0.63	53%	0.531	S	S	*	.	H	α-helix	trans	-59	-38.3	176.7	-73.2	171.4	-174.5	169.2	0	112.3	Q88 M89 E90 W95 A96	Q88-K92 WeakPolarHBondContact O-CG 3.38Å; Q88-K92 PolarHBondContact O-N 3.44Å; M89-K92 PolarHBondContact O-N 2.7Å; E90-K92 PolarHBondContact O-N 2.97Å; K92-W95 PolarHBondContact O-N 3.46Å; K92-A96 WeakPolarHBondContact O-CB 3.07Å; K92-A96 PolarHBondContact O-N 2.82Å
93	R	90.6	Very high	88.7	Confident	199 Å²	199	104.3 Å²	104.3	75%	0.751	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-44.9	176.2	-174.3	-178.2	-175.9	171.4	1.6	111.6	M89 E90 W91 A96 Q97	M89-R93 PolarHBondContact O-N 3.46Å; E90-R93 WeakPolarHBondContact O-CB 3.18Å; E90-R93 PolarHBondContact O-N 2.86Å; E90-R93 VanDerWaalsContact O-N 3.12Å; W91-R93 VanDerWaalsContact C-N 3.26Å; W91-R93 PolarHBondContact O-N 2.83Å; R93-A96 PolarHBondContact O-N 3.16Å; R93-Q97 PolarHBondContact O-N 3.27Å
94	Q	95.3	Very high	88.9	Confident	112 Å²	112	107.6 Å²	107.6	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-44.1	176.5	-71.2	175.7	-11	0	0	111.3	E90 W91 A96 Q97 V98	E90-Q94 WeakPolarHBondContact O-CG 3.39Å; E90-Q94 PolarHBondContact O-N 3.36Å; W91-Q94 PolarHBondContact O-N 3.25Å; W91-Q94 VanDerWaalsContact O-N 3.16Å; Q94-A96 VanDerWaalsContact C-N 3.35Å; Q94-A96 PolarHBondContact O-N 3.12Å; Q94-Q97 WeakPolarHBondContact O-CB 3.27Å; Q94-Q97 PolarHBondContact O-N 3.26Å; Q94-Q97 VanDerWaalsContact O-N 3.14Å; Q94-V98 WeakPolarHBondContact O-CG2 3.36Å; Q94-V98 PolarHBondContact O-N 3.24Å
95	W	95.3	Very high	89.4	Confident	118 Å²	118	108 Å²	108	45%	0.447	53%	0.528	S	S	.	.	H	α-helix	trans	-60.1	-42.9	174.4	-84.4	97.6	0	0	0	113	W91 K92 Q97 V98 I99	W91-W95 AromaticContact CD1-CD1 3.89Å; W91-W95 AromaticContact CD2-CD1 3.38Å; W91-W95 AromaticContact CD2-NE1 3.19Å; W91-W95 AromaticContact CE2-CD1 3.32Å; W91-W95 AromaticContact CE2-CE2 3.95Å; W91-W95 AromaticContact CE2-NE1 2.85Å; W91-W95 AromaticContact CE3-CD1 3.77Å; W91-W95 AromaticContact CE3-NE1 3.35Å; W91-W95 AromaticContact CG-CD1 3.85Å; W91-W95 AromaticContact CH2-CE2 3.61Å; W91-W95 AromaticContact CH2-CZ2 3.66Å; W91-W95 HydrophobicContact CH2-CZ2 3.66Å; W91-W95 AromaticContact CH2-NE1 2.99Å; W91-W95 AromaticContact CZ2-CD1 3.77Å; W91-W95 AromaticContact CZ2-CE2 3.53Å; W91-W95 AromaticContact CZ2-CZ2 3.76Å; W91-W95 HydrophobicContact CZ2-CZ2 3.76Å; W91-W95 AromaticContact CZ2-NE1 2.79Å; W91-W95 HydrophobicContact CZ3-CZ2 4.45Å; W91-W95 AromaticContact CZ3-NE1 3.24Å; W91-W95 AromaticContact NE1-CD1 3.55Å; W91-W95 AromaticContact NE1-NE1 3.49Å; W91-W95 PolarHBondContact O-N 3.39Å; K92-W95 PolarHBondContact O-N 3.46Å; W95-Q97 VanDerWaalsContact C-N 3.27Å; W95-Q97 PolarHBondContact O-N 2.96Å; W95-V98 PolarHBondContact O-N 2.84Å; W95-I99 WeakPolarHBondContact O-CB 3.43Å; W95-I99 VanDerWaalsContact O-CG1 3.26Å; W95-I99 WeakPolarHBondContact O-CG1 3.48Å; W95-I99 PolarHBondContact O-N 2.78Å
96	A	94.8	Very high	90	Very high	60 Å²	60	106.3 Å²	106.3	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-38.6	175.9	0	0	0	0	0	111.7	K92 R93 Q94 L100	K92-A96 WeakPolarHBondContact O-CB 3.07Å; K92-A96 PolarHBondContact O-N 2.82Å; R93-A96 PolarHBondContact O-N 3.16Å; Q94-A96 VanDerWaalsContact C-N 3.35Å; Q94-A96 PolarHBondContact O-N 3.12Å; A96-L100 VanDerWaalsContact O-CB 3.32Å; A96-L100 WeakPolarHBondContact O-CB 3.25Å; A96-L100 PolarHBondContact O-N 3.14Å
97	Q	95.6	Very high	90.5	Very high	108 Å²	108	105.2 Å²	105.2	51%	0.505	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.6	-177.6	175.1	-15.3	0	0	112.1	R93 Q94 W95 L100 M101	R93-Q97 PolarHBondContact O-N 3.27Å; Q94-Q97 WeakPolarHBondContact O-CB 3.27Å; Q94-Q97 PolarHBondContact O-N 3.26Å; Q94-Q97 VanDerWaalsContact O-N 3.14Å; W95-Q97 VanDerWaalsContact C-N 3.27Å; W95-Q97 PolarHBondContact O-N 2.96Å; Q97-L100 PolarHBondContact O-N 2.81Å; Q97-M101 HydrophobicContact CG-CE 4.02Å; Q97-M101 HydrophobicContact CG-SD 4.29Å; Q97-M101 WeakPolarHBondContact O-CG 3.47Å; Q97-M101 PolarHBondContact O-N 3.4Å
98	V	96.1	Very high	90.8	Very high	82 Å²	82	105.8 Å²	105.8	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-46	176.1	172.2	0	0	0	0	110.8	Q94 W95 L100 M101 L102	Q94-V98 WeakPolarHBondContact O-CG2 3.36Å; Q94-V98 PolarHBondContact O-N 3.24Å; W95-V98 PolarHBondContact O-N 2.84Å; V98-L100 VanDerWaalsContact C-N 3.34Å; V98-L100 PolarHBondContact O-N 3.35Å; V98-M101 PolarHBondContact O-N 2.76Å; V98-L102 WeakPolarHBondContact O-CB 3.34Å; V98-L102 PolarHBondContact O-N 3.32Å
99	I	91.5	Very high	91.3	Very high	88 Å²	88	110 Å²	110	45%	0.451	54%	0.538	S	S	.	.	H	α-helix	trans	-61.9	-43.4	177.1	-67.2	164.8	0	0	0	110.5	W95 L102 E103	W95-I99 WeakPolarHBondContact O-CB 3.43Å; W95-I99 VanDerWaalsContact O-CG1 3.26Å; W95-I99 WeakPolarHBondContact O-CG1 3.48Å; W95-I99 PolarHBondContact O-N 2.78Å; I99-L102 WeakPolarHBondContact O-CB 3.39Å; I99-L102 PolarHBondContact O-N 3.02Å; I99-E103 HydrophobicContact CG2-CG 4.44Å; I99-E103 WeakPolarHBondContact O-CG 3.25Å; I99-E103 PolarHBondContact O-N 3.43Å
100	L	90.9	Very high	91.6	Very high	92 Å²	92	110 Å²	110	48%	0.482	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-42.7	178.6	-177	65.7	0	0	0	112	A96 Q97 V98 L102 E103 Q104	A96-L100 VanDerWaalsContact O-CB 3.32Å; A96-L100 WeakPolarHBondContact O-CB 3.25Å; A96-L100 PolarHBondContact O-N 3.14Å; Q97-L100 PolarHBondContact O-N 2.81Å; V98-L100 VanDerWaalsContact C-N 3.34Å; V98-L100 PolarHBondContact O-N 3.35Å; L100-L102 VanDerWaalsContact C-N 3.31Å; L100-L102 PolarHBondContact O-N 3.27Å; L100-E103 PolarHBondContact O-N 3.46Å; L100-Q104 WeakPolarHBondContact O-CB 3.27Å; L100-Q104 VanDerWaalsContact O-CG 3.29Å; L100-Q104 WeakPolarHBondContact O-CG 3.38Å; L100-Q104 PolarHBondContact O-N 3.37Å
101	M	93.4	Very high	91.6	Very high	112 Å²	112	109.6 Å²	109.6	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-62.5	-40	175.2	-73.7	178.1	169.7	0	0	111.4	Q97 V98 Q104 S105	Q97-M101 HydrophobicContact CG-CE 4.02Å; Q97-M101 HydrophobicContact CG-SD 4.29Å; Q97-M101 WeakPolarHBondContact O-CG 3.47Å; Q97-M101 PolarHBondContact O-N 3.4Å; V98-M101 PolarHBondContact O-N 2.76Å; M101-Q104 PolarHBondContact O-N 2.84Å; M101-S105 PolarHBondContact O-N 2.83Å; M101-S105 VanDerWaalsContact O-N 3.09Å
102	L	92.3	Very high	91.4	Very high	116 Å²	116	108.1 Å²	108.1	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-39.8	175	-176.5	65.3	0	0	0	112.3	V98 I99 L100 Q104 S105	V98-L102 WeakPolarHBondContact O-CB 3.34Å; V98-L102 PolarHBondContact O-N 3.32Å; I99-L102 WeakPolarHBondContact O-CB 3.39Å; I99-L102 PolarHBondContact O-N 3.02Å; L100-L102 VanDerWaalsContact C-N 3.31Å; L100-L102 PolarHBondContact O-N 3.27Å; L102-Q104 PolarHBondContact O-N 2.81Å; L102-S105 PolarHBondContact O-N 3.17Å; L102-S105 PolarHBondContact O-OG 2.95Å
103	E	88.4	Confident	91.3	Very high	58 Å²	58	104 Å²	104	27%	0.271	53%	0.525	S	S	.	.	H	α-helix	trans	-68.2	-24	174.3	-76.1	-164	153.3	0	0	112.7	I99 L100 I106 R111 Y118	I99-E103 HydrophobicContact CG2-CG 4.44Å; I99-E103 WeakPolarHBondContact O-CG 3.25Å; I99-E103 PolarHBondContact O-N 3.43Å; L100-E103 PolarHBondContact O-N 3.46Å; E103-I106 WeakPolarHBondContact O-CG1 3.23Å; E103-R111 WeakPolarHBondContact O-CD 3.28Å; E103-Y118 PolarHBondContact OE1-OH 3.46Å
104	Q	88.3	Confident	91.1	Very high	118 Å²	118	96.3 Å²	96.3	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-85.2	-21.8	177	-73.1	179	13.4	0	0	113.5	L100 M101 L102 I106	L100-Q104 WeakPolarHBondContact O-CB 3.27Å; L100-Q104 VanDerWaalsContact O-CG 3.29Å; L100-Q104 WeakPolarHBondContact O-CG 3.38Å; L100-Q104 PolarHBondContact O-N 3.37Å; M101-Q104 PolarHBondContact O-N 2.84Å; L102-Q104 PolarHBondContact O-N 2.81Å; Q104-I106 VanDerWaalsContact C-N 3.28Å; Q104-I106 PolarHBondContact O-N 2.99Å
105	S	91	Very high	90.7	Very high	93 Å²	93	94.3 Å²	94.3	65%	0.65	50%	0.496	S	S	*	.	H	α-helix	trans	-76.6	-14.4	178	69.6	0	0	0	0	113.6	M101 L102	M101-S105 PolarHBondContact O-N 2.83Å; M101-S105 VanDerWaalsContact O-N 3.09Å; L102-S105 PolarHBondContact O-N 3.17Å; L102-S105 PolarHBondContact O-OG 2.95Å
106	I	89.4	Confident	90.2	Very high	60 Å²	60	92.3 Å²	92.3	31%	0.308	49%	0.494	S	S	.	.	S	Bend	trans	-86.4	153.7	176.4	61	164.1	0	0	0	112.5	E103 Q104 R111	E103-I106 WeakPolarHBondContact O-CG1 3.23Å; Q104-I106 VanDerWaalsContact C-N 3.28Å; Q104-I106 PolarHBondContact O-N 2.99Å; I106-R111 VanDerWaalsContact CD1-CA 3.49Å; I106-R111 HydrophobicContact CD1-CB 3.78Å; I106-R111 HydrophobicContact CD1-CG 4.24Å; I106-R111 HydrophobicContact CG1-CB 3.97Å; I106-R111 HydrophobicContact CG1-CG 4.43Å
107	N	91.9	Very high	89.8	Confident	109 Å²	109	98.5 Å²	98.5	58%	0.583	51%	0.509	S	S	*	.			trans	-55.8	140.4	178.7	-81.1	-43.4	0	0	0	112.1	K109 Q110 R111	N107-K109 PolarHBondContact O-N 3.29Å; N107-K109 VanDerWaalsContact O-N 3.1Å; N107-Q110 PolarHBondContact O-N 3.19Å; N107-R111 PolarHBondContact O-N 3.45Å
108	P	89.6	Confident	89.2	Confident	84 Å²	84	98 Å²	98	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-31.8	-172.3	22.6	-33.8	0	0	0	113.4	L112	P108-L112 PolarHBondContact O-N 2.87Å; P108-L112 VanDerWaalsContact O-N 3.07Å
109	K	90.7	Very high	88.7	Confident	185 Å²	185	94.5 Å²	94.5	80%	0.804	48%	0.483	S	S	*	.	H	α-helix	trans	-66.1	-41.8	175.4	-65.7	-176.3	-179.4	178.8	0	112.2	N107 A113	N107-K109 PolarHBondContact O-N 3.29Å; N107-K109 VanDerWaalsContact O-N 3.1Å; K109-A113 PolarHBondContact O-N 3.36Å
110	Q	90	Very high	88.3	Confident	120 Å²	120	98.6 Å²	98.6	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-73.7	-37.8	177.8	-67.8	176.9	-4.8	0	0	111.3	N107 L112 A113 A114	N107-Q110 PolarHBondContact O-N 3.19Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; Q110-L112 PolarHBondContact O-N 3.12Å; Q110-A113 WeakPolarHBondContact O-CB 3.35Å; Q110-A113 PolarHBondContact O-N 3.05Å; Q110-A113 VanDerWaalsContact O-N 3.1Å; Q110-A114 PolarHBondContact O-N 3.37Å
111	R	87.9	Confident	87.9	Confident	111 Å²	111	97.6 Å²	97.6	42%	0.419	49%	0.492	S	S	.	.	H	α-helix	trans	-57.4	-44.4	173.7	-170.5	178.6	69	-165.3	1.2	112.1	E103 I106 N107 A114 L115	E103-R111 WeakPolarHBondContact O-CD 3.28Å; I106-R111 VanDerWaalsContact CD1-CA 3.49Å; I106-R111 HydrophobicContact CD1-CB 3.78Å; I106-R111 HydrophobicContact CD1-CG 4.24Å; I106-R111 HydrophobicContact CG1-CB 3.97Å; I106-R111 HydrophobicContact CG1-CG 4.43Å; N107-R111 PolarHBondContact O-N 3.45Å; R111-A114 PolarHBondContact O-N 2.95Å; R111-L115 WeakPolarHBondContact O-CB 3.39Å; R111-L115 PolarHBondContact O-N 3.25Å
112	L	87	Confident	87.1	Confident	100 Å²	100	98 Å²	98	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-48.7	174	-179.5	60.5	0	0	0	110.4	P108 Q110 A114 L115 L116	P108-L112 PolarHBondContact O-N 2.87Å; P108-L112 VanDerWaalsContact O-N 3.07Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; Q110-L112 PolarHBondContact O-N 3.12Å; L112-A114 VanDerWaalsContact C-N 3.31Å; L112-A114 PolarHBondContact O-N 2.85Å; L112-L115 WeakPolarHBondContact O-CB 3.35Å; L112-L115 PolarHBondContact O-N 3.11Å; L112-L116 HydrophobicContact CD1-CD2 4.47Å; L112-L116 HydrophobicContact CD1-CG 4.4Å; L112-L116 HydrophobicContact CG-CD1 4.41Å; L112-L116 HydrophobicContact CG-CG 4.45Å; L112-L116 VanDerWaalsContact O-CG 3.22Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 2.87Å
113	A	88.1	Confident	86.3	Confident	59 Å²	59	95.8 Å²	95.8	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-58.9	-39.7	177.9	0	0	0	0	0	113.1	K109 Q110 L116 K117	K109-A113 PolarHBondContact O-N 3.36Å; Q110-A113 WeakPolarHBondContact O-CB 3.35Å; Q110-A113 PolarHBondContact O-N 3.05Å; Q110-A113 VanDerWaalsContact O-N 3.1Å; A113-L116 PolarHBondContact O-N 2.99Å; A113-K117 PolarHBondContact O-N 3.18Å
114	A	86	Confident	85.7	Confident	38 Å²	38	101.2 Å²	101.2	31%	0.314	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-47.2	174.3	0	0	0	0	0	111.6	Q110 R111 L112 L116 K117 Y118	Q110-A114 PolarHBondContact O-N 3.37Å; R111-A114 PolarHBondContact O-N 2.95Å; L112-A114 VanDerWaalsContact C-N 3.31Å; L112-A114 PolarHBondContact O-N 2.85Å; A114-L116 VanDerWaalsContact C-N 3.27Å; A114-L116 PolarHBondContact O-N 3.38Å; A114-K117 VanDerWaalsContact O-CB 3.23Å; A114-K117 WeakPolarHBondContact O-CB 3.31Å; A114-K117 PolarHBondContact O-N 3.46Å; A114-Y118 WeakPolarHBondContact O-CD1 3.46Å; A114-Y118 VanDerWaalsContact O-CE1 3.25Å; A114-Y118 WeakPolarHBondContact O-CE1 3.35Å
115	L	86.2	Confident	85.1	Confident	69 Å²	69	100.3 Å²	100.3	36%	0.361	53%	0.527	S	S	.	.	H	α-helix	trans	-56.7	-40.3	174.3	175.4	63.5	0	0	0	112.2	R111 L112 K117 Y118 S119	R111-L115 WeakPolarHBondContact O-CB 3.39Å; R111-L115 PolarHBondContact O-N 3.25Å; L112-L115 WeakPolarHBondContact O-CB 3.35Å; L112-L115 PolarHBondContact O-N 3.11Å; L115-K117 PolarHBondContact O-N 2.97Å; L115-Y118 HydrophobicContact CD1-CD2 4.26Å; L115-Y118 HydrophobicContact CD1-CE2 3.37Å; L115-Y118 HydrophobicContact CG-CE2 4.5Å; L115-Y118 PolarHBondContact O-N 3.27Å; L115-S119 WeakPolarHBondContact O-CB 3.46Å; L115-S119 PolarHBondContact O-N 2.98Å; L115-S119 PolarHBondContact O-OG 3.48Å
116	L	85.2	Confident	84.2	Confident	77 Å²	77	106 Å²	106	40%	0.403	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-24.8	177	-64.8	179.5	0	0	0	112.9	L112 A113 A114	L112-L116 HydrophobicContact CD1-CD2 4.47Å; L112-L116 HydrophobicContact CD1-CG 4.4Å; L112-L116 HydrophobicContact CG-CD1 4.41Å; L112-L116 HydrophobicContact CG-CG 4.45Å; L112-L116 VanDerWaalsContact O-CG 3.22Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 2.87Å; A113-L116 PolarHBondContact O-N 2.99Å; A114-L116 VanDerWaalsContact C-N 3.27Å; A114-L116 PolarHBondContact O-N 3.38Å
117	K	85.9	Confident	83.5	Confident	189 Å²	189	112.8 Å²	112.8	82%	0.822	56%	0.562	S	S	*	*	H	α-helix	trans	-74.5	-36.8	-178.6	-166.9	175.6	-179.1	179.1	0	112.7	A113 A114 L115	A113-K117 PolarHBondContact O-N 3.18Å; A114-K117 VanDerWaalsContact O-CB 3.23Å; A114-K117 WeakPolarHBondContact O-CB 3.31Å; A114-K117 PolarHBondContact O-N 3.46Å; L115-K117 PolarHBondContact O-N 2.97Å
118	Y	83.8	Confident	83	Confident	97 Å²	97	115.6 Å²	115.6	38%	0.38	56%	0.564	S	S	.	*	H	α-helix	trans	-105.2	-11.7	-178.3	57.9	-105.5	0	0	0	114.6	E103 A114 L115	E103-Y118 PolarHBondContact OE1-OH 3.46Å; A114-Y118 WeakPolarHBondContact O-CD1 3.46Å; A114-Y118 VanDerWaalsContact O-CE1 3.25Å; A114-Y118 WeakPolarHBondContact O-CE1 3.35Å; L115-Y118 HydrophobicContact CD1-CD2 4.26Å; L115-Y118 HydrophobicContact CD1-CE2 3.37Å; L115-Y118 HydrophobicContact CG-CE2 4.5Å; L115-Y118 PolarHBondContact O-N 3.27Å
119	S	85.9	Confident	82.5	Confident	10 Å²	10	116.6 Å²	116.6	7%	0.07	56%	0.557	C	S	.	*			trans	-92.7	143.7	174.3	66.9	0	0	0	0	112.5	L115 R129	L115-S119 WeakPolarHBondContact O-CB 3.46Å; L115-S119 PolarHBondContact O-N 2.98Å; L115-S119 PolarHBondContact O-OG 3.48Å; S119-R129 PolarHBondContact OG-NH1 2.94Å; S119-R129 VanDerWaalsContact OG-NH1 3.16Å
120	R	83.5	Confident	82.1	Confident	173 Å²	173	109.7 Å²	109.7	65%	0.653	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	142	174.6	-66.1	-66.2	-176	164.8	-1.7	110.4	R129 A130 V132	R120-R129 CarbonylContact O-C 3.52Å; R120-R129 VanDerWaalsContact O-CA 3.28Å; R120-R129 WeakPolarHBondContact O-CA 3.33Å; R120-A130 PolarHBondContact N-O 3.16Å; R120-A130 PolarHBondContact O-N 3.14Å; R120-V132 HydrophobicContact CB-CG2 4.32Å; R120-V132 HydrophobicContact CG-CG2 4.31Å
121	P	82.2	Confident	81.7	Confident	72 Å²	72	111 Å²	111	47%	0.468	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	141.2	174.3	28.3	-33.4	0	0	0	110.2	R128	P121-R128 CarbonylContact C-O 3.59Å; P121-R128 WeakPolarHBondContact CA-O 3.18Å
122	M	76.5	Confident	81.2	Confident	119 Å²	119	110.9 Å²	110.9	59%	0.586	55%	0.55	S	S	*	*			trans	-97	112.5	178.8	-174.6	-179.7	-178.1	0	0	109.1	R128 A130	M122-R128 HydrophobicContact CB-CB 4.07Å; M122-R128 PolarHBondContact N-O 3.06Å; M122-A130 HydrophobicContact CB-CB 4.42Å
123	G	75.9	Confident	80.8	Confident	70 Å²	70	111 Å²	111	72%	0.722	56%	0.555	S	S	*	*	S	Bend	trans	69.6	-147.5	179.3	0	0	0	0	0	113.1
124	I	75.1	Confident	80.4	Confident	172 Å²	172	118.9 Å²	118.9	88%	0.882	57%	0.572	S	S	*	*	S	Bend	trans	-76.6	-29.9	-178.1	-54.1	167.4	0	0	0	110.7	R126	I124-R126 PolarHBondContact O-N 3.31Å
125	D	75.7	Confident	79.9	Confident	99 Å²	99	123 Å²	123	53%	0.529	59%	0.586	S	S	.	*			trans	-76.7	117.4	-175.9	-70.3	-25.3	0	0	0	112.3	K127 R128	D125-K127 PolarHBondContact O-N 3.43Å; D125-R128 PolarHBondContact O-N 2.91Å
126	R	71.4	Confident	79.3	Confident	214 Å²	214	130.1 Å²	130.1	81%	0.808	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-14	175	-61.7	-170.7	-176.9	-155.8	1.9	114.1	I124	I124-R126 PolarHBondContact O-N 3.31Å
127	K	75.1	Confident	78.2	Confident	201 Å²	201	132.7 Å²	132.7	87%	0.874	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-36.9	-178.6	-68.9	-175.8	-178.9	179.2	0	112.3	D125	D125-K127 PolarHBondContact O-N 3.43Å
128	R	80.5	Confident	77	Confident	169 Å²	169	130.4 Å²	130.4	64%	0.638	62%	0.617	S	S	*	*			trans	-86.3	129.9	179.3	-65.7	-172.3	-175.5	-113	2.1	109.1	P121 M122 D125	P121-R128 CarbonylContact C-O 3.59Å; P121-R128 WeakPolarHBondContact CA-O 3.18Å; M122-R128 HydrophobicContact CB-CB 4.07Å; M122-R128 PolarHBondContact N-O 3.06Å; D125-R128 PolarHBondContact O-N 2.91Å
129	R	79.8	Confident	76	Confident	105 Å²	105	134.6 Å²	134.6	40%	0.396	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.9	145.5	-178.4	-70.4	175.5	173.5	-87.8	-12.1	110	S119 R120	S119-R129 PolarHBondContact OG-NH1 2.94Å; S119-R129 VanDerWaalsContact OG-NH1 3.16Å; R120-R129 CarbonylContact O-C 3.52Å; R120-R129 VanDerWaalsContact O-CA 3.28Å; R120-R129 WeakPolarHBondContact O-CA 3.33Å
130	A	82.8	Confident	74.5	Confident	40 Å²	40	137.1 Å²	137.1	33%	0.331	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.8	151.4	179.6	0	0	0	0	0	110.4	R120 M122	R120-A130 PolarHBondContact N-O 3.16Å; R120-A130 PolarHBondContact O-N 3.14Å; M122-A130 HydrophobicContact CB-CB 4.42Å
131	F	80.5	Confident	73.3	Confident	147 Å²	147	134.8 Å²	134.8	65%	0.645	65%	0.654	S	S	*	*			trans	-95.7	122.7	168.9	-178.3	-117	0	0	0	108.5	V133	F131-V133 HydrophobicContact CD1-CG2 3.41Å; F131-V133 VanDerWaalsContact CD1-CG2 3.41Å; F131-V133 HydrophobicContact CE1-CG2 3.37Å; F131-V133 HydrophobicContact CZ-CG2 4.46Å; F131-V133 PolarHBondContact O-N 3.29Å
132	V	78.5	Confident	72.2	Confident	109 Å²	109	139.6 Å²	139.6	66%	0.661	67%	0.67	S	S	*	*			trans	-92.4	104.2	-177.2	-178.3	0	0	0	0	108.6	R120	R120-V132 HydrophobicContact CB-CG2 4.32Å; R120-V132 HydrophobicContact CG-CG2 4.31Å
133	V	79.3	Confident	71.3	Confident	102 Å²	102	141.1 Å²	141.1	62%	0.618	68%	0.68	S	S	*	*			trans	-92.3	119	172.9	-177	0	0	0	0	108.9	F131	F131-V133 HydrophobicContact CD1-CG2 3.41Å; F131-V133 VanDerWaalsContact CD1-CG2 3.41Å; F131-V133 HydrophobicContact CE1-CG2 3.37Å; F131-V133 HydrophobicContact CZ-CG2 4.46Å; F131-V133 PolarHBondContact O-N 3.29Å
134	R	79.2	Confident	70.4	Confident	225 Å²	225	142.1 Å²	142.1	85%	0.849	67%	0.669	S	S	*	*			trans	-88.1	105	166.4	-171.3	-175.2	-66	-117.5	2.8	108.2	R136	R134-R136 PolarHBondContact O-N 3.24Å
135	M	74.3	Confident	69.7	Low	123 Å²	123	137.4 Å²	137.4	61%	0.606	65%	0.646	S	S	*	*			trans	-62.5	117.9	165.8	-86.9	-91.5	-149.3	0	0	108.5	I137 F151	M135-I137 PolarHBondContact O-N 2.98Å; M135-F151 HydrophobicContact CE-CE1 3.65Å; M135-F151 HydrophobicContact CE-CE2 4.36Å; M135-F151 HydrophobicContact CE-CZ 3.46Å; M135-F151 VanDerWaalsContact CE-CZ 3.46Å
136	R	73.3	Confident	69.2	Low	220 Å²	220	136.9 Å²	136.9	83%	0.83	65%	0.646	S	S	*	*			trans	-83.1	107.4	160.3	-60.2	-170.8	-155	-163.1	7	105.6	R134 L138	R134-R136 PolarHBondContact O-N 3.24Å; R136-L138 PolarHBondContact O-N 2.95Å; R136-L138 VanDerWaalsContact O-N 3.14Å
137	I	63.4	Low	68.9	Low	130 Å²	130	129.5 Å²	129.5	67%	0.667	63%	0.631	S	S	*	*			trans	-72.5	105	167.7	-58.3	166.1	0	0	0	104.1	M135 K139	M135-I137 PolarHBondContact O-N 2.98Å; I137-K139 PolarHBondContact O-N 3.4Å
138	L	61.1	Low	68.4	Low	141 Å²	141	122.6 Å²	122.6	74%	0.738	60%	0.602	S	S	*	*			trans	-54.3	136.3	163.1	-108.7	71.1	0	0	0	106.1	R136 P140	R136-L138 PolarHBondContact O-N 2.95Å; R136-L138 VanDerWaalsContact O-N 3.14Å; L138-P140 VanDerWaalsContact O-N 3.17Å
139	K	61.3	Low	68	Low	185 Å²	185	118.1 Å²	118.1	80%	0.804	59%	0.594	S	S	*	*			trans	-48	129.8	176.3	-81.7	179.3	176.9	175.9	0	107.7	I137 D141	I137-K139 PolarHBondContact O-N 3.4Å; K139-D141 PolarHBondContact O-N 3.13Å
140	P	55.1	Low	67.7	Low	64 Å²	64	119 Å²	119	42%	0.416	60%	0.603	S	S	.	*			trans	-58.9	113.6	180	21.7	-30.7	0	0	0	108.4	L138 N145	L138-P140 VanDerWaalsContact O-N 3.17Å; P140-N145 WeakPolarHBondContact CB-OD1 3.38Å
141	D	58.4	Low	67.3	Low	123 Å²	123	123 Å²	123	66%	0.658	61%	0.614	S	S	*	*			trans	-62.2	133.6	151.3	-55.7	-37.7	0	0	0	105.4	K139 N143 D144	K139-D141 PolarHBondContact O-N 3.13Å; D141-N143 PolarHBondContact O-N 3.38Å; D141-D144 PolarHBondContact O-N 3.2Å
142	E	58.5	Low	67	Low	174 Å²	174	119.2 Å²	119.2	81%	0.813	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-50.8	-22.8	-165.5	-73.7	-174.1	147.6	0	0	115.1	N145	E142-N145 PolarHBondContact O-ND2 3.04Å
143	N	57.8	Low	67	Low	150 Å²	150	117.3 Å²	117.3	80%	0.802	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-76.8	-29	179	-102.7	0.7	0	0	0	114.7	D141 N145	D141-N143 PolarHBondContact O-N 3.38Å; N143-N145 PolarHBondContact O-N 3.46Å
144	D	57	Low	67	Low	91 Å²	91	115.7 Å²	115.7	49%	0.487	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-80.5	-2.3	-177.4	-87.2	-7.3	0	0	0	112.8	D141 T146 A147 Q148	D141-D144 PolarHBondContact O-N 3.2Å; D144-T146 PolarHBondContact O-N 3.47Å; D144-T146 VanDerWaalsContact O-N 3.15Å; D144-A147 PolarHBondContact O-N 3.44Å; D144-A147 VanDerWaalsContact O-N 3.16Å; D144-Q148 HydrophobicContact CB-CG 4.48Å; D144-Q148 VanDerWaalsContact O-CB 3.31Å; D144-Q148 WeakPolarHBondContact O-CB 3.49Å; D144-Q148 VanDerWaalsContact O-CG 3.25Å; D144-Q148 WeakPolarHBondContact O-CG 3.41Å; D144-Q148 PolarHBondContact O-N 2.87Å
145	N	61.7	Low	67	Low	73 Å²	73	106.8 Å²	106.8	39%	0.39	56%	0.556	S	S	.	*	H	α-helix	trans	-53.5	-35.6	176.2	-73.3	-26.6	0	0	0	111.9	P140 E142 N143 T149	P140-N145 WeakPolarHBondContact CB-OD1 3.38Å; E142-N145 PolarHBondContact O-ND2 3.04Å; N143-N145 PolarHBondContact O-N 3.46Å; N145-T149 VanDerWaalsContact O-CB 3.25Å; N145-T149 WeakPolarHBondContact O-CB 3.47Å; N145-T149 WeakPolarHBondContact O-CG2 3.46Å; N145-T149 PolarHBondContact O-N 2.93Å; N145-T149 PolarHBondContact O-OG1 3.38Å
146	T	65.1	Low	67.3	Low	88 Å²	88	105.6 Å²	105.6	54%	0.54	55%	0.552	S	S	.	*	H	α-helix	trans	-70.4	-45.5	179.3	-17.7	0	0	0	0	112.3	D144 T149 M150	D144-T146 PolarHBondContact O-N 3.47Å; D144-T146 VanDerWaalsContact O-N 3.15Å; T146-T149 WeakPolarHBondContact CA-OG1 3.45Å; T146-T149 PolarHBondContact O-OG1 2.9Å; T146-M150 HydrophobicContact CG2-CE 4.25Å; T146-M150 WeakPolarHBondContact O-CG 3.48Å; T146-M150 PolarHBondContact O-N 3.26Å
147	A	64.4	Low	67.7	Low	60 Å²	60	99.5 Å²	99.5	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-68.8	-38.2	177	0	0	0	0	0	111.3	D144 M150 F151	D144-A147 PolarHBondContact O-N 3.44Å; D144-A147 VanDerWaalsContact O-N 3.16Å; A147-M150 PolarHBondContact O-N 2.93Å; A147-F151 WeakPolarHBondContact O-CB 3.31Å; A147-F151 PolarHBondContact O-N 3.15Å
148	Q	65.6	Low	68.5	Low	56 Å²	56	97 Å²	97	26%	0.262	52%	0.521	S	S	.	.	H	α-helix	trans	-68	-42.4	176.4	-70.8	-179	49.4	0	0	112	D144 F151 T152	D144-Q148 HydrophobicContact CB-CG 4.48Å; D144-Q148 VanDerWaalsContact O-CB 3.31Å; D144-Q148 WeakPolarHBondContact O-CB 3.49Å; D144-Q148 VanDerWaalsContact O-CG 3.25Å; D144-Q148 WeakPolarHBondContact O-CG 3.41Å; D144-Q148 PolarHBondContact O-N 2.87Å; Q148-F151 PolarHBondContact O-N 3.13Å; Q148-T152 WeakPolarHBondContact O-CB 3.32Å; Q148-T152 VanDerWaalsContact O-CG2 3.23Å; Q148-T152 WeakPolarHBondContact O-CG2 3.26Å; Q148-T152 PolarHBondContact O-N 3.29Å; Q148-T152 PolarHBondContact O-OG1 3.32Å
149	T	71	Confident	69.3	Low	75 Å²	75	95.4 Å²	95.4	46%	0.46	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-43.3	173.8	49.8	0	0	0	0	110.6	N145 T146 F151 T152 V153	N145-T149 VanDerWaalsContact O-CB 3.25Å; N145-T149 WeakPolarHBondContact O-CB 3.47Å; N145-T149 WeakPolarHBondContact O-CG2 3.46Å; N145-T149 PolarHBondContact O-N 2.93Å; N145-T149 PolarHBondContact O-OG1 3.38Å; T146-T149 WeakPolarHBondContact CA-OG1 3.45Å; T146-T149 PolarHBondContact O-OG1 2.9Å; T149-F151 PolarHBondContact O-N 3.24Å; T149-T152 WeakPolarHBondContact CA-OG1 3.44Å; T149-T152 PolarHBondContact O-N 3.47Å; T149-T152 PolarHBondContact O-OG1 2.98Å; T149-V153 WeakPolarHBondContact O-CB 3.5Å; T149-V153 WeakPolarHBondContact O-CG2 3.38Å; T149-V153 PolarHBondContact O-N 3.29Å
150	M	74.6	Confident	70.3	Confident	122 Å²	122	92.3 Å²	92.3	60%	0.601	50%	0.5	S	S	*	.	H	α-helix	trans	-62.8	-42.3	174.6	-73.1	-166.3	-144.1	0	0	112.8	T146 A147 T154	T146-M150 HydrophobicContact CG2-CE 4.25Å; T146-M150 WeakPolarHBondContact O-CG 3.48Å; T146-M150 PolarHBondContact O-N 3.26Å; A147-M150 PolarHBondContact O-N 2.93Å; M150-T154 VanDerWaalsContact O-CB 3.27Å; M150-T154 WeakPolarHBondContact O-CB 3.37Å; M150-T154 PolarHBondContact O-N 3.35Å; M150-T154 PolarHBondContact O-OG1 2.91Å
151	F	72.8	Confident	71.6	Confident	126 Å²	126	95.9 Å²	95.9	55%	0.553	51%	0.508	S	S	*	.	H	α-helix	trans	-66.7	-44.5	178.6	-177.4	-96.8	0	0	0	112	M135 A147 Q148 T149 T154 A155	M135-F151 HydrophobicContact CE-CE1 3.65Å; M135-F151 HydrophobicContact CE-CE2 4.36Å; M135-F151 HydrophobicContact CE-CZ 3.46Å; M135-F151 VanDerWaalsContact CE-CZ 3.46Å; A147-F151 WeakPolarHBondContact O-CB 3.31Å; A147-F151 PolarHBondContact O-N 3.15Å; Q148-F151 PolarHBondContact O-N 3.13Å; T149-F151 PolarHBondContact O-N 3.24Å; F151-T154 PolarHBondContact O-N 3.12Å; F151-A155 VanDerWaalsContact O-CB 3.28Å; F151-A155 WeakPolarHBondContact O-CB 3.49Å; F151-A155 PolarHBondContact O-N 3.42Å
152	T	74	Confident	72.7	Confident	67 Å²	67	97.1 Å²	97.1	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-40.2	177.8	53.8	0	0	0	0	111.6	Q148 T149 A155 N156	Q148-T152 WeakPolarHBondContact O-CB 3.32Å; Q148-T152 VanDerWaalsContact O-CG2 3.23Å; Q148-T152 WeakPolarHBondContact O-CG2 3.26Å; Q148-T152 PolarHBondContact O-N 3.29Å; Q148-T152 PolarHBondContact O-OG1 3.32Å; T149-T152 WeakPolarHBondContact CA-OG1 3.44Å; T149-T152 PolarHBondContact O-N 3.47Å; T149-T152 PolarHBondContact O-OG1 2.98Å; T152-A155 PolarHBondContact O-N 3.41Å; T152-N156 VanDerWaalsContact O-CB 3.27Å; T152-N156 WeakPolarHBondContact O-CB 3.33Å; T152-N156 PolarHBondContact O-N 3.01Å; T152-N156 PolarHBondContact O-ND2 3.25Å
153	V	79.6	Confident	73.9	Confident	69 Å²	69	95.7 Å²	95.7	42%	0.418	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-46.3	172.1	169.5	0	0	0	0	110.3	T149 A155 N156 Q157	T149-V153 WeakPolarHBondContact O-CB 3.5Å; T149-V153 WeakPolarHBondContact O-CG2 3.38Å; T149-V153 PolarHBondContact O-N 3.29Å; V153-A155 PolarHBondContact O-N 3.07Å; V153-N156 PolarHBondContact O-N 3.49Å; V153-Q157 HydrophobicContact CG1-CG 4.27Å; V153-Q157 WeakPolarHBondContact O-CB 3.35Å; V153-Q157 VanDerWaalsContact O-CG 3.25Å; V153-Q157 WeakPolarHBondContact O-CG 3.48Å; V153-Q157 PolarHBondContact O-N 3.31Å
154	T	78.6	Confident	75	Confident	68 Å²	68	92.9 Å²	92.9	42%	0.417	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-41.5	178.1	-57.1	0	0	0	0	111.4	M150 F151 N158	M150-T154 VanDerWaalsContact O-CB 3.27Å; M150-T154 WeakPolarHBondContact O-CB 3.37Å; M150-T154 PolarHBondContact O-N 3.35Å; M150-T154 PolarHBondContact O-OG1 2.91Å; F151-T154 PolarHBondContact O-N 3.12Å; T154-N158 VanDerWaalsContact O-CB 3.31Å; T154-N158 WeakPolarHBondContact O-CB 3.42Å; T154-N158 PolarHBondContact O-N 3.48Å; T154-N158 PolarHBondContact O-ND2 3.49Å
155	A	79	Confident	76.1	Confident	37 Å²	37	96.6 Å²	96.6	31%	0.306	50%	0.496	S	S	.	.	H	α-helix	trans	-63.5	-43	175.6	0	0	0	0	0	111.6	F151 T152 V153 N158 M159	F151-A155 VanDerWaalsContact O-CB 3.28Å; F151-A155 WeakPolarHBondContact O-CB 3.49Å; F151-A155 PolarHBondContact O-N 3.42Å; T152-A155 PolarHBondContact O-N 3.41Å; V153-A155 PolarHBondContact O-N 3.07Å; A155-N158 PolarHBondContact O-N 2.82Å; A155-M159 WeakPolarHBondContact O-CG 3.5Å; A155-M159 PolarHBondContact O-N 3.25Å
156	N	80.9	Confident	76.9	Confident	99 Å²	99	100.8 Å²	100.8	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-45.6	177.5	-73.4	-18.3	0	0	0	111.7	T152 V153 N158 M159 E160	T152-N156 VanDerWaalsContact O-CB 3.27Å; T152-N156 WeakPolarHBondContact O-CB 3.33Å; T152-N156 PolarHBondContact O-N 3.01Å; T152-N156 PolarHBondContact O-ND2 3.25Å; V153-N156 PolarHBondContact O-N 3.49Å; N156-N158 VanDerWaalsContact C-N 3.3Å; N156-N158 PolarHBondContact O-N 2.99Å; N156-M159 CarbonylContact O-C 3.58Å; N156-M159 WeakPolarHBondContact O-CA 3.48Å; N156-M159 WeakPolarHBondContact O-CB 3.49Å; N156-M159 PolarHBondContact O-N 3.39Å; N156-E160 WeakPolarHBondContact O-CG 3.48Å; N156-E160 PolarHBondContact O-N 2.8Å
157	Q	82.6	Confident	77.5	Confident	92 Å²	92	103.6 Å²	103.6	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-59.4	-41.2	174.2	-74	177.2	-4.7	0	0	111.7	V153 M159 E160 K161	V153-Q157 HydrophobicContact CG1-CG 4.27Å; V153-Q157 WeakPolarHBondContact O-CB 3.35Å; V153-Q157 VanDerWaalsContact O-CG 3.25Å; V153-Q157 WeakPolarHBondContact O-CG 3.48Å; V153-Q157 PolarHBondContact O-N 3.31Å; Q157-M159 VanDerWaalsContact C-N 3.3Å; Q157-M159 PolarHBondContact O-N 3.09Å; Q157-E160 PolarHBondContact O-N 2.82Å; Q157-K161 WeakPolarHBondContact O-CG 3.28Å; Q157-K161 PolarHBondContact O-N 2.64Å
158	N	80.2	Confident	78.3	Confident	78 Å²	78	108.4 Å²	108.4	42%	0.417	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-32.6	175.6	-73.9	-25	0	0	0	112.3	T154 A155 N156 K162	T154-N158 VanDerWaalsContact O-CB 3.31Å; T154-N158 WeakPolarHBondContact O-CB 3.42Å; T154-N158 PolarHBondContact O-N 3.48Å; T154-N158 PolarHBondContact O-ND2 3.49Å; A155-N158 PolarHBondContact O-N 2.82Å; N156-N158 VanDerWaalsContact C-N 3.3Å; N156-N158 PolarHBondContact O-N 2.99Å; N158-K162 VanDerWaalsContact O-CG 3.31Å; N158-K162 WeakPolarHBondContact O-CG 3.36Å; N158-K162 PolarHBondContact O-N 2.92Å
159	M	77.9	Confident	78.8	Confident	106 Å²	106	108.7 Å²	108.7	52%	0.522	53%	0.53	S	S	.	.	H	α-helix	trans	-70.2	-41.5	173.4	-72.3	-90.2	-77.9	0	0	111.8	A155 N156 Q157 K162 K163	A155-M159 WeakPolarHBondContact O-CG 3.5Å; A155-M159 PolarHBondContact O-N 3.25Å; N156-M159 CarbonylContact O-C 3.58Å; N156-M159 WeakPolarHBondContact O-CA 3.48Å; N156-M159 WeakPolarHBondContact O-CB 3.49Å; N156-M159 PolarHBondContact O-N 3.39Å; Q157-M159 VanDerWaalsContact C-N 3.3Å; Q157-M159 PolarHBondContact O-N 3.09Å; M159-K162 WeakPolarHBondContact O-CB 3.29Å; M159-K162 PolarHBondContact O-N 3.34Å; M159-K163 WeakPolarHBondContact O-CG 3.43Å; M159-K163 PolarHBondContact O-N 3.31Å
160	E	82.5	Confident	79	Confident	121 Å²	121	108.8 Å²	108.8	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-47.1	176.6	-72.8	-177.4	162.5	0	0	111.6	N156 Q157 K162 K163 D164	N156-E160 WeakPolarHBondContact O-CG 3.48Å; N156-E160 PolarHBondContact O-N 2.8Å; Q157-E160 PolarHBondContact O-N 2.82Å; E160-K162 PolarHBondContact O-N 2.91Å; E160-K163 WeakPolarHBondContact O-CB 3.19Å; E160-K163 PolarHBondContact O-N 2.98Å; E160-D164 PolarHBondContact O-N 3.46Å
161	K	82.2	Confident	79.1	Confident	138 Å²	138	106.3 Å²	106.3	60%	0.6	52%	0.519	S	S	*	.	H	α-helix	trans	-55.6	-36.9	173.8	-72.6	175.2	-177.7	175.7	0	112.4	Q157 K165	Q157-K161 WeakPolarHBondContact O-CG 3.28Å; Q157-K161 PolarHBondContact O-N 2.64Å; K161-K165 WeakPolarHBondContact O-CB 3.32Å; K161-K165 PolarHBondContact O-N 3.28Å; K161-K165 VanDerWaalsContact O-N 3.11Å
162	K	81	Confident	79.1	Confident	150 Å²	150	108 Å²	108	65%	0.652	53%	0.526	S	S	*	.	H	α-helix	trans	-68.9	-42.3	175.2	-75.7	174.4	-178.4	178.6	0	112	N158 M159 E160 K165 Y166	N158-K162 VanDerWaalsContact O-CG 3.31Å; N158-K162 WeakPolarHBondContact O-CG 3.36Å; N158-K162 PolarHBondContact O-N 2.92Å; M159-K162 WeakPolarHBondContact O-CB 3.29Å; M159-K162 PolarHBondContact O-N 3.34Å; E160-K162 PolarHBondContact O-N 2.91Å; K162-K165 PolarHBondContact O-N 3.32Å; K162-Y166 PolarHBondContact O-N 3.39Å
163	K	82.7	Confident	79.1	Confident	144 Å²	144	110.8 Å²	110.8	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-62.8	-44	176.4	-72.3	178.1	179.5	179.3	0	111.5	M159 E160 K165 Y166 K167	M159-K163 WeakPolarHBondContact O-CG 3.43Å; M159-K163 PolarHBondContact O-N 3.31Å; E160-K163 WeakPolarHBondContact O-CB 3.19Å; E160-K163 PolarHBondContact O-N 2.98Å; K163-K165 VanDerWaalsContact C-N 3.35Å; K163-K165 PolarHBondContact O-N 3.47Å; K163-Y166 WeakPolarHBondContact O-CB 3.44Å; K163-Y166 PolarHBondContact O-N 3.5Å; K163-K167 PolarHBondContact O-N 2.92Å
164	D	82.5	Confident	78.8	Confident	91 Å²	91	113.4 Å²	113.4	49%	0.487	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-41.1	178.6	-71.7	-18.4	0	0	0	112	E160 Y166 K167 K168	E160-D164 PolarHBondContact O-N 3.46Å; D164-Y166 VanDerWaalsContact C-N 3.3Å; D164-Y166 PolarHBondContact O-N 3.18Å; D164-K167 PolarHBondContact O-N 2.98Å; D164-K168 WeakPolarHBondContact O-CB 3.06Å; D164-K168 WeakPolarHBondContact O-CG 3.15Å; D164-K168 PolarHBondContact O-N 3.19Å
165	K	79.3	Confident	77.8	Confident	168 Å²	168	120.6 Å²	120.6	73%	0.73	57%	0.574	S	S	*	*	H	α-helix	trans	-62.7	-39.6	175.3	-166.3	173.2	-176.5	176.3	0	111.5	K161 K162 K163 S169	K161-K165 WeakPolarHBondContact O-CB 3.32Å; K161-K165 PolarHBondContact O-N 3.28Å; K161-K165 VanDerWaalsContact O-N 3.11Å; K162-K165 PolarHBondContact O-N 3.32Å; K163-K165 VanDerWaalsContact C-N 3.35Å; K163-K165 PolarHBondContact O-N 3.47Å; K165-S169 PolarHBondContact O-N 2.92Å; K165-S169 VanDerWaalsContact O-N 3.13Å
166	Y	77.7	Confident	77.7	Confident	161 Å²	161	124.8 Å²	124.8	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-67.3	-45.2	175.9	-173	-103.7	0	0	0	112.1	K162 K163 D164 K168 S169 L170	K162-Y166 PolarHBondContact O-N 3.39Å; K163-Y166 WeakPolarHBondContact O-CB 3.44Å; K163-Y166 PolarHBondContact O-N 3.5Å; D164-Y166 VanDerWaalsContact C-N 3.3Å; D164-Y166 PolarHBondContact O-N 3.18Å; Y166-K168 VanDerWaalsContact C-N 3.33Å; Y166-K168 PolarHBondContact O-N 3.16Å; Y166-S169 WeakPolarHBondContact O-CB 3.25Å; Y166-S169 PolarHBondContact O-N 2.91Å; Y166-S169 VanDerWaalsContact O-N 3.12Å; Y166-L170 HydrophobicContact CD1-CD1 4.04Å; Y166-L170 HydrophobicContact CE1-CD1 3.42Å; Y166-L170 VanDerWaalsContact CE1-CD1 3.42Å; Y166-L170 PolarHBondContact O-N 3.35Å
167	K	79.5	Confident	77.6	Confident	148 Å²	148	126.1 Å²	126.1	64%	0.643	59%	0.591	S	S	*	*	H	α-helix	trans	-60	-41.9	177	-169.8	177.1	-179.6	-177.8	0	111.7	K163 D164 S169 L170 V171	K163-K167 PolarHBondContact O-N 2.92Å; D164-K167 PolarHBondContact O-N 2.98Å; K167-S169 VanDerWaalsContact C-N 3.34Å; K167-S169 PolarHBondContact O-N 3.35Å; K167-L170 PolarHBondContact O-N 3.33Å; K167-V171 WeakPolarHBondContact O-CG2 3.12Å; K167-V171 PolarHBondContact O-N 3.1Å
168	K	79.4	Confident	77.3	Confident	161 Å²	161	128 Å²	128	70%	0.7	60%	0.6	S	S	*	*	H	α-helix	trans	-64.3	-36.4	175.3	-73.8	179.6	-178.4	-177.5	0	112.8	D164 Y166 K172	D164-K168 WeakPolarHBondContact O-CB 3.06Å; D164-K168 WeakPolarHBondContact O-CG 3.15Å; D164-K168 PolarHBondContact O-N 3.19Å; Y166-K168 VanDerWaalsContact C-N 3.33Å; Y166-K168 PolarHBondContact O-N 3.16Å; K168-K172 WeakPolarHBondContact O-CB 3.23Å; K168-K172 PolarHBondContact O-N 2.96Å; K168-K172 VanDerWaalsContact O-N 3.15Å
169	S	76.1	Confident	77.1	Confident	61 Å²	61	130.9 Å²	130.9	43%	0.427	61%	0.611	S	S	.	*	H	α-helix	trans	-63.5	-47.8	173.5	-168.5	0	0	0	0	111.2	K165 Y166 K167 V171 K172 D173	K165-S169 PolarHBondContact O-N 2.92Å; K165-S169 VanDerWaalsContact O-N 3.13Å; Y166-S169 WeakPolarHBondContact O-CB 3.25Å; Y166-S169 PolarHBondContact O-N 2.91Å; Y166-S169 VanDerWaalsContact O-N 3.12Å; K167-S169 VanDerWaalsContact C-N 3.34Å; K167-S169 PolarHBondContact O-N 3.35Å; S169-V171 VanDerWaalsContact C-N 3.34Å; S169-V171 PolarHBondContact O-N 3.24Å; S169-K172 PolarHBondContact O-N 3.1Å; S169-K172 VanDerWaalsContact O-N 3.13Å; S169-D173 VanDerWaalsContact O-CG 3.31Å; S169-D173 PolarHBondContact O-N 3.32Å
170	L	76.3	Confident	77.1	Confident	77 Å²	77	132.5 Å²	132.5	40%	0.403	62%	0.616	S	S	.	*	H	α-helix	trans	-61.1	-41.2	180	-115.6	160.3	0	0	0	112.5	Y166 K167 K172 D173 I174	Y166-L170 HydrophobicContact CD1-CD1 4.04Å; Y166-L170 HydrophobicContact CE1-CD1 3.42Å; Y166-L170 VanDerWaalsContact CE1-CD1 3.42Å; Y166-L170 PolarHBondContact O-N 3.35Å; K167-L170 PolarHBondContact O-N 3.33Å; L170-K172 VanDerWaalsContact C-N 3.33Å; L170-D173 PolarHBondContact O-N 2.84Å; L170-I174 HydrophobicContact CD2-CD1 4.37Å; L170-I174 WeakPolarHBondContact O-CD1 3.22Å; L170-I174 VanDerWaalsContact O-CG1 3.32Å; L170-I174 WeakPolarHBondContact O-CG1 3.43Å; L170-I174 PolarHBondContact O-N 3.38Å
171	V	76.6	Confident	76.7	Confident	70 Å²	70	133.3 Å²	133.3	42%	0.424	62%	0.62	S	S	.	*	H	α-helix	trans	-66.1	-37.2	176.4	174.1	0	0	0	0	111.2	K167 S169 D173 I174 F175	K167-V171 WeakPolarHBondContact O-CG2 3.12Å; K167-V171 PolarHBondContact O-N 3.1Å; S169-V171 VanDerWaalsContact C-N 3.34Å; S169-V171 PolarHBondContact O-N 3.24Å; V171-D173 VanDerWaalsContact C-N 3.27Å; V171-D173 PolarHBondContact O-N 3.41Å; V171-I174 PolarHBondContact O-N 3.07Å; V171-F175 HydrophobicContact CG1-CD2 3.88Å; V171-F175 HydrophobicContact CG1-CE2 4.03Å; V171-F175 WeakPolarHBondContact O-CD2 3.45Å; V171-F175 PolarHBondContact O-N 2.92Å
172	K	72.8	Confident	76.3	Confident	163 Å²	163	132.9 Å²	132.9	71%	0.709	62%	0.621	S	S	*	*	H	α-helix	trans	-69.9	-23.2	177	-169.3	178.6	178.2	-175.4	0	113.3	K168 S169 L170	K168-K172 WeakPolarHBondContact O-CB 3.23Å; K168-K172 PolarHBondContact O-N 2.96Å; K168-K172 VanDerWaalsContact O-N 3.15Å; S169-K172 PolarHBondContact O-N 3.1Å; S169-K172 VanDerWaalsContact O-N 3.13Å; L170-K172 VanDerWaalsContact C-N 3.33Å
173	D	74.2	Confident	75.9	Confident	125 Å²	125	131.6 Å²	131.6	67%	0.668	62%	0.619	S	S	*	*	H	α-helix	trans	-84.8	-13.8	175.9	-61.1	-30.3	0	0	0	112.1	S169 L170 V171	S169-D173 VanDerWaalsContact O-CG 3.31Å; S169-D173 PolarHBondContact O-N 3.32Å; L170-D173 PolarHBondContact O-N 2.84Å; V171-D173 VanDerWaalsContact C-N 3.27Å; V171-D173 PolarHBondContact O-N 3.41Å
174	I	72.1	Confident	75.4	Confident	124 Å²	124	130.6 Å²	130.6	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-92.4	-27	178.2	-66.8	167	0	0	0	112.2	L170 V171	L170-I174 HydrophobicContact CD2-CD1 4.37Å; L170-I174 WeakPolarHBondContact O-CD1 3.22Å; L170-I174 VanDerWaalsContact O-CG1 3.32Å; L170-I174 WeakPolarHBondContact O-CG1 3.43Å; L170-I174 PolarHBondContact O-N 3.38Å; V171-I174 PolarHBondContact O-N 3.07Å
175	F	58.1	Low	74.7	Confident	218 Å²	218	134.2 Å²	134.2	96%	0.956	63%	0.63	S	S	*	*			trans	-111.8	0	178	-69.4	-79	0	0	0	111.5	V171	V171-F175 HydrophobicContact CG1-CD2 3.88Å; V171-F175 HydrophobicContact CG1-CE2 4.03Å; V171-F175 WeakPolarHBondContact O-CD2 3.45Å; V171-F175 PolarHBondContact O-N 2.92Å

Retrieved 175 of 175 residues in 119.5 ms (Link to these results)

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