A0A3Q0KQ64_SCHMA Loading...

Rtdr1, putative

AlphaFold DB , UniProt , Accession A0A3Q0KQ64, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 323 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	37.2	Very low	50.9	Low	239 Å²	239	138.3 Å²	138.3	100%	1.177	78%	0.781	S	S	*	*				0	108.1	0	-79.5	177.5	168.9	0	0	108	L3	M1-L3 PolarHBondContact O-N 3.35Å
2	A	44.7	Very low	51.7	Low	102 Å²	102	138.3 Å²	138.3	84%	0.843	79%	0.79	S	S	*	*			trans	-81.2	107.2	173	0	0	0	0	0	108	V4	A2-V4 PolarHBondContact O-N 3.01Å
3	L	43.8	Very low	52.2	Low	158 Å²	158	140.2 Å²	140.2	83%	0.827	80%	0.797	S	S	*	*			trans	-73.4	114.9	173.9	-78.9	155.2	0	0	0	108.2	M1 T5	M1-L3 PolarHBondContact O-N 3.35Å; L3-T5 PolarHBondContact O-N 3.04Å; L3-T5 VanDerWaalsContact O-N 3.11Å
4	V	43.4	Very low	52.5	Low	135 Å²	135	134.5 Å²	134.5	82%	0.818	77%	0.766	S	S	*	*			trans	-76.4	95	173	-179	0	0	0	0	107.6	A2 I6	A2-V4 PolarHBondContact O-N 3.01Å; V4-I6 PolarHBondContact O-N 2.89Å
5	T	51.6	Low	53	Low	119 Å²	119	130.1 Å²	130.1	73%	0.73	74%	0.74	S	S	*	*			trans	-81.2	110.7	172.6	-31.8	0	0	0	0	108.6	L3 S7	L3-T5 PolarHBondContact O-N 3.04Å; L3-T5 VanDerWaalsContact O-N 3.11Å; T5-S7 PolarHBondContact O-N 3.1Å
6	I	48.6	Very low	53.4	Low	169 Å²	169	126.9 Å²	126.9	87%	0.867	73%	0.725	S	S	*	*			trans	-69.2	99.2	170.7	-58.1	172.5	0	0	0	107	V4	V4-I6 PolarHBondContact O-N 2.89Å
7	S	61.1	Low	53.8	Low	70 Å²	70	124.8 Å²	124.8	49%	0.49	72%	0.716	S	S	.	*			trans	-110	136.1	178.6	158.8	0	0	0	0	109.6	T5 K9	T5-S7 PolarHBondContact O-N 3.1Å; S7-K9 PolarHBondContact O-N 3.44Å; S7-K9 WeakPolarHBondContact OG-CB 3.46Å; S7-K9 PolarHBondContact OG-N 2.87Å; S7-K9 PolarHBondContact OG-O 3.05Å
8	L	60.7	Low	54.2	Low	187 Å²	187	126.1 Å²	126.1	98%	0.979	71%	0.711	S	S	*	*	S	Bend	trans	-69.3	-12.9	169.8	-81.7	161	0	0	0	113.1
9	K	55	Low	54.5	Low	170 Å²	170	120.5 Å²	120.5	74%	0.739	68%	0.683	S	S	*	*	S	Bend	trans	-81.5	131.2	175.1	-60.1	-176	178.5	-178.3	0	109.7	S7	S7-K9 PolarHBondContact O-N 3.44Å; S7-K9 WeakPolarHBondContact OG-CB 3.46Å; S7-K9 PolarHBondContact OG-N 2.87Å; S7-K9 PolarHBondContact OG-O 3.05Å
10	P	55.6	Low	55.1	Low	88 Å²	88	118.2 Å²	118.2	57%	0.571	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-57.8	153.5	175.7	22.5	-31	0	0	0	110.9
11	P	57.8	Low	55.5	Low	84 Å²	84	117.2 Å²	117.2	55%	0.545	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-55.7	145.3	176.2	-15.2	25.4	0	0	0	110.1	N13 V14	P11-N13 PolarHBondContact O-N 3.11Å; P11-V14 HydrophobicContact CB-CG2 3.97Å; P11-V14 HydrophobicContact CG-CG2 3.78Å; P11-V14 PolarHBondContact O-N 2.83Å
12	P	60.7	Low	56.8	Low	138 Å²	138	107.2 Å²	107.2	90%	0.896	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-7.4	-169.3	21.6	-32.3	0	0	0	115.4
13	N	58.2	Low	57.5	Low	163 Å²	163	113.1 Å²	113.1	87%	0.872	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	14.2	-179	-101.6	-8.9	0	0	0	114.5	P11	P11-N13 PolarHBondContact O-N 3.11Å
14	V	56.8	Low	58.7	Low	61 Å²	61	107.5 Å²	107.5	37%	0.37	60%	0.601	S	S	.	*			trans	-98.5	104.8	175.1	-177.1	0	0	0	0	108.8	P11 P16 T20	P11-V14 HydrophobicContact CB-CG2 3.97Å; P11-V14 HydrophobicContact CG-CG2 3.78Å; P11-V14 PolarHBondContact O-N 2.83Å; V14-P16 VanDerWaalsContact O-CD 3.24Å; V14-P16 WeakPolarHBondContact O-CD 3.3Å; V14-T20 HydrophobicContact CG1-CG2 4.31Å
15	D	60	Low	60	Low	69 Å²	69	110.5 Å²	110.5	37%	0.369	60%	0.598	S	S	.	*			trans	-65.3	110.5	166	179.7	-8.4	0	0	0	107.8	T17 K18	D15-T17 PolarHBondContact O-N 3.28Å; D15-T17 WeakPolarHBondContact OD1-CB 3.48Å; D15-T17 PolarHBondContact OD1-N 3.49Å; D15-T17 PolarHBondContact OD1-OG1 3.29Å; D15-T17 PolarHBondContact OD2-OG1 2.93Å; D15-K18 HydrophobicContact CB-CB 4.42Å; D15-K18 HydrophobicContact CB-CD 4.37Å; D15-K18 HydrophobicContact CB-CG 4.3Å; D15-K18 PolarHBondContact O-N 2.87Å; D15-K18 VanDerWaalsContact O-N 3.13Å
16	P	58.9	Low	61.4	Low	79 Å²	79	110 Å²	110	51%	0.513	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-18.6	-177.1	27.8	-34.3	0	0	0	111.3	V14 R45	V14-P16 VanDerWaalsContact O-CD 3.24Å; V14-P16 WeakPolarHBondContact O-CD 3.3Å; P16-R45 PolarHBondContact O-NE 2.65Å; P16-R45 VanDerWaalsContact O-NE 3.15Å; P16-R45 PolarHBondContact O-NH1 3.45Å; P16-R45 PolarHBondContact O-NH2 3.19Å
17	T	60.1	Low	63.2	Low	91 Å²	91	102.1 Å²	102.1	56%	0.558	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-9.8	-178.8	72.5	0	0	0	0	113.9	D15	D15-T17 PolarHBondContact O-N 3.28Å; D15-T17 WeakPolarHBondContact OD1-CB 3.48Å; D15-T17 PolarHBondContact OD1-N 3.49Å; D15-T17 PolarHBondContact OD1-OG1 3.29Å; D15-T17 PolarHBondContact OD2-OG1 2.93Å
18	K	61.5	Low	64.6	Low	147 Å²	147	98.8 Å²	98.8	64%	0.639	53%	0.527	S	S	*	.	S	Bend	trans	-104.1	136.3	178.3	-68.2	-174.5	-178.4	-173.2	0	111.1	D15 T20	D15-K18 HydrophobicContact CB-CB 4.42Å; D15-K18 HydrophobicContact CB-CD 4.37Å; D15-K18 HydrophobicContact CB-CG 4.3Å; D15-K18 PolarHBondContact O-N 2.87Å; D15-K18 VanDerWaalsContact O-N 3.13Å; K18-T20 PolarHBondContact O-N 3.08Å
19	A	60.4	Low	66.1	Low	21 Å²	21	95.1 Å²	95.1	17%	0.174	50%	0.503	C	S	.	.			trans	-63	131.6	167.1	0	0	0	0	0	108.9	L21 R45 A49	A19-L21 PolarHBondContact O-N 3.32Å; A19-L21 VanDerWaalsContact O-N 3.14Å; A19-R45 HydrophobicContact CB-CB 4.22Å; A19-A49 HydrophobicContact CB-CB 3.87Å
20	T	65.2	Low	67.8	Low	74 Å²	74	90.7 Å²	90.7	45%	0.454	48%	0.482	S	S	.	.			trans	-72.8	105.7	171.3	45.4	0	0	0	0	108.5	V14 K18 A22 R30	V14-T20 HydrophobicContact CG1-CG2 4.31Å; K18-T20 PolarHBondContact O-N 3.08Å; T20-A22 PolarHBondContact O-N 3.24Å; T20-R30 VanDerWaalsContact O-CZ 3.27Å; T20-R30 PolarHBondContact O-NH1 3.3Å; T20-R30 PolarHBondContact OG1-NH1 3.34Å; T20-R30 PolarHBondContact OG1-NH2 3.48Å
21	L	64	Low	69.6	Low	98 Å²	98	86.7 Å²	86.7	51%	0.513	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-64.1	126.5	175.1	-71.9	165.1	0	0	0	109.2	A19 A27 I31 Y53	A19-L21 PolarHBondContact O-N 3.32Å; A19-L21 VanDerWaalsContact O-N 3.14Å; L21-A27 HydrophobicContact CD2-CB 4.37Å; L21-I31 HydrophobicContact CD2-CD1 3.54Å; L21-I31 HydrophobicContact CD2-CG1 4.28Å; L21-Y53 HydrophobicContact CD2-CD2 4.38Å
22	A	64.6	Low	71.4	Confident	28 Å²	28	83.5 Å²	83.5	23%	0.231	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-67.6	151.6	168.5	0	0	0	0	0	109.4	T20 L26 A27	T20-A22 PolarHBondContact O-N 3.24Å; A22-L26 HydrophobicContact CB-CB 3.96Å; A22-A27 WeakPolarHBondContact O-CB 3.46Å
23	Y	60.2	Low	73	Confident	227 Å²	227	85.1 Å²	85.1	89%	0.89	42%	0.422	S	S	*	.	S	Bend	trans	-69.8	133.6	-177.2	-175	-98.8	0	0	0	112
24	G	69.1	Low	74.8	Confident	39 Å²	39	78.4 Å²	78.4	40%	0.402	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	-141.2	174.8	0	0	0	0	0	114	L26 A27	G24-L26 PolarHBondContact O-N 3.49Å; G24-A27 VanDerWaalsContact O-CB 3.28Å; G24-A27 WeakPolarHBondContact O-CB 3.29Å; G24-A27 PolarHBondContact O-N 2.85Å
25	R	70.2	Confident	76.7	Confident	199 Å²	199	75.6 Å²	75.6	75%	0.751	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-13.5	-175.4	-65.1	-177.4	176.5	176.5	0.2	115.6	A27	R25-A27 VanDerWaalsContact C-N 3.34Å
26	L	80.6	Confident	78.4	Confident	109 Å²	109	78.5 Å²	78.5	57%	0.571	38%	0.377	S	S	*	.	H	α-helix	trans	-81.9	-14.8	177	-63.2	179.8	0	0	0	112.9	A22 G24 K29 R30	A22-L26 HydrophobicContact CB-CB 3.96Å; G24-L26 PolarHBondContact O-N 3.49Å; L26-K29 HydrophobicContact CD2-CD 4.29Å; L26-R30 WeakPolarHBondContact O-CB 3.33Å; L26-R30 PolarHBondContact O-N 3.34Å; L26-R30 VanDerWaalsContact O-N 3.13Å
27	A	86.3	Confident	80.2	Confident	3 Å²	3	77 Å²	77	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-55.1	-57.7	179.1	0	0	0	0	0	110.9	L21 A22 G24 R25 K29 R30 I31 Y53	L21-A27 HydrophobicContact CD2-CB 4.37Å; A22-A27 WeakPolarHBondContact O-CB 3.46Å; G24-A27 VanDerWaalsContact O-CB 3.28Å; G24-A27 WeakPolarHBondContact O-CB 3.29Å; G24-A27 PolarHBondContact O-N 2.85Å; R25-A27 VanDerWaalsContact C-N 3.34Å; A27-K29 PolarHBondContact O-N 3Å; A27-R30 PolarHBondContact O-N 3.21Å; A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.46Å; A27-I31 PolarHBondContact O-N 3.14Å; A27-Y53 HydrophobicContact CB-CE2 4.16Å
28	I	90.1	Very high	81.8	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-64	-42.6	-176.1	-59.3	-174.4	0	0	0	111.6	R30 I31 N32 Y53 E62 A63 E66 T68	I28-R30 VanDerWaalsContact C-N 3.26Å; I28-R30 PolarHBondContact O-N 3.05Å; I28-I31 PolarHBondContact O-N 2.9Å; I28-N32 VanDerWaalsContact O-CB 3.22Å; I28-N32 WeakPolarHBondContact O-CB 3.39Å; I28-N32 PolarHBondContact O-N 3.33Å; I28-Y53 HydrophobicContact CD1-CD1 4.21Å; I28-Y53 HydrophobicContact CD1-CE1 3.56Å; I28-Y53 HydrophobicContact CG1-CD1 3.98Å; I28-Y53 HydrophobicContact CG1-CE1 3.4Å; I28-E62 HydrophobicContact CD1-CB 3.26Å; I28-E62 HydrophobicContact CD1-CG 4.46Å; I28-A63 HydrophobicContact CD1-CB 4.13Å; I28-A63 HydrophobicContact CG2-CB 4.36Å; I28-E66 HydrophobicContact CB-CG 4.26Å; I28-E66 HydrophobicContact CG2-CB 3.65Å; I28-E66 HydrophobicContact CG2-CG 3.7Å; I28-T68 HydrophobicContact CG2-CG2 3.89Å
29	K	91.8	Very high	83.5	Confident	110 Å²	110	77.2 Å²	77.2	48%	0.478	37%	0.371	S	S	.	.	H	α-helix	trans	-54.2	-46.1	176.5	-78.5	-177.5	-179.7	-172.8	0	112	L26 A27 R33 E66	L26-K29 HydrophobicContact CD2-CD 4.29Å; A27-K29 PolarHBondContact O-N 3Å; K29-R33 PolarHBondContact O-N 3.41Å; K29-E66 WeakPolarHBondContact CE-OE1 3.39Å; K29-E66 WeakPolarHBondContact CE-OE2 3.15Å; K29-E66 VanDerWaalsContact CG-CD 3.41Å; K29-E66 HydrophobicContact CG-CG 4.16Å; K29-E66 WeakPolarHBondContact CG-OE2 3.39Å; K29-E66 IonicContact NZ-OE1 3Å
30	R	91.9	Very high	85.1	Confident	77 Å²	77	79.5 Å²	79.5	29%	0.291	38%	0.38	S	S	.	.	H	α-helix	trans	-67.6	-50.1	178.7	180	177.1	173.1	-165.9	-11	111.1	T20 L26 A27 I28 N32 R33 E34	T20-R30 VanDerWaalsContact O-CZ 3.27Å; T20-R30 PolarHBondContact O-NH1 3.3Å; T20-R30 PolarHBondContact OG1-NH1 3.34Å; T20-R30 PolarHBondContact OG1-NH2 3.48Å; L26-R30 WeakPolarHBondContact O-CB 3.33Å; L26-R30 PolarHBondContact O-N 3.34Å; L26-R30 VanDerWaalsContact O-N 3.13Å; A27-R30 PolarHBondContact O-N 3.21Å; I28-R30 VanDerWaalsContact C-N 3.26Å; I28-R30 PolarHBondContact O-N 3.05Å; R30-N32 VanDerWaalsContact C-N 3.29Å; R30-N32 PolarHBondContact O-N 3.44Å; R30-R33 WeakPolarHBondContact O-CB 3.37Å; R30-R33 PolarHBondContact O-N 2.72Å; R30-R33 VanDerWaalsContact O-N 3.16Å; R30-E34 HydrophobicContact CG-CG 4.5Å; R30-E34 WeakPolarHBondContact CG-OE1 3.4Å; R30-E34 IonicContact CZ-OE1 3.36Å; R30-E34 IonicContact NE-OE1 2.74Å; R30-E34 PolarHBondContact NE-OE1 3.3Å; R30-E34 IonicContact NH2-OE1 3.1Å; R30-E34 PolarHBondContact NH2-OE1 2.85Å; R30-E34 VanDerWaalsContact NH2-OE1 3.1Å; R30-E34 WeakPolarHBondContact O-CG 3.47Å; R30-E34 PolarHBondContact O-N 3.43Å
31	I	93.6	Very high	86.5	Confident	4 Å²	4	79.4 Å²	79.4	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-54.9	-48.4	178.1	-68	168.3	0	0	0	109.9	L21 A27 I28 R33 E34 L35 A46 L50	L21-I31 HydrophobicContact CD2-CD1 3.54Å; L21-I31 HydrophobicContact CD2-CG1 4.28Å; A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.46Å; A27-I31 PolarHBondContact O-N 3.14Å; I28-I31 PolarHBondContact O-N 2.9Å; I31-R33 VanDerWaalsContact C-N 3.27Å; I31-R33 PolarHBondContact O-N 3.08Å; I31-E34 CarbonylContact O-C 3.51Å; I31-E34 WeakPolarHBondContact O-CA 3.39Å; I31-E34 PolarHBondContact O-N 3.33Å; I31-L35 HydrophobicContact CG2-CG 4.39Å; I31-L35 WeakPolarHBondContact O-CG 3.14Å; I31-L35 PolarHBondContact O-N 2.61Å; I31-A46 HydrophobicContact CG2-CB 4.49Å; I31-A46 WeakPolarHBondContact CG2-O 3.37Å; I31-L50 HydrophobicContact CG2-CB 3.76Å; I31-L50 HydrophobicContact CG2-CD1 4.23Å; I31-L50 HydrophobicContact CG2-CD2 4.49Å; I31-L50 HydrophobicContact CG2-CG 4.37Å
32	N	95.2	Very high	88	Confident	16 Å²	16	76.7 Å²	76.7	9%	0.086	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-32	-177.8	-167.2	32	0	0	0	113.4	I28 R30 E66 T68 S71	I28-N32 VanDerWaalsContact O-CB 3.22Å; I28-N32 WeakPolarHBondContact O-CB 3.39Å; I28-N32 PolarHBondContact O-N 3.33Å; R30-N32 VanDerWaalsContact C-N 3.29Å; R30-N32 PolarHBondContact O-N 3.44Å; N32-E66 PolarHBondContact ND2-O 3.02Å; N32-T68 HydrophobicContact CB-CG2 4.04Å; N32-S71 VanDerWaalsContact OD1-CB 3.27Å; N32-S71 WeakPolarHBondContact OD1-CB 3.41Å; N32-S71 PolarHBondContact OD1-OG 3.4Å
33	R	94.7	Very high	89.5	Confident	173 Å²	173	77.1 Å²	77.1	65%	0.653	36%	0.357	S	S	*	.	H	α-helix	trans	-69	-45.4	170.6	-175.8	-176.2	66.4	-169.6	0.1	111	K29 R30 I31 L35 K36	K29-R33 PolarHBondContact O-N 3.41Å; R30-R33 WeakPolarHBondContact O-CB 3.37Å; R30-R33 PolarHBondContact O-N 2.72Å; R30-R33 VanDerWaalsContact O-N 3.16Å; I31-R33 VanDerWaalsContact C-N 3.27Å; I31-R33 PolarHBondContact O-N 3.08Å; R33-L35 VanDerWaalsContact C-N 3.29Å; R33-L35 PolarHBondContact O-N 3.27Å; R33-K36 PolarHBondContact O-N 2.69Å; R33-K36 VanDerWaalsContact O-N 3.11Å
34	E	95.6	Very high	91.2	Very high	22 Å²	22	68.5 Å²	68.5	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-25.8	-179.3	-68.7	177.8	-176.8	0	0	112.8	R30 I31 K36 D37 I42 A46	R30-E34 HydrophobicContact CG-CG 4.5Å; R30-E34 WeakPolarHBondContact CG-OE1 3.4Å; R30-E34 IonicContact CZ-OE1 3.36Å; R30-E34 IonicContact NE-OE1 2.74Å; R30-E34 PolarHBondContact NE-OE1 3.3Å; R30-E34 IonicContact NH2-OE1 3.1Å; R30-E34 PolarHBondContact NH2-OE1 2.85Å; R30-E34 VanDerWaalsContact NH2-OE1 3.1Å; R30-E34 WeakPolarHBondContact O-CG 3.47Å; R30-E34 PolarHBondContact O-N 3.43Å; I31-E34 CarbonylContact O-C 3.51Å; I31-E34 WeakPolarHBondContact O-CA 3.39Å; I31-E34 PolarHBondContact O-N 3.33Å; E34-K36 PolarHBondContact O-N 2.77Å; E34-D37 VanDerWaalsContact O-CB 3.28Å; E34-D37 WeakPolarHBondContact O-CB 3.38Å; E34-D37 PolarHBondContact O-N 3.39Å; E34-D37 VanDerWaalsContact O-N 3.15Å; E34-I42 HydrophobicContact CB-CG2 3.72Å; E34-I42 HydrophobicContact CG-CG2 3.88Å; E34-A46 HydrophobicContact CB-CB 3.55Å
35	L	96.4	Very high	92.3	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.005	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-25.7	170.2	-67.3	-179.6	0	0	0	112.9	I31 R33 R43 A46 V47 L50 L75	I31-L35 HydrophobicContact CG2-CG 4.39Å; I31-L35 WeakPolarHBondContact O-CG 3.14Å; I31-L35 PolarHBondContact O-N 2.61Å; R33-L35 VanDerWaalsContact C-N 3.29Å; R33-L35 PolarHBondContact O-N 3.27Å; L35-R43 WeakPolarHBondContact O-CD 3.44Å; L35-A46 HydrophobicContact CD2-CB 3.88Å; L35-A46 HydrophobicContact CG-CB 4.41Å; L35-V47 HydrophobicContact CD2-CB 3.78Å; L35-V47 HydrophobicContact CD2-CG2 4.28Å; L35-L50 HydrophobicContact CD1-CD2 3.79Å; L35-L75 HydrophobicContact CB-CD1 4.04Å; L35-L75 HydrophobicContact CD2-CD1 3.71Å; L35-L75 HydrophobicContact CG-CD1 4.3Å
36	K	95.7	Very high	93.6	Very high	130 Å²	130	61 Å²	61	57%	0.565	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	8.8	-177.9	-56.6	176.1	-169.7	175	0	112.5	R33 E34 S71	R33-K36 PolarHBondContact O-N 2.69Å; R33-K36 VanDerWaalsContact O-N 3.11Å; E34-K36 PolarHBondContact O-N 2.77Å; K36-S71 WeakPolarHBondContact CE-OG 3.19Å; K36-S71 PolarHBondContact NZ-OG 3.21Å
37	D	96.3	Very high	94.3	Very high	48 Å²	48	55.8 Å²	55.8	26%	0.257	26%	0.258	S	S	.	.			trans	-68.6	147.4	-174.9	-157.8	-71	0	0	0	111.9	E34 E39 I42 R43	E34-D37 VanDerWaalsContact O-CB 3.28Å; E34-D37 WeakPolarHBondContact O-CB 3.38Å; E34-D37 PolarHBondContact O-N 3.39Å; E34-D37 VanDerWaalsContact O-N 3.15Å; D37-E39 VanDerWaalsContact C-N 3.29Å; D37-E39 PolarHBondContact O-N 3.04Å; D37-E39 PolarHBondContact OD1-N 3.06Å; D37-I42 HydrophobicContact CB-CB 3.91Å; D37-I42 HydrophobicContact CB-CG2 3.55Å; D37-R43 HydrophobicContact CB-CG 4.22Å; D37-R43 WeakPolarHBondContact O-CD 3.49Å; D37-R43 WeakPolarHBondContact O-CG 3.2Å; D37-R43 PolarHBondContact O-NH1 2.95Å
38	T	95.3	Very high	94.7	Very high	133 Å²	133	60.2 Å²	60.2	82%	0.816	28%	0.276	S	S	*	.	S	Bend	trans	-68.6	-30.5	176.1	48.9	0	0	0	0	112.2	L40 R43	T38-L40 PolarHBondContact O-N 3.32Å; T38-R43 PolarHBondContact O-NH1 3.45Å
39	E	95.7	Very high	94.9	Very high	110 Å²	110	60.8 Å²	60.8	51%	0.514	28%	0.281	S	S	.	.	S	Bend	trans	-79	122.1	179.6	-64.2	-168.9	179.2	0	0	111.5	D37 I41 I42 R43	D37-E39 VanDerWaalsContact C-N 3.29Å; D37-E39 PolarHBondContact O-N 3.04Å; D37-E39 PolarHBondContact OD1-N 3.06Å; E39-I41 VanDerWaalsContact C-N 3.28Å; E39-I41 HydrophobicContact CB-CG2 4.49Å; E39-I41 PolarHBondContact O-N 3.22Å; E39-I42 HydrophobicContact CB-CB 4.24Å; E39-I42 HydrophobicContact CB-CD1 3.92Å; E39-I42 HydrophobicContact CB-CG1 3.93Å; E39-I42 HydrophobicContact CG-CD1 4.28Å; E39-I42 PolarHBondContact O-N 2.9Å; E39-I42 VanDerWaalsContact O-N 3.11Å; E39-I42 WeakPolarHBondContact OE2-CD1 3.39Å; E39-R43 PolarHBondContact O-N 3.4Å; E39-R43 VanDerWaalsContact O-N 3.14Å
40	L	95.2	Very high	95.1	Very high	69 Å²	69	55.6 Å²	55.6	36%	0.361	26%	0.258	S	S	.	.	H	α-helix	trans	-55	-43.9	-179.1	173.9	59.1	0	0	0	112.5	T38 I42 R43 Q44 D80	T38-L40 PolarHBondContact O-N 3.32Å; L40-I42 VanDerWaalsContact C-N 3.25Å; L40-I42 PolarHBondContact O-N 3.34Å; L40-R43 PolarHBondContact O-N 3.49Å; L40-Q44 HydrophobicContact CD1-CG 3.87Å; L40-Q44 HydrophobicContact CG-CG 4.22Å; L40-Q44 WeakPolarHBondContact O-CB 3.49Å; L40-Q44 WeakPolarHBondContact O-CG 3.4Å; L40-Q44 PolarHBondContact O-N 3.42Å; L40-D80 HydrophobicContact CD1-CB 3.43Å; L40-D80 VanDerWaalsContact CD1-CB 3.43Å; L40-D80 VanDerWaalsContact CD1-CG 3.49Å; L40-D80 HydrophobicContact CD2-CB 4.4Å
41	I	94.8	Very high	95.2	Very high	71 Å²	71	52 Å²	52	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-33.2	-177.4	-169.1	59.5	0	0	0	112.1	E39 R45	E39-I41 VanDerWaalsContact C-N 3.28Å; E39-I41 HydrophobicContact CB-CG2 4.49Å; E39-I41 PolarHBondContact O-N 3.22Å; I41-R45 WeakPolarHBondContact O-CB 3.43Å; I41-R45 VanDerWaalsContact O-CG 3.23Å; I41-R45 WeakPolarHBondContact O-CG 3.29Å; I41-R45 PolarHBondContact O-N 3.23Å; I41-R45 VanDerWaalsContact O-N 3.1Å
42	I	94.6	Very high	95.1	Very high	42 Å²	42	56.9 Å²	56.9	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-69.3	-47.4	176.1	-62.9	-178.1	0	0	0	109.1	E34 D37 E39 L40 Q44 R45 A46	E34-I42 HydrophobicContact CB-CG2 3.72Å; E34-I42 HydrophobicContact CG-CG2 3.88Å; D37-I42 HydrophobicContact CB-CB 3.91Å; D37-I42 HydrophobicContact CB-CG2 3.55Å; E39-I42 HydrophobicContact CB-CB 4.24Å; E39-I42 HydrophobicContact CB-CD1 3.92Å; E39-I42 HydrophobicContact CB-CG1 3.93Å; E39-I42 HydrophobicContact CG-CD1 4.28Å; E39-I42 PolarHBondContact O-N 2.9Å; E39-I42 VanDerWaalsContact O-N 3.11Å; E39-I42 WeakPolarHBondContact OE2-CD1 3.39Å; L40-I42 VanDerWaalsContact C-N 3.25Å; L40-I42 PolarHBondContact O-N 3.34Å; I42-Q44 PolarHBondContact O-N 3.21Å; I42-R45 PolarHBondContact O-N 2.93Å; I42-A46 VanDerWaalsContact O-CB 3.28Å; I42-A46 WeakPolarHBondContact O-CB 3.31Å; I42-A46 PolarHBondContact O-N 3.19Å
43	R	95.9	Very high	94.9	Very high	36 Å²	36	57.7 Å²	57.7	14%	0.136	27%	0.273	C	S	.	.	H	α-helix	trans	-59.1	-45.8	176.4	-63	-157.6	-58	-73.7	1.5	112.6	L35 D37 T38 E39 L40 R45 A46 V47 D78	L35-R43 WeakPolarHBondContact O-CD 3.44Å; D37-R43 HydrophobicContact CB-CG 4.22Å; D37-R43 WeakPolarHBondContact O-CD 3.49Å; D37-R43 WeakPolarHBondContact O-CG 3.2Å; D37-R43 PolarHBondContact O-NH1 2.95Å; T38-R43 PolarHBondContact O-NH1 3.45Å; E39-R43 PolarHBondContact O-N 3.4Å; E39-R43 VanDerWaalsContact O-N 3.14Å; L40-R43 PolarHBondContact O-N 3.49Å; R43-R45 PolarHBondContact O-N 3.22Å; R43-A46 PolarHBondContact O-N 2.94Å; R43-V47 WeakPolarHBondContact O-CG1 3.5Å; R43-V47 PolarHBondContact O-N 3.46Å; R43-D78 IonicContact CZ-OD2 3.48Å; R43-D78 VanDerWaalsContact CZ-OD2 3.3Å; R43-D78 IonicContact NE-OD2 3.65Å; R43-D78 PolarHBondContact NE-OD2 3.29Å; R43-D78 IonicContact NH2-OD1 2.78Å; R43-D78 PolarHBondContact NH2-OD1 3.34Å; R43-D78 IonicContact NH2-OD2 3.44Å; R43-D78 PolarHBondContact NH2-OD2 3.34Å
44	Q	95.3	Very high	94.9	Very high	46 Å²	46	49.5 Å²	49.5	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-46.2	178.4	-76.2	178.8	-21.5	0	0	112.1	L40 I42 V47 K48 D80	L40-Q44 HydrophobicContact CD1-CG 3.87Å; L40-Q44 HydrophobicContact CG-CG 4.22Å; L40-Q44 WeakPolarHBondContact O-CB 3.49Å; L40-Q44 WeakPolarHBondContact O-CG 3.4Å; L40-Q44 PolarHBondContact O-N 3.42Å; I42-Q44 PolarHBondContact O-N 3.21Å; Q44-V47 WeakPolarHBondContact O-CG1 3.45Å; Q44-K48 VanDerWaalsContact O-CB 3.31Å; Q44-K48 WeakPolarHBondContact O-CB 3.39Å; Q44-K48 PolarHBondContact O-N 2.99Å; Q44-K48 VanDerWaalsContact O-N 3.1Å; Q44-D80 VanDerWaalsContact NE2-CG 3.34Å; Q44-D80 PolarHBondContact NE2-OD1 2.72Å; Q44-D80 PolarHBondContact NE2-OD2 3.06Å
45	R	94	Very high	94.6	Very high	81 Å²	81	54.1 Å²	54.1	31%	0.306	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-40.6	177.1	-72	174.6	-172.9	165.9	4.5	111.7	P16 A19 I41 I42 R43 A49	P16-R45 PolarHBondContact O-NE 2.65Å; P16-R45 VanDerWaalsContact O-NE 3.15Å; P16-R45 PolarHBondContact O-NH1 3.45Å; P16-R45 PolarHBondContact O-NH2 3.19Å; A19-R45 HydrophobicContact CB-CB 4.22Å; I41-R45 WeakPolarHBondContact O-CB 3.43Å; I41-R45 VanDerWaalsContact O-CG 3.23Å; I41-R45 WeakPolarHBondContact O-CG 3.29Å; I41-R45 PolarHBondContact O-N 3.23Å; I41-R45 VanDerWaalsContact O-N 3.1Å; I42-R45 PolarHBondContact O-N 2.93Å; R43-R45 PolarHBondContact O-N 3.22Å; R45-A49 WeakPolarHBondContact O-CB 3.37Å; R45-A49 PolarHBondContact O-N 3.08Å
46	A	95.9	Very high	94.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-47.5	179.8	0	0	0	0	0	112.1	I31 E34 L35 I42 R43 A49 L50	I31-A46 HydrophobicContact CG2-CB 4.49Å; I31-A46 WeakPolarHBondContact CG2-O 3.37Å; E34-A46 HydrophobicContact CB-CB 3.55Å; L35-A46 HydrophobicContact CD2-CB 3.88Å; L35-A46 HydrophobicContact CG-CB 4.41Å; I42-A46 VanDerWaalsContact O-CB 3.28Å; I42-A46 WeakPolarHBondContact O-CB 3.31Å; I42-A46 PolarHBondContact O-N 3.19Å; R43-A46 PolarHBondContact O-N 2.94Å; A46-A49 PolarHBondContact O-N 2.78Å; A46-L50 WeakPolarHBondContact O-CB 3.34Å; A46-L50 PolarHBondContact O-N 2.86Å
47	V	96.2	Very high	93.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.3	-37.5	-179.4	71.6	0	0	0	0	111.8	L35 R43 Q44 L50 C51 L72 L75 Y86	L35-V47 HydrophobicContact CD2-CB 3.78Å; L35-V47 HydrophobicContact CD2-CG2 4.28Å; R43-V47 WeakPolarHBondContact O-CG1 3.5Å; R43-V47 PolarHBondContact O-N 3.46Å; Q44-V47 WeakPolarHBondContact O-CG1 3.45Å; V47-L50 PolarHBondContact O-N 3.28Å; V47-C51 WeakPolarHBondContact O-CB 3.49Å; V47-C51 PolarHBondContact O-N 3.27Å; V47-L72 HydrophobicContact CG2-CD2 4.1Å; V47-L75 HydrophobicContact CB-CD1 4.2Å; V47-L75 HydrophobicContact CG2-CD1 4.12Å; V47-Y86 HydrophobicContact CG1-CD2 4.06Å; V47-Y86 HydrophobicContact CG1-CG 4.2Å
48	K	94.9	Very high	93.5	Very high	96 Å²	96	59.1 Å²	59.1	42%	0.417	30%	0.296	S	S	.	.	H	α-helix	trans	-64.5	-46.7	173.6	-177.1	179.2	177.2	-175.9	0	111.5	Q44 L50 C51 D52 Y86	Q44-K48 VanDerWaalsContact O-CB 3.31Å; Q44-K48 WeakPolarHBondContact O-CB 3.39Å; Q44-K48 PolarHBondContact O-N 2.99Å; Q44-K48 VanDerWaalsContact O-N 3.1Å; K48-L50 VanDerWaalsContact C-N 3.28Å; K48-L50 PolarHBondContact O-N 2.99Å; K48-C51 WeakPolarHBondContact O-CB 3.3Å; K48-C51 PolarHBondContact O-N 3.23Å; K48-D52 PolarHBondContact O-N 3.44Å; K48-Y86 HydrophobicContact CB-CD2 4.38Å; K48-Y86 HydrophobicContact CB-CE1 4.49Å; K48-Y86 HydrophobicContact CB-CE2 4.26Å; K48-Y86 HydrophobicContact CG-CE1 4.19Å
49	A	93.6	Very high	93.3	Very high	12 Å²	12	54.7 Å²	54.7	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-36.6	176.9	0	0	0	0	0	112	A19 R45 A46 Y53	A19-A49 HydrophobicContact CB-CB 3.87Å; R45-A49 WeakPolarHBondContact O-CB 3.37Å; R45-A49 PolarHBondContact O-N 3.08Å; A46-A49 PolarHBondContact O-N 2.78Å; A49-Y53 VanDerWaalsContact O-CB 3.23Å; A49-Y53 WeakPolarHBondContact O-CB 3.44Å; A49-Y53 PolarHBondContact O-N 3.45Å
50	L	95.2	Very high	93.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-45.9	173.3	-173.7	55.6	0	0	0	111.1	I31 L35 A46 V47 K48 D52 Y53 L54 T68 L72	I31-L50 HydrophobicContact CG2-CB 3.76Å; I31-L50 HydrophobicContact CG2-CD1 4.23Å; I31-L50 HydrophobicContact CG2-CD2 4.49Å; I31-L50 HydrophobicContact CG2-CG 4.37Å; L35-L50 HydrophobicContact CD1-CD2 3.79Å; A46-L50 WeakPolarHBondContact O-CB 3.34Å; A46-L50 PolarHBondContact O-N 2.86Å; V47-L50 PolarHBondContact O-N 3.28Å; K48-L50 VanDerWaalsContact C-N 3.28Å; K48-L50 PolarHBondContact O-N 2.99Å; L50-D52 PolarHBondContact O-N 3.03Å; L50-Y53 WeakPolarHBondContact O-CB 3.31Å; L50-Y53 PolarHBondContact O-N 3.23Å; L50-Y53 VanDerWaalsContact O-N 3.09Å; L50-L54 HydrophobicContact CD1-CD1 4.08Å; L50-L54 HydrophobicContact CD1-CD2 4.16Å; L50-L54 HydrophobicContact CD1-CG 3.86Å; L50-L54 HydrophobicContact CD2-CD1 4.37Å; L50-L54 HydrophobicContact CG-CD1 3.73Å; L50-L54 HydrophobicContact CG-CG 4.03Å; L50-L54 WeakPolarHBondContact O-CB 3.44Å; L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.32Å; L50-T68 HydrophobicContact CD2-CG2 4.28Å; L50-L72 HydrophobicContact CD2-CD1 4.07Å; L50-L72 HydrophobicContact CD2-CD2 4Å; L50-L72 HydrophobicContact CD2-CG 4.14Å
51	C	94.2	Very high	93	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-56	-49.2	178.2	-164.1	0	0	0	0	111.5	V47 K48 Y53 L54 H55 E89 I93	V47-C51 WeakPolarHBondContact O-CB 3.49Å; V47-C51 PolarHBondContact O-N 3.27Å; K48-C51 WeakPolarHBondContact O-CB 3.3Å; K48-C51 PolarHBondContact O-N 3.23Å; C51-Y53 VanDerWaalsContact C-N 3.27Å; C51-Y53 PolarHBondContact O-N 3.47Å; C51-L54 PolarHBondContact O-N 2.98Å; C51-H55 PolarHBondContact O-CD2 3Å; C51-E89 VanDerWaalsContact SG-CD 3.56Å; C51-E89 VanDerWaalsContact SG-CG 3.6Å; C51-I93 VanDerWaalsContact SG-CD1 3.54Å
52	D	92	Very high	92.9	Very high	106 Å²	106	50.6 Å²	50.6	57%	0.567	24%	0.243	S	C	*	.	H	α-helix	trans	-60.8	-37.2	176.4	-67.4	-23.6	0	0	0	111.9	K48 L50	K48-D52 PolarHBondContact O-N 3.44Å; L50-D52 PolarHBondContact O-N 3.03Å
53	Y	91.5	Very high	92.9	Very high	34 Å²	34	48.6 Å²	48.6	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-74.5	-34.3	-176.7	-164.9	-99	0	0	0	113.2	L21 A27 I28 A49 L50 C51 H55 D56 H59	L21-Y53 HydrophobicContact CD2-CD2 4.38Å; A27-Y53 HydrophobicContact CB-CE2 4.16Å; I28-Y53 HydrophobicContact CD1-CD1 4.21Å; I28-Y53 HydrophobicContact CD1-CE1 3.56Å; I28-Y53 HydrophobicContact CG1-CD1 3.98Å; I28-Y53 HydrophobicContact CG1-CE1 3.4Å; A49-Y53 VanDerWaalsContact O-CB 3.23Å; A49-Y53 WeakPolarHBondContact O-CB 3.44Å; A49-Y53 PolarHBondContact O-N 3.45Å; L50-Y53 WeakPolarHBondContact O-CB 3.31Å; L50-Y53 PolarHBondContact O-N 3.23Å; L50-Y53 VanDerWaalsContact O-N 3.09Å; C51-Y53 VanDerWaalsContact C-N 3.27Å; C51-Y53 PolarHBondContact O-N 3.47Å; Y53-H55 PolarHBondContact O-N 3.42Å; Y53-D56 PolarHBondContact O-N 3.36Å; Y53-H59 HydrophobicContact CD1-CB 3.52Å; Y53-H59 AromaticContact CD1-CG 3.52Å; Y53-H59 AromaticContact CD1-ND1 3.48Å; Y53-H59 WeakPolarHBondContact CD1-ND1 3.45Å; Y53-H59 AromaticContact CD2-CE1 3.98Å; Y53-H59 AromaticContact CD2-ND1 3.79Å; Y53-H59 HydrophobicContact CE1-CB 3.36Å; Y53-H59 AromaticContact CE1-CD2 3.45Å; Y53-H59 VanDerWaalsContact CE1-CD2 3.45Å; Y53-H59 WeakPolarHBondContact CE1-CD2 3.46Å; Y53-H59 AromaticContact CE1-CE1 3.83Å; Y53-H59 AromaticContact CE1-CG 3.06Å; Y53-H59 AromaticContact CE1-ND1 3.31Å; Y53-H59 VanDerWaalsContact CE1-ND1 3.31Å; Y53-H59 WeakPolarHBondContact CE1-ND1 2.94Å; Y53-H59 AromaticContact CE1-NE2 3.89Å; Y53-H59 AromaticContact CE2-CE1 3.52Å; Y53-H59 AromaticContact CE2-ND1 3.67Å; Y53-H59 AromaticContact CE2-NE2 3.88Å; Y53-H59 HydrophobicContact CG-CB 4.49Å; Y53-H59 AromaticContact CG-ND1 3.7Å; Y53-H59 AromaticContact CZ-CD2 3.44Å; Y53-H59 VanDerWaalsContact CZ-CD2 3.44Å; Y53-H59 AromaticContact CZ-CE1 3.43Å; Y53-H59 VanDerWaalsContact CZ-CE1 3.43Å; Y53-H59 AromaticContact CZ-CG 3.46Å; Y53-H59 VanDerWaalsContact CZ-CG 3.46Å; Y53-H59 AromaticContact CZ-ND1 3.42Å; Y53-H59 AromaticContact CZ-NE2 3.4Å; Y53-H59 WeakPolarHBondContact O-CB 3.44Å; Y53-H59 PolarHBondContact O-ND1 3.31Å; Y53-H59 PolarHBondContact OH-CD2 3.13Å; Y53-H59 PolarHBondContact OH-NE2 3.25Å
54	L	94	Very high	92.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10	-176.3	-73.7	171.1	0	0	0	114.3	L50 C51 D56 I60 A63 C90 I93 I94	L50-L54 HydrophobicContact CD1-CD1 4.08Å; L50-L54 HydrophobicContact CD1-CD2 4.16Å; L50-L54 HydrophobicContact CD1-CG 3.86Å; L50-L54 HydrophobicContact CD2-CD1 4.37Å; L50-L54 HydrophobicContact CG-CD1 3.73Å; L50-L54 HydrophobicContact CG-CG 4.03Å; L50-L54 WeakPolarHBondContact O-CB 3.44Å; L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.32Å; C51-L54 PolarHBondContact O-N 2.98Å; L54-D56 PolarHBondContact O-N 3.02Å; L54-I60 HydrophobicContact CD2-CG1 4.14Å; L54-I60 WeakPolarHBondContact O-CG1 3.47Å; L54-A63 HydrophobicContact CD2-CB 3.62Å; L54-C90 HydrophobicContact CD1-CB 3.85Å; L54-I93 HydrophobicContact CB-CG2 3.83Å; L54-I93 VanDerWaalsContact O-CG2 3.27Å; L54-I93 WeakPolarHBondContact O-CG2 3.27Å; L54-I94 HydrophobicContact CD1-CD1 3.84Å; L54-I94 HydrophobicContact CD1-CG1 3.91Å; L54-I94 HydrophobicContact CD2-CD1 4.49Å; L54-I94 HydrophobicContact CD2-CG1 4.22Å
55	H	90.2	Very high	92.8	Very high	119 Å²	119	51.5 Å²	51.5	55%	0.551	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.9	175.3	-76.7	-69.4	0	0	0	113.5	C51 Y53	C51-H55 PolarHBondContact O-CD2 3Å; Y53-H55 PolarHBondContact O-N 3.42Å
56	D	88.7	Confident	92.8	Very high	67 Å²	67	51 Å²	51	36%	0.358	25%	0.253	S	S	.	.	S	Bend	trans	-87.1	121.7	168.8	-166.9	-39.3	0	0	0	110.1	Y53 L54 E58 H59	Y53-D56 PolarHBondContact O-N 3.36Å; L54-D56 PolarHBondContact O-N 3.02Å; D56-E58 PolarHBondContact O-N 2.8Å; D56-E58 PolarHBondContact OD1-N 2.91Å; D56-H59 HydrophobicContact CB-CB 4.32Å; D56-H59 WeakPolarHBondContact CB-ND1 3.23Å; D56-H59 WeakPolarHBondContact O-CB 3.34Å; D56-H59 PolarHBondContact O-N 3.13Å; D56-H59 VanDerWaalsContact O-N 3.08Å
57	P	87.8	Confident	92.8	Very high	71 Å²	71	52.1 Å²	52.1	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-57.1	-31.5	179.7	-25.6	35.3	0	0	0	114.8	H59 I60	P57-H59 VanDerWaalsContact C-N 3.27Å; P57-H59 PolarHBondContact O-N 3.4Å; P57-I60 PolarHBondContact O-N 3.41Å
58	E	87.7	Confident	92.8	Very high	147 Å²	147	52.1 Å²	52.1	69%	0.687	27%	0.265	S	S	*	.	H	α-helix	trans	-65.1	-35.3	178.5	-66.1	-172.5	178.2	0	0	111.1	D56 I60 E62	D56-E58 PolarHBondContact O-N 2.8Å; D56-E58 PolarHBondContact OD1-N 2.91Å; E58-I60 VanDerWaalsContact C-N 3.3Å; E58-I60 PolarHBondContact O-N 3.44Å; E58-E62 PolarHBondContact O-N 2.73Å
59	H	91.7	Very high	92.9	Very high	40 Å²	40	47.5 Å²	47.5	19%	0.185	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-22.9	179.3	-63.8	162.1	0	0	0	113.5	Y53 D56 P57 E62 A63	Y53-H59 HydrophobicContact CD1-CB 3.52Å; Y53-H59 AromaticContact CD1-CG 3.52Å; Y53-H59 AromaticContact CD1-ND1 3.48Å; Y53-H59 WeakPolarHBondContact CD1-ND1 3.45Å; Y53-H59 AromaticContact CD2-CE1 3.98Å; Y53-H59 AromaticContact CD2-ND1 3.79Å; Y53-H59 HydrophobicContact CE1-CB 3.36Å; Y53-H59 AromaticContact CE1-CD2 3.45Å; Y53-H59 VanDerWaalsContact CE1-CD2 3.45Å; Y53-H59 WeakPolarHBondContact CE1-CD2 3.46Å; Y53-H59 AromaticContact CE1-CE1 3.83Å; Y53-H59 AromaticContact CE1-CG 3.06Å; Y53-H59 AromaticContact CE1-ND1 3.31Å; Y53-H59 VanDerWaalsContact CE1-ND1 3.31Å; Y53-H59 WeakPolarHBondContact CE1-ND1 2.94Å; Y53-H59 AromaticContact CE1-NE2 3.89Å; Y53-H59 AromaticContact CE2-CE1 3.52Å; Y53-H59 AromaticContact CE2-ND1 3.67Å; Y53-H59 AromaticContact CE2-NE2 3.88Å; Y53-H59 HydrophobicContact CG-CB 4.49Å; Y53-H59 AromaticContact CG-ND1 3.7Å; Y53-H59 AromaticContact CZ-CD2 3.44Å; Y53-H59 VanDerWaalsContact CZ-CD2 3.44Å; Y53-H59 AromaticContact CZ-CE1 3.43Å; Y53-H59 VanDerWaalsContact CZ-CE1 3.43Å; Y53-H59 AromaticContact CZ-CG 3.46Å; Y53-H59 VanDerWaalsContact CZ-CG 3.46Å; Y53-H59 AromaticContact CZ-ND1 3.42Å; Y53-H59 AromaticContact CZ-NE2 3.4Å; Y53-H59 WeakPolarHBondContact O-CB 3.44Å; Y53-H59 PolarHBondContact O-ND1 3.31Å; Y53-H59 PolarHBondContact OH-CD2 3.13Å; Y53-H59 PolarHBondContact OH-NE2 3.25Å; D56-H59 HydrophobicContact CB-CB 4.32Å; D56-H59 WeakPolarHBondContact CB-ND1 3.23Å; D56-H59 WeakPolarHBondContact O-CB 3.34Å; D56-H59 PolarHBondContact O-N 3.13Å; D56-H59 VanDerWaalsContact O-N 3.08Å; P57-H59 VanDerWaalsContact C-N 3.27Å; P57-H59 PolarHBondContact O-N 3.4Å; H59-E62 PolarHBondContact O-N 3.39Å; H59-A63 WeakPolarHBondContact O-CB 3.24Å; H59-A63 PolarHBondContact O-N 3.31Å
60	I	93	Very high	93	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-44.2	177.9	-62.9	175.6	0	0	0	110.1	L54 P57 E58 A63 I64 I94 H97 I99	L54-I60 HydrophobicContact CD2-CG1 4.14Å; L54-I60 WeakPolarHBondContact O-CG1 3.47Å; P57-I60 PolarHBondContact O-N 3.41Å; E58-I60 VanDerWaalsContact C-N 3.3Å; E58-I60 PolarHBondContact O-N 3.44Å; I60-A63 PolarHBondContact O-N 2.85Å; I60-I64 HydrophobicContact CG2-CD1 3.81Å; I60-I64 HydrophobicContact CG2-CG1 4.49Å; I60-I64 WeakPolarHBondContact O-CD1 3.47Å; I60-I64 VanDerWaalsContact O-CG1 3.23Å; I60-I64 WeakPolarHBondContact O-CG1 3.35Å; I60-I64 PolarHBondContact O-N 3.45Å; I60-I94 HydrophobicContact CG2-CG2 4.49Å; I60-H97 HydrophobicContact CD1-CB 4.35Å; I60-H97 WeakPolarHBondContact CD1-CD2 3.48Å; I60-H97 WeakPolarHBondContact CD1-NE2 3.43Å; I60-I99 HydrophobicContact CG2-CG2 4.35Å
61	E	92.4	Very high	93.1	Very high	106 Å²	106	50 Å²	50	50%	0.495	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-46.6	177.1	-178.6	175.3	-176.1	0	0	111.2	A63 I64 N65 I99	E61-A63 VanDerWaalsContact C-N 3.31Å; E61-A63 PolarHBondContact O-N 2.96Å; E61-I64 PolarHBondContact O-N 2.72Å; E61-N65 WeakPolarHBondContact O-CB 3.44Å; E61-N65 VanDerWaalsContact O-CG 3.31Å; E61-N65 PolarHBondContact O-N 3.49Å; E61-N65 PolarHBondContact O-ND2 3.27Å; E61-I99 HydrophobicContact CB-CD1 4.41Å; E61-I99 HydrophobicContact CG-CD1 4.1Å
62	E	93	Very high	93.3	Very high	57 Å²	57	50 Å²	50	27%	0.266	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-41.9	176	-64.5	-169.8	159.7	0	0	111.5	I28 E58 H59 N65 E66	I28-E62 HydrophobicContact CD1-CB 3.26Å; I28-E62 HydrophobicContact CD1-CG 4.46Å; E58-E62 PolarHBondContact O-N 2.73Å; H59-E62 PolarHBondContact O-N 3.39Å; E62-N65 PolarHBondContact O-N 3.16Å; E62-E66 WeakPolarHBondContact O-CG 3.47Å; E62-E66 PolarHBondContact O-N 3.48Å
63	A	94.6	Very high	93.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-45.4	177.8	0	0	0	0	0	112.2	I28 L54 H59 I60 E61 N65 E66 G67 T68	I28-A63 HydrophobicContact CD1-CB 4.13Å; I28-A63 HydrophobicContact CG2-CB 4.36Å; L54-A63 HydrophobicContact CD2-CB 3.62Å; H59-A63 WeakPolarHBondContact O-CB 3.24Å; H59-A63 PolarHBondContact O-N 3.31Å; I60-A63 PolarHBondContact O-N 2.85Å; E61-A63 VanDerWaalsContact C-N 3.31Å; E61-A63 PolarHBondContact O-N 2.96Å; A63-N65 VanDerWaalsContact C-N 3.34Å; A63-N65 PolarHBondContact O-N 2.96Å; A63-E66 PolarHBondContact O-N 3.17Å; A63-G67 PolarHBondContact O-N 3.44Å; A63-T68 VanDerWaalsContact C-OG1 3.26Å; A63-T68 HydrophobicContact CB-CG2 4.05Å; A63-T68 WeakPolarHBondContact CB-OG1 3.41Å; A63-T68 WeakPolarHBondContact O-CG2 3.44Å; A63-T68 PolarHBondContact O-N 2.86Å; A63-T68 VanDerWaalsContact O-N 3.09Å; A63-T68 PolarHBondContact O-OG1 3.16Å
64	I	95	Very high	93.8	Very high	27 Å²	27	51 Å²	51	14%	0.138	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-46.2	176.5	-68.9	164.1	0	0	0	110.3	I60 E61 E66 G67 I69 I99 A103	I60-I64 HydrophobicContact CG2-CD1 3.81Å; I60-I64 HydrophobicContact CG2-CG1 4.49Å; I60-I64 WeakPolarHBondContact O-CD1 3.47Å; I60-I64 VanDerWaalsContact O-CG1 3.23Å; I60-I64 WeakPolarHBondContact O-CG1 3.35Å; I60-I64 PolarHBondContact O-N 3.45Å; E61-I64 PolarHBondContact O-N 2.72Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 2.82Å; I64-G67 PolarHBondContact O-N 3.09Å; I64-I69 HydrophobicContact CG1-CD1 4.3Å; I64-I69 HydrophobicContact CG1-CG1 4.26Å; I64-I99 HydrophobicContact CD1-CG1 4.06Å; I64-I99 HydrophobicContact CD1-CG2 4.04Å; I64-A103 HydrophobicContact CD1-CB 3.92Å; I64-A103 HydrophobicContact CG1-CB 4.01Å; I64-A103 HydrophobicContact CG2-CB 3.76Å
65	N	93.5	Very high	93.9	Very high	116 Å²	116	51 Å²	51	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-64.7	-32.8	-179.5	-73.2	-29.4	0	0	0	113.1	E61 E62 A63 G67	E61-N65 WeakPolarHBondContact O-CB 3.44Å; E61-N65 VanDerWaalsContact O-CG 3.31Å; E61-N65 PolarHBondContact O-N 3.49Å; E61-N65 PolarHBondContact O-ND2 3.27Å; E62-N65 PolarHBondContact O-N 3.16Å; A63-N65 VanDerWaalsContact C-N 3.34Å; A63-N65 PolarHBondContact O-N 2.96Å; N65-G67 PolarHBondContact O-N 3.15Å
66	E	94.3	Very high	94.3	Very high	69 Å²	69	45.5 Å²	45.5	32%	0.322	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-2.3	173.4	-68.1	-59.5	153.8	0	0	113.2	I28 K29 N32 E62 A63 I64	I28-E66 HydrophobicContact CB-CG 4.26Å; I28-E66 HydrophobicContact CG2-CB 3.65Å; I28-E66 HydrophobicContact CG2-CG 3.7Å; K29-E66 WeakPolarHBondContact CE-OE1 3.39Å; K29-E66 WeakPolarHBondContact CE-OE2 3.15Å; K29-E66 VanDerWaalsContact CG-CD 3.41Å; K29-E66 HydrophobicContact CG-CG 4.16Å; K29-E66 WeakPolarHBondContact CG-OE2 3.39Å; K29-E66 IonicContact NZ-OE1 3Å; N32-E66 PolarHBondContact ND2-O 3.02Å; E62-E66 WeakPolarHBondContact O-CG 3.47Å; E62-E66 PolarHBondContact O-N 3.48Å; A63-E66 PolarHBondContact O-N 3.17Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 2.82Å
67	G	95.3	Very high	94.7	Very high	24 Å²	24	49.2 Å²	49.2	25%	0.247	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	29	176.9	0	0	0	0	0	113.9	A63 I64 N65 I69 C70	A63-G67 PolarHBondContact O-N 3.44Å; I64-G67 PolarHBondContact O-N 3.09Å; N65-G67 PolarHBondContact O-N 3.15Å; G67-I69 PolarHBondContact O-N 3.37Å; G67-C70 PolarHBondContact O-N 3.1Å
68	T	96.2	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-26.6	177	60.7	0	0	0	0	112.6	I28 N32 L50 A63 C70 S71 L72	I28-T68 HydrophobicContact CG2-CG2 3.89Å; N32-T68 HydrophobicContact CB-CG2 4.04Å; L50-T68 HydrophobicContact CD2-CG2 4.28Å; A63-T68 VanDerWaalsContact C-OG1 3.26Å; A63-T68 HydrophobicContact CB-CG2 4.05Å; A63-T68 WeakPolarHBondContact CB-OG1 3.41Å; A63-T68 WeakPolarHBondContact O-CG2 3.44Å; A63-T68 PolarHBondContact O-N 2.86Å; A63-T68 VanDerWaalsContact O-N 3.09Å; A63-T68 PolarHBondContact O-OG1 3.16Å; T68-C70 VanDerWaalsContact C-N 3.31Å; T68-C70 PolarHBondContact O-N 3.03Å; T68-S71 WeakPolarHBondContact O-CB 3.39Å; T68-S71 PolarHBondContact O-N 3.34Å; T68-S71 VanDerWaalsContact O-N 3.08Å; T68-L72 WeakPolarHBondContact O-CB 3.38Å; T68-L72 WeakPolarHBondContact O-CG 3.35Å; T68-L72 PolarHBondContact O-N 3.08Å
69	I	97.1	Very high	95.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-55.6	-45.2	177.2	-58.4	-62.1	0	0	0	111.4	I64 G67 S71 L72 S73 F91 I94 A103 H107	I64-I69 HydrophobicContact CG1-CD1 4.3Å; I64-I69 HydrophobicContact CG1-CG1 4.26Å; G67-I69 PolarHBondContact O-N 3.37Å; I69-S71 PolarHBondContact O-N 2.93Å; I69-L72 PolarHBondContact O-N 3.47Å; I69-S73 VanDerWaalsContact O-CB 3.29Å; I69-S73 WeakPolarHBondContact O-CB 3.28Å; I69-S73 PolarHBondContact O-N 3.18Å; I69-F91 HydrophobicContact CD1-CE1 4.28Å; I69-F91 HydrophobicContact CG2-CE1 4.21Å; I69-I94 HydrophobicContact CD1-CD1 3.87Å; I69-I94 HydrophobicContact CD1-CG2 4.05Å; I69-A103 HydrophobicContact CG1-CB 4.24Å; I69-H107 HydrophobicContact CG2-CB 3.67Å
70	C	96.4	Very high	95.7	Very high	62 Å²	62	43.7 Å²	43.7	42%	0.419	24%	0.237	S	C	.	.	H	α-helix	trans	-63.4	-42.4	176.8	-66.4	0	0	0	0	111.8	G67 T68 S73 F74 H107	G67-C70 PolarHBondContact O-N 3.1Å; T68-C70 VanDerWaalsContact C-N 3.31Å; T68-C70 PolarHBondContact O-N 3.03Å; C70-S73 PolarHBondContact O-N 2.87Å; C70-F74 PolarHBondContact O-N 3.14Å; C70-H107 PolarHBondContact SG-CE1 3.17Å; C70-H107 PolarHBondContact SG-ND1 3.18Å; C70-H107 VanDerWaalsContact SG-ND1 3.41Å
71	S	97.1	Very high	95.9	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-43.3	-179.8	-50.9	0	0	0	0	111.8	N32 K36 T68 I69 F74 L75	N32-S71 VanDerWaalsContact OD1-CB 3.27Å; N32-S71 WeakPolarHBondContact OD1-CB 3.41Å; N32-S71 PolarHBondContact OD1-OG 3.4Å; K36-S71 WeakPolarHBondContact CE-OG 3.19Å; K36-S71 PolarHBondContact NZ-OG 3.21Å; T68-S71 WeakPolarHBondContact O-CB 3.39Å; T68-S71 PolarHBondContact O-N 3.34Å; T68-S71 VanDerWaalsContact O-N 3.08Å; I69-S71 PolarHBondContact O-N 2.93Å; S71-F74 WeakPolarHBondContact O-CB 3.33Å; S71-F74 PolarHBondContact O-N 3.05Å; S71-L75 WeakPolarHBondContact O-CG 3.47Å; S71-L75 PolarHBondContact O-N 3.08Å
72	L	97.9	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-44.1	174.7	-72.6	171.5	0	0	0	111.1	V47 L50 T68 I69 F74 L75 L76 C90 F91 I94	V47-L72 HydrophobicContact CG2-CD2 4.1Å; L50-L72 HydrophobicContact CD2-CD1 4.07Å; L50-L72 HydrophobicContact CD2-CD2 4Å; L50-L72 HydrophobicContact CD2-CG 4.14Å; T68-L72 WeakPolarHBondContact O-CB 3.38Å; T68-L72 WeakPolarHBondContact O-CG 3.35Å; T68-L72 PolarHBondContact O-N 3.08Å; I69-L72 PolarHBondContact O-N 3.47Å; L72-F74 VanDerWaalsContact C-N 3.26Å; L72-F74 PolarHBondContact O-N 3.3Å; L72-L75 PolarHBondContact O-N 2.9Å; L72-L75 VanDerWaalsContact O-N 3.08Å; L72-L76 WeakPolarHBondContact O-CG 3.27Å; L72-L76 PolarHBondContact O-N 3.29Å; L72-C90 HydrophobicContact CD1-CB 3.73Å; L72-C90 HydrophobicContact CD2-CB 3.81Å; L72-C90 HydrophobicContact CG-CB 4.43Å; L72-F91 HydrophobicContact CB-CD2 4.45Å; L72-F91 HydrophobicContact CB-CE2 3.56Å; L72-F91 HydrophobicContact CB-CZ 3.66Å; L72-I94 HydrophobicContact CD1-CD1 3.72Å
73	S	97.3	Very high	96.3	Very high	21 Å²	21	42 Å²	42	15%	0.147	24%	0.235	C	C	.	.	H	α-helix	trans	-58.7	-37.6	175.4	166.8	0	0	0	0	112.1	I69 C70 L76 S112	I69-S73 VanDerWaalsContact O-CB 3.29Å; I69-S73 WeakPolarHBondContact O-CB 3.28Å; I69-S73 PolarHBondContact O-N 3.18Å; C70-S73 PolarHBondContact O-N 2.87Å; S73-L76 WeakPolarHBondContact O-CB 3.44Å; S73-L76 PolarHBondContact O-N 2.99Å; S73-S112 PolarHBondContact OG-OG 3.21Å
74	F	96.4	Very high	96.4	Very high	142 Å²	142	43.2 Å²	43.2	62%	0.623	24%	0.24	S	C	*	.	H	α-helix	trans	-66.2	-43.8	172.9	-174.4	-95.1	0	0	0	112	C70 S71 L72 L76 K77	C70-F74 PolarHBondContact O-N 3.14Å; S71-F74 WeakPolarHBondContact O-CB 3.33Å; S71-F74 PolarHBondContact O-N 3.05Å; L72-F74 VanDerWaalsContact C-N 3.26Å; L72-F74 PolarHBondContact O-N 3.3Å; F74-L76 PolarHBondContact O-N 3.29Å; F74-K77 PolarHBondContact O-N 2.85Å
75	L	97.5	Very high	96.6	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-22.2	178.4	-74.1	174.4	0	0	0	114	L35 V47 S71 L72 K77 D78 C83 S87	L35-L75 HydrophobicContact CB-CD1 4.04Å; L35-L75 HydrophobicContact CD2-CD1 3.71Å; L35-L75 HydrophobicContact CG-CD1 4.3Å; V47-L75 HydrophobicContact CB-CD1 4.2Å; V47-L75 HydrophobicContact CG2-CD1 4.12Å; S71-L75 WeakPolarHBondContact O-CG 3.47Å; S71-L75 PolarHBondContact O-N 3.08Å; L72-L75 PolarHBondContact O-N 2.9Å; L72-L75 VanDerWaalsContact O-N 3.08Å; L75-K77 PolarHBondContact O-N 2.89Å; L75-K77 VanDerWaalsContact O-N 3.13Å; L75-D78 HydrophobicContact CD2-CB 4.33Å; L75-D78 VanDerWaalsContact O-CB 3.23Å; L75-D78 WeakPolarHBondContact O-CB 3.42Å; L75-D78 PolarHBondContact O-N 3.04Å; L75-C83 HydrophobicContact CD2-CB 4.43Å; L75-S87 WeakPolarHBondContact CB-OG 3.42Å
76	L	97.9	Very high	96.8	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.1	169.8	-66.4	178.8	0	0	0	112.5	L72 S73 F74 R84 T88 F91 I109 F113 L116	L72-L76 WeakPolarHBondContact O-CG 3.27Å; L72-L76 PolarHBondContact O-N 3.29Å; S73-L76 WeakPolarHBondContact O-CB 3.44Å; S73-L76 PolarHBondContact O-N 2.99Å; F74-L76 PolarHBondContact O-N 3.29Å; L76-R84 WeakPolarHBondContact O-CD 3.35Å; L76-T88 HydrophobicContact CD2-CG2 3.58Å; L76-F91 HydrophobicContact CD1-CD2 4.05Å; L76-F91 HydrophobicContact CD1-CE2 3.64Å; L76-F91 HydrophobicContact CD1-CZ 4.49Å; L76-F91 HydrophobicContact CD2-CD2 4.07Å; L76-F91 HydrophobicContact CD2-CE2 4.16Å; L76-F91 HydrophobicContact CG-CD2 4.34Å; L76-F91 HydrophobicContact CG-CE2 3.94Å; L76-I109 HydrophobicContact CD1-CD1 3.86Å; L76-F113 HydrophobicContact CD1-CD1 3.77Å; L76-F113 HydrophobicContact CD1-CE1 3.73Å; L76-L116 HydrophobicContact CB-CD1 4.04Å; L76-L116 HydrophobicContact CD1-CD1 4.35Å; L76-L116 HydrophobicContact CD2-CD1 3.73Å; L76-L116 HydrophobicContact CG-CD1 4.24Å
77	K	96.6	Very high	97	Very high	145 Å²	145	37.5 Å²	37.5	63%	0.63	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	6.6	177.6	-57.1	176.1	-174.6	176.4	0	112.7	F74 L75	F74-K77 PolarHBondContact O-N 2.85Å; L75-K77 PolarHBondContact O-N 2.89Å; L75-K77 VanDerWaalsContact O-N 3.13Å
78	D	96.6	Very high	97.1	Very high	17 Å²	17	36.4 Å²	36.4	9%	0.091	20%	0.196	C	C	.	.			trans	-62.6	145	179.8	-159.6	-58.3	0	0	0	110.4	R43 L75 D80 C83 R84	R43-D78 IonicContact CZ-OD2 3.48Å; R43-D78 VanDerWaalsContact CZ-OD2 3.3Å; R43-D78 IonicContact NE-OD2 3.65Å; R43-D78 PolarHBondContact NE-OD2 3.29Å; R43-D78 IonicContact NH2-OD1 2.78Å; R43-D78 PolarHBondContact NH2-OD1 3.34Å; R43-D78 IonicContact NH2-OD2 3.44Å; R43-D78 PolarHBondContact NH2-OD2 3.34Å; L75-D78 HydrophobicContact CD2-CB 4.33Å; L75-D78 VanDerWaalsContact O-CB 3.23Å; L75-D78 WeakPolarHBondContact O-CB 3.42Å; L75-D78 PolarHBondContact O-N 3.04Å; D78-D80 PolarHBondContact O-N 2.86Å; D78-D80 WeakPolarHBondContact OD1-CB 3.35Å; D78-D80 PolarHBondContact OD1-N 2.82Å; D78-C83 HydrophobicContact CB-CB 3.94Å; D78-R84 HydrophobicContact CB-CG 4.49Å; D78-R84 WeakPolarHBondContact O-CD 3.45Å; D78-R84 WeakPolarHBondContact O-CG 3.45Å; D78-R84 PolarHBondContact O-NH1 3.13Å
79	A	95.8	Very high	97.2	Very high	94 Å²	94	39.6 Å²	39.6	78%	0.777	21%	0.211	S	C	*	.	S	Bend	trans	-64	-32	175.9	0	0	0	0	0	111.4	R84	A79-R84 PolarHBondContact O-NH1 3.09Å
80	D	96.9	Very high	97.3	Very high	31 Å²	31	39.6 Å²	39.6	17%	0.166	21%	0.211	C	C	.	.			trans	-76.5	128.3	-179.1	-175.4	66.7	0	0	0	112.8	L40 Q44 D78 P82 C83 R84	L40-D80 HydrophobicContact CD1-CB 3.43Å; L40-D80 VanDerWaalsContact CD1-CB 3.43Å; L40-D80 VanDerWaalsContact CD1-CG 3.49Å; L40-D80 HydrophobicContact CD2-CB 4.4Å; Q44-D80 VanDerWaalsContact NE2-CG 3.34Å; Q44-D80 PolarHBondContact NE2-OD1 2.72Å; Q44-D80 PolarHBondContact NE2-OD2 3.06Å; D78-D80 PolarHBondContact O-N 2.86Å; D78-D80 WeakPolarHBondContact OD1-CB 3.35Å; D78-D80 PolarHBondContact OD1-N 2.82Å; D80-P82 WeakPolarHBondContact OD1-CD 3.41Å; D80-P82 VanDerWaalsContact OD2-CB 3.31Å; D80-P82 WeakPolarHBondContact OD2-CB 3.5Å; D80-P82 WeakPolarHBondContact OD2-CD 3.33Å; D80-P82 WeakPolarHBondContact OD2-CG 3.43Å; D80-C83 HydrophobicContact CB-CB 4.11Å; D80-C83 PolarHBondContact O-N 3Å; D80-C83 PolarHBondContact OD2-N 3.29Å; D80-R84 PolarHBondContact O-N 3.13Å; D80-R84 PolarHBondContact O-NH1 3.36Å
81	I	96.4	Very high	97.4	Very high	79 Å²	79	36.7 Å²	36.7	41%	0.405	19%	0.191	S	C	.	.	H	α-helix	trans	-64.6	-51.5	-179.3	-68.5	167.3	0	0	0	111.2	C83 R84 V85 P122 I125	I81-C83 VanDerWaalsContact C-N 3.3Å; I81-C83 PolarHBondContact O-N 3.17Å; I81-R84 PolarHBondContact O-N 2.94Å; I81-V85 HydrophobicContact CG2-CG2 4.03Å; I81-V85 WeakPolarHBondContact O-CG2 3.43Å; I81-V85 PolarHBondContact O-N 3.36Å; I81-P122 HydrophobicContact CD1-CG 4.26Å; I81-P122 HydrophobicContact CG1-CG 4.48Å; I81-P122 HydrophobicContact CG2-CG 4.06Å; I81-I125 HydrophobicContact CG2-CD1 4.31Å
82	P	96.1	Very high	97.4	Very high	50 Å²	50	37.4 Å²	37.4	33%	0.325	20%	0.196	S	C	.	.	H	α-helix	trans	-51.1	-44.1	174.8	-27.5	29	0	0	0	114.2	D80 R84 V85 Y86	D80-P82 WeakPolarHBondContact OD1-CD 3.41Å; D80-P82 VanDerWaalsContact OD2-CB 3.31Å; D80-P82 WeakPolarHBondContact OD2-CB 3.5Å; D80-P82 WeakPolarHBondContact OD2-CD 3.33Å; D80-P82 WeakPolarHBondContact OD2-CG 3.43Å; P82-R84 VanDerWaalsContact C-N 3.34Å; P82-R84 PolarHBondContact O-N 2.9Å; P82-V85 PolarHBondContact O-N 3.21Å; P82-Y86 WeakPolarHBondContact O-CD2 3.34Å; P82-Y86 PolarHBondContact O-N 3.19Å
83	C	97.4	Very high	97.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.9	-45.7	174.6	-78.4	0	0	0	0	112.3	L75 D78 D80 I81 S87	L75-C83 HydrophobicContact CD2-CB 4.43Å; D78-C83 HydrophobicContact CB-CB 3.94Å; D80-C83 HydrophobicContact CB-CB 4.11Å; D80-C83 PolarHBondContact O-N 3Å; D80-C83 PolarHBondContact OD2-N 3.29Å; I81-C83 VanDerWaalsContact C-N 3.3Å; I81-C83 PolarHBondContact O-N 3.17Å; C83-S87 VanDerWaalsContact O-CB 3.26Å; C83-S87 WeakPolarHBondContact O-CB 3.11Å; C83-S87 PolarHBondContact O-N 3.33Å; C83-S87 PolarHBondContact O-OG 3.19Å
84	R	97.8	Very high	97.4	Very high	26 Å²	26	36.8 Å²	36.8	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-43.5	176.2	-64.2	-161	-57.8	-78.8	7.4	112.4	L76 D78 A79 D80 I81 P82 S87 T88 I125	L76-R84 WeakPolarHBondContact O-CD 3.35Å; D78-R84 HydrophobicContact CB-CG 4.49Å; D78-R84 WeakPolarHBondContact O-CD 3.45Å; D78-R84 WeakPolarHBondContact O-CG 3.45Å; D78-R84 PolarHBondContact O-NH1 3.13Å; A79-R84 PolarHBondContact O-NH1 3.09Å; D80-R84 PolarHBondContact O-N 3.13Å; D80-R84 PolarHBondContact O-NH1 3.36Å; I81-R84 PolarHBondContact O-N 2.94Å; P82-R84 VanDerWaalsContact C-N 3.34Å; P82-R84 PolarHBondContact O-N 2.9Å; R84-S87 PolarHBondContact O-N 3.29Å; R84-T88 WeakPolarHBondContact O-CG2 3.48Å; R84-T88 PolarHBondContact O-N 2.93Å; R84-T88 PolarHBondContact O-OG1 3.09Å; R84-I125 HydrophobicContact CB-CD1 3.63Å; R84-I125 HydrophobicContact CB-CG1 4.49Å
85	V	97.9	Very high	97.5	Very high	23 Å²	23	30.1 Å²	30.1	14%	0.139	16%	0.162	C	C	.	.	H	α-helix	trans	-57.1	-56.9	178.8	171.8	0	0	0	0	110.6	I81 P82 S87 T88 E89 V124 I125	I81-V85 HydrophobicContact CG2-CG2 4.03Å; I81-V85 WeakPolarHBondContact O-CG2 3.43Å; I81-V85 PolarHBondContact O-N 3.36Å; P82-V85 PolarHBondContact O-N 3.21Å; V85-S87 PolarHBondContact O-N 2.82Å; V85-T88 PolarHBondContact O-N 3.38Å; V85-T88 PolarHBondContact O-OG1 3.41Å; V85-E89 PolarHBondContact O-N 3.39Å; V85-V124 HydrophobicContact CG1-CG2 4.03Å; V85-V124 HydrophobicContact CG2-CG1 3.76Å; V85-I125 HydrophobicContact CG2-CD1 4.05Å; V85-I125 HydrophobicContact CG2-CG1 3.61Å
86	Y	97.7	Very high	97.4	Very high	69 Å²	69	35.3 Å²	35.3	27%	0.271	19%	0.186	S	C	.	.	H	α-helix	trans	-64.3	-30.8	179.7	-71.2	-59.3	0	0	0	112.3	V47 K48 P82 E89 C90	V47-Y86 HydrophobicContact CG1-CD2 4.06Å; V47-Y86 HydrophobicContact CG1-CG 4.2Å; K48-Y86 HydrophobicContact CB-CD2 4.38Å; K48-Y86 HydrophobicContact CB-CE1 4.49Å; K48-Y86 HydrophobicContact CB-CE2 4.26Å; K48-Y86 HydrophobicContact CG-CE1 4.19Å; P82-Y86 WeakPolarHBondContact O-CD2 3.34Å; P82-Y86 PolarHBondContact O-N 3.19Å; Y86-E89 PolarHBondContact O-N 3.37Å; Y86-C90 PolarHBondContact O-N 3.23Å; Y86-C90 PolarHBondContact O-SG 2.97Å
87	S	98.2	Very high	97.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.4	-44.8	175.7	-60.6	0	0	0	0	111.9	L75 C83 R84 V85 E89 C90 F91	L75-S87 WeakPolarHBondContact CB-OG 3.42Å; C83-S87 VanDerWaalsContact O-CB 3.26Å; C83-S87 WeakPolarHBondContact O-CB 3.11Å; C83-S87 PolarHBondContact O-N 3.33Å; C83-S87 PolarHBondContact O-OG 3.19Å; R84-S87 PolarHBondContact O-N 3.29Å; V85-S87 PolarHBondContact O-N 2.82Å; S87-E89 VanDerWaalsContact C-N 3.31Å; S87-E89 PolarHBondContact O-N 3.23Å; S87-C90 WeakPolarHBondContact O-CB 3.48Å; S87-C90 PolarHBondContact O-N 3.2Å; S87-F91 WeakPolarHBondContact O-CD2 3.44Å; S87-F91 PolarHBondContact O-N 3.4Å; S87-F91 VanDerWaalsContact O-N 3.13Å
88	T	98.5	Very high	97.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-38.3	173.8	57.5	0	0	0	0	111.8	L76 R84 V85 F91 V92 L116 I125 N128	L76-T88 HydrophobicContact CD2-CG2 3.58Å; R84-T88 WeakPolarHBondContact O-CG2 3.48Å; R84-T88 PolarHBondContact O-N 2.93Å; R84-T88 PolarHBondContact O-OG1 3.09Å; V85-T88 PolarHBondContact O-N 3.38Å; V85-T88 PolarHBondContact O-OG1 3.41Å; T88-F91 PolarHBondContact O-N 3.29Å; T88-V92 WeakPolarHBondContact O-CG2 3.32Å; T88-V92 PolarHBondContact O-N 3.31Å; T88-L116 HydrophobicContact CG2-CD1 3.71Å; T88-I125 HydrophobicContact CG2-CG2 4.22Å; T88-N128 VanDerWaalsContact OG1-CB 3.24Å; T88-N128 WeakPolarHBondContact OG1-CB 3.49Å; T88-N128 PolarHBondContact OG1-ND2 3.16Å
89	E	98.2	Very high	97.2	Very high	68 Å²	68	36.8 Å²	36.8	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-64.6	-43.5	175.9	-167.7	174.6	179.4	0	0	112.1	C51 V85 Y86 S87 F91 V92 I93	C51-E89 VanDerWaalsContact SG-CD 3.56Å; C51-E89 VanDerWaalsContact SG-CG 3.6Å; V85-E89 PolarHBondContact O-N 3.39Å; Y86-E89 PolarHBondContact O-N 3.37Å; S87-E89 VanDerWaalsContact C-N 3.31Å; S87-E89 PolarHBondContact O-N 3.23Å; E89-F91 VanDerWaalsContact C-N 3.25Å; E89-F91 PolarHBondContact O-N 3.2Å; E89-V92 WeakPolarHBondContact O-CB 3.34Å; E89-V92 PolarHBondContact O-N 2.9Å; E89-I93 HydrophobicContact CG-CD1 4.46Å; E89-I93 WeakPolarHBondContact O-CG1 3.3Å; E89-I93 PolarHBondContact O-N 2.89Å
90	C	98.2	Very high	97.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-54.6	-43	171.5	-68.3	0	0	0	0	111.3	L54 L72 Y86 S87 I93 I94	L54-C90 HydrophobicContact CD1-CB 3.85Å; L72-C90 HydrophobicContact CD1-CB 3.73Å; L72-C90 HydrophobicContact CD2-CB 3.81Å; L72-C90 HydrophobicContact CG-CB 4.43Å; Y86-C90 PolarHBondContact O-N 3.23Å; Y86-C90 PolarHBondContact O-SG 2.97Å; S87-C90 WeakPolarHBondContact O-CB 3.48Å; S87-C90 PolarHBondContact O-N 3.2Å; C90-I93 PolarHBondContact O-N 3.12Å; C90-I94 WeakPolarHBondContact O-CB 3.47Å; C90-I94 WeakPolarHBondContact O-CD1 3.39Å; C90-I94 WeakPolarHBondContact O-CG1 3.47Å; C90-I94 PolarHBondContact O-N 3.02Å
91	F	98.5	Very high	97.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.2	-33.2	177.2	-81.3	-67	0	0	0	113.5	I69 L72 L76 S87 T88 E89 S95 A104 I109 F113 A132	I69-F91 HydrophobicContact CD1-CE1 4.28Å; I69-F91 HydrophobicContact CG2-CE1 4.21Å; L72-F91 HydrophobicContact CB-CD2 4.45Å; L72-F91 HydrophobicContact CB-CE2 3.56Å; L72-F91 HydrophobicContact CB-CZ 3.66Å; L76-F91 HydrophobicContact CD1-CD2 4.05Å; L76-F91 HydrophobicContact CD1-CE2 3.64Å; L76-F91 HydrophobicContact CD1-CZ 4.49Å; L76-F91 HydrophobicContact CD2-CD2 4.07Å; L76-F91 HydrophobicContact CD2-CE2 4.16Å; L76-F91 HydrophobicContact CG-CD2 4.34Å; L76-F91 HydrophobicContact CG-CE2 3.94Å; S87-F91 WeakPolarHBondContact O-CD2 3.44Å; S87-F91 PolarHBondContact O-N 3.4Å; S87-F91 VanDerWaalsContact O-N 3.13Å; T88-F91 PolarHBondContact O-N 3.29Å; E89-F91 VanDerWaalsContact C-N 3.25Å; E89-F91 PolarHBondContact O-N 3.2Å; F91-S95 WeakPolarHBondContact O-CB 3.46Å; F91-S95 PolarHBondContact O-N 3.32Å; F91-S95 PolarHBondContact O-OG 3.21Å; F91-A104 HydrophobicContact CE1-CB 4.49Å; F91-I109 HydrophobicContact CD1-CD1 4Å; F91-I109 HydrophobicContact CD1-CG1 4.16Å; F91-I109 HydrophobicContact CD2-CD1 4.23Å; F91-I109 HydrophobicContact CE1-CD1 3.43Å; F91-I109 VanDerWaalsContact CE1-CD1 3.43Å; F91-I109 HydrophobicContact CE1-CG1 3.95Å; F91-I109 HydrophobicContact CE2-CD1 3.69Å; F91-I109 HydrophobicContact CG-CD1 4.38Å; F91-I109 HydrophobicContact CZ-CD1 3.27Å; F91-I109 HydrophobicContact CZ-CG1 4.27Å; F91-F113 HydrophobicContact CB-CE1 4.26Å; F91-F113 HydrophobicContact CB-CZ 3.83Å; F91-F113 HydrophobicContact CD1-CZ 4.33Å; F91-F113 AromaticContact CD2-CE1 3.98Å; F91-F113 HydrophobicContact CD2-CE1 3.98Å; F91-F113 HydrophobicContact CD2-CZ 4.26Å; F91-F113 HydrophobicContact CG-CE1 4.09Å; F91-F113 AromaticContact CG-CZ 3.89Å; F91-F113 HydrophobicContact CG-CZ 3.89Å; F91-A132 HydrophobicContact CB-CB 4.26Å
92	V	98.5	Very high	97.3	Very high	19 Å²	19	31.4 Å²	31.4	12%	0.115	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-49.7	171.1	174.9	0	0	0	0	109.8	T88 E89 S95 Q96 N128 R131 A132 L135	T88-V92 WeakPolarHBondContact O-CG2 3.32Å; T88-V92 PolarHBondContact O-N 3.31Å; E89-V92 WeakPolarHBondContact O-CB 3.34Å; E89-V92 PolarHBondContact O-N 2.9Å; V92-S95 PolarHBondContact O-N 2.87Å; V92-Q96 WeakPolarHBondContact O-CG 3.29Å; V92-Q96 PolarHBondContact O-N 2.87Å; V92-N128 HydrophobicContact CG2-CB 4.14Å; V92-N128 WeakPolarHBondContact CG2-O 3.42Å; V92-R131 HydrophobicContact CG1-CB 4.36Å; V92-R131 HydrophobicContact CG2-CB 3.85Å; V92-A132 HydrophobicContact CG2-CB 4.17Å; V92-L135 HydrophobicContact CG1-CD1 4.05Å; V92-L135 VanDerWaalsContact O-CD1 3.28Å; V92-L135 WeakPolarHBondContact O-CD1 3.2Å
93	I	97.9	Very high	97.3	Very high	7 Å²	7	29.3 Å²	29.3	4%	0.036	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-50.5	-179.7	-61.8	166	0	0	0	110.8	C51 L54 E89 C90 S95 Q96	C51-I93 VanDerWaalsContact SG-CD1 3.54Å; L54-I93 HydrophobicContact CB-CG2 3.83Å; L54-I93 VanDerWaalsContact O-CG2 3.27Å; L54-I93 WeakPolarHBondContact O-CG2 3.27Å; E89-I93 HydrophobicContact CG-CD1 4.46Å; E89-I93 WeakPolarHBondContact O-CG1 3.3Å; E89-I93 PolarHBondContact O-N 2.89Å; C90-I93 PolarHBondContact O-N 3.12Å; I93-S95 VanDerWaalsContact C-N 3.28Å; I93-S95 PolarHBondContact O-N 3.42Å; I93-Q96 WeakPolarHBondContact O-CB 3.46Å; I93-Q96 PolarHBondContact O-N 3.4Å
94	I	97.4	Very high	97.3	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-58	-41.7	178.7	-69.9	165.8	0	0	0	110.9	L54 I60 I69 L72 C90 Q96 H97 G100	L54-I94 HydrophobicContact CD1-CD1 3.84Å; L54-I94 HydrophobicContact CD1-CG1 3.91Å; L54-I94 HydrophobicContact CD2-CD1 4.49Å; L54-I94 HydrophobicContact CD2-CG1 4.22Å; I60-I94 HydrophobicContact CG2-CG2 4.49Å; I69-I94 HydrophobicContact CD1-CD1 3.87Å; I69-I94 HydrophobicContact CD1-CG2 4.05Å; L72-I94 HydrophobicContact CD1-CD1 3.72Å; C90-I94 WeakPolarHBondContact O-CB 3.47Å; C90-I94 WeakPolarHBondContact O-CD1 3.39Å; C90-I94 WeakPolarHBondContact O-CG1 3.47Å; C90-I94 PolarHBondContact O-N 3.02Å; I94-Q96 VanDerWaalsContact C-N 3.26Å; I94-Q96 PolarHBondContact O-N 3Å; I94-H97 PolarHBondContact O-N 3.4Å; I94-H97 VanDerWaalsContact O-N 3.17Å; I94-G100 WeakPolarHBondContact O-CA 3Å
95	S	97.4	Very high	97.3	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-74.5	-11.2	-175.9	-57.7	0	0	0	0	114	F91 V92 I93 H97 R101	F91-S95 WeakPolarHBondContact O-CB 3.46Å; F91-S95 PolarHBondContact O-N 3.32Å; F91-S95 PolarHBondContact O-OG 3.21Å; V92-S95 PolarHBondContact O-N 2.87Å; I93-S95 VanDerWaalsContact C-N 3.28Å; I93-S95 PolarHBondContact O-N 3.42Å; S95-H97 PolarHBondContact O-N 2.97Å; S95-R101 VanDerWaalsContact O-CD 3.3Å; S95-R101 WeakPolarHBondContact O-CD 3.47Å; S95-R101 WeakPolarHBondContact O-CG 3.27Å; S95-R101 PolarHBondContact O-NH1 3.29Å
96	Q	96.6	Very high	97.3	Very high	110 Å²	110	37.5 Å²	37.5	51%	0.514	18%	0.179	S	C	.	.	H	α-helix	trans	-62.9	-26.4	169	-67.3	173.6	28.4	0	0	111.3	V92 I93 I94 R101 L135	V92-Q96 WeakPolarHBondContact O-CG 3.29Å; V92-Q96 PolarHBondContact O-N 2.87Å; I93-Q96 WeakPolarHBondContact O-CB 3.46Å; I93-Q96 PolarHBondContact O-N 3.4Å; I94-Q96 VanDerWaalsContact C-N 3.26Å; I94-Q96 PolarHBondContact O-N 3Å; Q96-R101 PolarHBondContact O-NH1 2.85Å; Q96-L135 HydrophobicContact CG-CD1 4Å; Q96-L135 HydrophobicContact CG-CD2 4.39Å
97	H	95.4	Very high	97.2	Very high	56 Å²	56	38.3 Å²	38.3	26%	0.259	18%	0.184	S	C	.	.	S	Bend	trans	-102.5	140.7	-178.5	-61.8	-93.7	0	0	0	112.2	I60 I94 S95 I99 G100 R101	I60-H97 HydrophobicContact CD1-CB 4.35Å; I60-H97 WeakPolarHBondContact CD1-CD2 3.48Å; I60-H97 WeakPolarHBondContact CD1-NE2 3.43Å; I94-H97 PolarHBondContact O-N 3.4Å; I94-H97 VanDerWaalsContact O-N 3.17Å; S95-H97 PolarHBondContact O-N 2.97Å; H97-I99 VanDerWaalsContact C-N 3.32Å; H97-I99 HydrophobicContact CB-CG2 4.34Å; H97-I99 PolarHBondContact O-N 2.82Å; H97-G100 PolarHBondContact O-N 3.32Å; H97-G100 VanDerWaalsContact O-N 3.07Å; H97-R101 VanDerWaalsContact C-NH1 3.34Å; H97-R101 PolarHBondContact O-N 3.38Å
98	A	95.3	Very high	97.1	Very high	58 Å²	58	42.9 Å²	42.9	48%	0.479	21%	0.209	S	C	.	.	H	α-helix	trans	-59.2	-40.9	-177.4	0	0	0	0	0	112.9	G100 R101 M102	A98-G100 VanDerWaalsContact C-N 3.29Å; A98-G100 PolarHBondContact O-N 3.37Å; A98-R101 PolarHBondContact O-N 2.92Å; A98-M102 WeakPolarHBondContact O-CG 3.46Å; A98-M102 PolarHBondContact O-N 3.29Å; A98-M102 VanDerWaalsContact O-N 3.08Å
99	I	95.2	Very high	97	Very high	81 Å²	81	43 Å²	43	42%	0.415	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-39.4	176.5	-167	170.8	0	0	0	111.7	I60 E61 I64 H97 M102 A103	I60-I99 HydrophobicContact CG2-CG2 4.35Å; E61-I99 HydrophobicContact CB-CD1 4.41Å; E61-I99 HydrophobicContact CG-CD1 4.1Å; I64-I99 HydrophobicContact CD1-CG1 4.06Å; I64-I99 HydrophobicContact CD1-CG2 4.04Å; H97-I99 VanDerWaalsContact C-N 3.32Å; H97-I99 HydrophobicContact CB-CG2 4.34Å; H97-I99 PolarHBondContact O-N 2.82Å; I99-M102 PolarHBondContact O-N 3.19Å; I99-A103 WeakPolarHBondContact O-CB 3.46Å; I99-A103 PolarHBondContact O-N 3.15Å
100	G	96.6	Very high	97	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.1	-42.6	178.1	0	0	0	0	0	113	I94 H97 A98 M102 A103 A104	I94-G100 WeakPolarHBondContact O-CA 3Å; H97-G100 PolarHBondContact O-N 3.32Å; H97-G100 VanDerWaalsContact O-N 3.07Å; A98-G100 VanDerWaalsContact C-N 3.29Å; A98-G100 PolarHBondContact O-N 3.37Å; G100-M102 PolarHBondContact O-N 2.98Å; G100-A103 PolarHBondContact O-N 3.08Å; G100-A104 WeakPolarHBondContact O-CB 3.49Å; G100-A104 PolarHBondContact O-N 3.49Å
101	R	97.5	Very high	96.9	Very high	35 Å²	35	46.9 Å²	46.9	13%	0.132	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-48.1	173.1	-64	-168.6	-67.9	-84.6	10.9	111.7	S95 Q96 H97 A98 A103 A104 L105 L135 L136 T138	S95-R101 VanDerWaalsContact O-CD 3.3Å; S95-R101 WeakPolarHBondContact O-CD 3.47Å; S95-R101 WeakPolarHBondContact O-CG 3.27Å; S95-R101 PolarHBondContact O-NH1 3.29Å; Q96-R101 PolarHBondContact O-NH1 2.85Å; H97-R101 VanDerWaalsContact C-NH1 3.34Å; H97-R101 PolarHBondContact O-N 3.38Å; A98-R101 PolarHBondContact O-N 2.92Å; R101-A103 VanDerWaalsContact C-N 3.34Å; R101-A103 PolarHBondContact O-N 3.14Å; R101-A104 PolarHBondContact O-N 3.46Å; R101-L105 VanDerWaalsContact O-CG 3.31Å; R101-L105 WeakPolarHBondContact O-CG 3.14Å; R101-L105 PolarHBondContact O-N 3.35Å; R101-L135 WeakPolarHBondContact CD-O 3.3Å; R101-L136 HydrophobicContact CB-CD2 3.98Å; R101-L136 HydrophobicContact CG-CD2 4.13Å; R101-T138 PolarHBondContact NE-OG1 3.22Å
102	M	96.7	Very high	96.9	Very high	56 Å²	56	47.3 Å²	47.3	28%	0.276	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-39.8	178.8	-68	-55.6	-59.7	0	0	112.1	A98 I99 G100 R106 T141	A98-M102 WeakPolarHBondContact O-CG 3.46Å; A98-M102 PolarHBondContact O-N 3.29Å; A98-M102 VanDerWaalsContact O-N 3.08Å; I99-M102 PolarHBondContact O-N 3.19Å; G100-M102 PolarHBondContact O-N 2.98Å; M102-R106 WeakPolarHBondContact O-CB 3.43Å; M102-R106 VanDerWaalsContact O-CG 3.23Å; M102-R106 WeakPolarHBondContact O-CG 3.33Å; M102-R106 PolarHBondContact O-N 3.3Å; M102-T141 HydrophobicContact CE-CG2 4.13Å; M102-T141 HydrophobicContact SD-CG2 4.19Å
103	A	97	Very high	96.9	Very high	6 Å²	6	46.5 Å²	46.5	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-48.9	175.5	0	0	0	0	0	111.3	I64 I69 I99 G100 R101 L105 R106 H107	I64-A103 HydrophobicContact CD1-CB 3.92Å; I64-A103 HydrophobicContact CG1-CB 4.01Å; I64-A103 HydrophobicContact CG2-CB 3.76Å; I69-A103 HydrophobicContact CG1-CB 4.24Å; I99-A103 WeakPolarHBondContact O-CB 3.46Å; I99-A103 PolarHBondContact O-N 3.15Å; G100-A103 PolarHBondContact O-N 3.08Å; R101-A103 VanDerWaalsContact C-N 3.34Å; R101-A103 PolarHBondContact O-N 3.14Å; A103-L105 VanDerWaalsContact C-N 3.35Å; A103-L105 PolarHBondContact O-N 2.85Å; A103-R106 PolarHBondContact O-N 3.28Å; A103-H107 PolarHBondContact O-CD2 3.47Å; A103-H107 PolarHBondContact O-N 3.38Å
104	A	97.7	Very high	96.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-44.9	178.8	0	0	0	0	0	111.9	F91 G100 R101 H107 N108 I109 L136	F91-A104 HydrophobicContact CE1-CB 4.49Å; G100-A104 WeakPolarHBondContact O-CB 3.49Å; G100-A104 PolarHBondContact O-N 3.49Å; R101-A104 PolarHBondContact O-N 3.46Å; A104-H107 CarbonylContact O-C 3.55Å; A104-H107 PolarHBondContact O-N 2.97Å; A104-N108 PolarHBondContact O-N 3.37Å; A104-I109 HydrophobicContact CB-CB 4.07Å; A104-I109 HydrophobicContact CB-CG1 4.41Å; A104-I109 HydrophobicContact CB-CG2 3.81Å; A104-I109 VanDerWaalsContact O-CB 3.28Å; A104-I109 WeakPolarHBondContact O-CB 3.45Å; A104-I109 WeakPolarHBondContact O-CG2 2.89Å; A104-I109 PolarHBondContact O-N 3.41Å; A104-I109 VanDerWaalsContact O-N 3.16Å; A104-L136 HydrophobicContact CB-CD2 4.31Å
105	L	97.5	Very high	96.9	Very high	24 Å²	24	54.6 Å²	54.6	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-41.5	176.8	-68.6	173.8	0	0	0	112.9	R101 A103 H107 N108 L136 T141 A145	R101-L105 VanDerWaalsContact O-CG 3.31Å; R101-L105 WeakPolarHBondContact O-CG 3.14Å; R101-L105 PolarHBondContact O-N 3.35Å; A103-L105 VanDerWaalsContact C-N 3.35Å; A103-L105 PolarHBondContact O-N 2.85Å; L105-H107 PolarHBondContact O-N 2.68Å; L105-N108 PolarHBondContact O-N 2.69Å; L105-N108 VanDerWaalsContact O-N 3.08Å; L105-L136 HydrophobicContact CD2-CD1 4.08Å; L105-L136 HydrophobicContact CD2-CD2 4.33Å; L105-L136 HydrophobicContact CG-CD2 4.15Å; L105-T141 HydrophobicContact CD1-CG2 4.15Å; L105-A145 HydrophobicContact CD2-CB 3.67Å
106	R	96.3	Very high	96.9	Very high	196 Å²	196	54.7 Å²	54.7	74%	0.74	27%	0.271	S	S	*	.	H	α-helix	trans	-61.2	-25	175.6	-75.7	171.7	-175.1	168	2.5	113.2	M102 A103	M102-R106 WeakPolarHBondContact O-CB 3.43Å; M102-R106 VanDerWaalsContact O-CG 3.23Å; M102-R106 WeakPolarHBondContact O-CG 3.33Å; M102-R106 PolarHBondContact O-N 3.3Å; A103-R106 PolarHBondContact O-N 3.28Å
107	H	96.2	Very high	96.9	Very high	85 Å²	85	49.8 Å²	49.8	39%	0.394	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	19.1	177.6	-73.8	-75.2	0	0	0	113.4	I69 C70 A103 A104 L105 I109	I69-H107 HydrophobicContact CG2-CB 3.67Å; C70-H107 PolarHBondContact SG-CE1 3.17Å; C70-H107 PolarHBondContact SG-ND1 3.18Å; C70-H107 VanDerWaalsContact SG-ND1 3.41Å; A103-H107 PolarHBondContact O-CD2 3.47Å; A103-H107 PolarHBondContact O-N 3.38Å; A104-H107 CarbonylContact O-C 3.55Å; A104-H107 PolarHBondContact O-N 2.97Å; L105-H107 PolarHBondContact O-N 2.68Å; H107-I109 VanDerWaalsContact C-N 3.25Å; H107-I109 PolarHBondContact O-N 3.32Å
108	N	95.6	Very high	97	Very high	97 Å²	97	50.8 Å²	50.8	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	42.1	178.9	-62.3	-26.3	0	0	0	113.1	A104 L105 L110 E111	A104-N108 PolarHBondContact O-N 3.37Å; L105-N108 PolarHBondContact O-N 2.69Å; L105-N108 VanDerWaalsContact O-N 3.08Å; N108-L110 PolarHBondContact O-N 3.12Å; N108-E111 HydrophobicContact CB-CG 4.43Å; N108-E111 PolarHBondContact O-N 3.15Å; N108-E111 VanDerWaalsContact O-N 3.08Å
109	I	97.6	Very high	97	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-56.2	-29.9	-173.8	-168.7	58.1	0	0	0	113.6	L76 F91 A104 H107 E111 S112 F113 L136	L76-I109 HydrophobicContact CD1-CD1 3.86Å; F91-I109 HydrophobicContact CD1-CD1 4Å; F91-I109 HydrophobicContact CD1-CG1 4.16Å; F91-I109 HydrophobicContact CD2-CD1 4.23Å; F91-I109 HydrophobicContact CE1-CD1 3.43Å; F91-I109 VanDerWaalsContact CE1-CD1 3.43Å; F91-I109 HydrophobicContact CE1-CG1 3.95Å; F91-I109 HydrophobicContact CE2-CD1 3.69Å; F91-I109 HydrophobicContact CG-CD1 4.38Å; F91-I109 HydrophobicContact CZ-CD1 3.27Å; F91-I109 HydrophobicContact CZ-CG1 4.27Å; A104-I109 HydrophobicContact CB-CB 4.07Å; A104-I109 HydrophobicContact CB-CG1 4.41Å; A104-I109 HydrophobicContact CB-CG2 3.81Å; A104-I109 VanDerWaalsContact O-CB 3.28Å; A104-I109 WeakPolarHBondContact O-CB 3.45Å; A104-I109 WeakPolarHBondContact O-CG2 2.89Å; A104-I109 PolarHBondContact O-N 3.41Å; A104-I109 VanDerWaalsContact O-N 3.16Å; H107-I109 VanDerWaalsContact C-N 3.25Å; H107-I109 PolarHBondContact O-N 3.32Å; I109-E111 VanDerWaalsContact C-N 3.35Å; I109-E111 PolarHBondContact O-N 3.49Å; I109-S112 CarbonylContact O-C 3.58Å; I109-S112 WeakPolarHBondContact O-CA 3.33Å; I109-S112 WeakPolarHBondContact O-CB 3.34Å; I109-S112 PolarHBondContact O-N 3.18Å; I109-F113 HydrophobicContact CD1-CD1 4.25Å; I109-F113 HydrophobicContact CD1-CE1 3.84Å; I109-F113 HydrophobicContact CD1-CZ 4.02Å; I109-F113 HydrophobicContact CG1-CD1 4.09Å; I109-F113 HydrophobicContact CG1-CD2 3.97Å; I109-F113 HydrophobicContact CG1-CE1 3.68Å; I109-F113 HydrophobicContact CG1-CE2 3.55Å; I109-F113 HydrophobicContact CG1-CG 4.23Å; I109-F113 HydrophobicContact CG1-CZ 3.38Å; I109-F113 HydrophobicContact CG2-CE2 4.22Å; I109-F113 PolarHBondContact O-N 3.26Å; I109-L136 HydrophobicContact CG2-CD1 3.8Å
110	L	97.9	Very high	97	Very high	13 Å²	13	57.5 Å²	57.5	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-56.9	-46.5	178	-61.2	179.9	0	0	0	111.1	N108 S112 F113 E114 I133 L136 A145 I146 A149 Y151	N108-L110 PolarHBondContact O-N 3.12Å; L110-S112 PolarHBondContact O-N 3.18Å; L110-F113 HydrophobicContact CD2-CD2 4.45Å; L110-F113 WeakPolarHBondContact O-CA 3.4Å; L110-F113 PolarHBondContact O-N 3.45Å; L110-E114 PolarHBondContact O-N 3.41Å; L110-I133 HydrophobicContact CD2-CG1 4.47Å; L110-L136 HydrophobicContact CD2-CD1 3.94Å; L110-A145 HydrophobicContact CD1-CB 4.03Å; L110-I146 HydrophobicContact CD1-CD1 3.87Å; L110-I146 HydrophobicContact CD1-CG1 4.34Å; L110-I146 HydrophobicContact CD2-CD1 3.56Å; L110-I146 HydrophobicContact CG-CD1 4.39Å; L110-A149 HydrophobicContact CB-CB 4.47Å; L110-A149 HydrophobicContact CD1-CB 3.86Å; L110-Y151 VanDerWaalsContact C-OH 3.28Å; L110-Y151 HydrophobicContact CB-CE2 3.99Å; L110-Y151 HydrophobicContact CD2-CE1 4.37Å; L110-Y151 PolarHBondContact O-OH 3.38Å
111	E	97.1	Very high	96.9	Very high	137 Å²	137	59.6 Å²	59.6	64%	0.64	28%	0.28	S	S	*	.	H	α-helix	trans	-57.7	-28.1	175.9	-64.4	179.4	-172.3	0	0	113.2	N108 I109	N108-E111 HydrophobicContact CB-CG 4.43Å; N108-E111 PolarHBondContact O-N 3.15Å; N108-E111 VanDerWaalsContact O-N 3.08Å; I109-E111 VanDerWaalsContact C-N 3.35Å; I109-E111 PolarHBondContact O-N 3.49Å
112	S	97.5	Very high	96.9	Very high	10 Å²	10	60 Å²	60	7%	0.07	29%	0.288	C	S	.	.	H	α-helix	trans	-83.8	-26.3	175.4	-55.1	0	0	0	0	113.2	S73 I109 L110	S73-S112 PolarHBondContact OG-OG 3.21Å; I109-S112 CarbonylContact O-C 3.58Å; I109-S112 WeakPolarHBondContact O-CA 3.33Å; I109-S112 WeakPolarHBondContact O-CB 3.34Å; I109-S112 PolarHBondContact O-N 3.18Å; L110-S112 PolarHBondContact O-N 3.18Å
113	F	98.4	Very high	96.9	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-80.6	-32.9	177.3	-73.9	-17.4	0	0	0	113.2	L76 F91 I109 L110 P115 L116 T129 A132 I133 L136	L76-F113 HydrophobicContact CD1-CD1 3.77Å; L76-F113 HydrophobicContact CD1-CE1 3.73Å; F91-F113 HydrophobicContact CB-CE1 4.26Å; F91-F113 HydrophobicContact CB-CZ 3.83Å; F91-F113 HydrophobicContact CD1-CZ 4.33Å; F91-F113 AromaticContact CD2-CE1 3.98Å; F91-F113 HydrophobicContact CD2-CE1 3.98Å; F91-F113 HydrophobicContact CD2-CZ 4.26Å; F91-F113 HydrophobicContact CG-CE1 4.09Å; F91-F113 AromaticContact CG-CZ 3.89Å; F91-F113 HydrophobicContact CG-CZ 3.89Å; I109-F113 HydrophobicContact CD1-CD1 4.25Å; I109-F113 HydrophobicContact CD1-CE1 3.84Å; I109-F113 HydrophobicContact CD1-CZ 4.02Å; I109-F113 HydrophobicContact CG1-CD1 4.09Å; I109-F113 HydrophobicContact CG1-CD2 3.97Å; I109-F113 HydrophobicContact CG1-CE1 3.68Å; I109-F113 HydrophobicContact CG1-CE2 3.55Å; I109-F113 HydrophobicContact CG1-CG 4.23Å; I109-F113 HydrophobicContact CG1-CZ 3.38Å; I109-F113 HydrophobicContact CG2-CE2 4.22Å; I109-F113 PolarHBondContact O-N 3.26Å; L110-F113 HydrophobicContact CD2-CD2 4.45Å; L110-F113 WeakPolarHBondContact O-CA 3.4Å; L110-F113 PolarHBondContact O-N 3.45Å; F113-P115 VanDerWaalsContact C-CD 3.49Å; F113-L116 HydrophobicContact CD1-CD1 4.46Å; F113-L116 WeakPolarHBondContact O-CA 3.25Å; F113-L116 VanDerWaalsContact O-CB 3.32Å; F113-L116 WeakPolarHBondContact O-CB 3.34Å; F113-L116 PolarHBondContact O-N 3.47Å; F113-T129 HydrophobicContact CB-CG2 3.64Å; F113-T129 HydrophobicContact CD1-CG2 3.85Å; F113-T129 HydrophobicContact CD2-CG2 4.27Å; F113-T129 HydrophobicContact CG-CG2 3.69Å; F113-A132 HydrophobicContact CE2-CB 3.77Å; F113-A132 HydrophobicContact CZ-CB 3.67Å; F113-I133 HydrophobicContact CB-CD1 4.38Å; F113-I133 HydrophobicContact CD2-CD1 4.26Å; F113-I133 HydrophobicContact CD2-CG1 3.72Å; F113-I133 HydrophobicContact CE2-CG1 4.26Å; F113-L136 HydrophobicContact CE2-CD1 4.32Å
114	E	97.7	Very high	97	Very high	104 Å²	104	64.3 Å²	64.3	49%	0.486	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-49.6	-48.4	-176	-161.9	-176.2	134.5	0	0	113.7	L110 L116 L117 Y151 L154	L110-E114 PolarHBondContact O-N 3.41Å; E114-L116 PolarHBondContact O-N 2.91Å; E114-L117 WeakPolarHBondContact O-CB 3.4Å; E114-L117 PolarHBondContact O-N 3.23Å; E114-L117 VanDerWaalsContact O-N 3.15Å; E114-Y151 WeakPolarHBondContact CA-OH 3.14Å; E114-Y151 WeakPolarHBondContact CB-OH 3.42Å; E114-Y151 PolarHBondContact N-OH 2.91Å; E114-Y151 VanDerWaalsContact N-OH 3.13Å; E114-L154 HydrophobicContact CG-CD1 4.2Å
115	P	97.3	Very high	97	Very high	74 Å²	74	64.2 Å²	64.2	48%	0.481	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-69	-17.3	-179.9	-17.7	33.4	0	0	0	113.9	F113 L117	F113-P115 VanDerWaalsContact C-CD 3.49Å; P115-L117 VanDerWaalsContact C-N 3.28Å
116	L	97.8	Very high	97	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.021	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-82.2	-9.3	178.3	-59.4	-176.2	0	0	0	112.8	L76 T88 F113 E114 I125 R126 T129	L76-L116 HydrophobicContact CB-CD1 4.04Å; L76-L116 HydrophobicContact CD1-CD1 4.35Å; L76-L116 HydrophobicContact CD2-CD1 3.73Å; L76-L116 HydrophobicContact CG-CD1 4.24Å; T88-L116 HydrophobicContact CG2-CD1 3.71Å; F113-L116 HydrophobicContact CD1-CD1 4.46Å; F113-L116 WeakPolarHBondContact O-CA 3.25Å; F113-L116 VanDerWaalsContact O-CB 3.32Å; F113-L116 WeakPolarHBondContact O-CB 3.34Å; F113-L116 PolarHBondContact O-N 3.47Å; E114-L116 PolarHBondContact O-N 2.91Å; L116-I125 HydrophobicContact CB-CG2 4.04Å; L116-I125 HydrophobicContact CD1-CG2 4.3Å; L116-I125 HydrophobicContact CD2-CG2 3.98Å; L116-I125 HydrophobicContact CG-CG2 4.35Å; L116-R126 WeakPolarHBondContact O-CG 3.25Å; L116-T129 HydrophobicContact CB-CG2 4.11Å
117	L	97.1	Very high	97.1	Very high	7 Å²	7	55 Å²	55	4%	0.037	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-89.1	-3.8	176.8	-53.9	-179.1	0	0	0	112.6	E114 P115 F119 T129 I133 Y151 L154	E114-L117 WeakPolarHBondContact O-CB 3.4Å; E114-L117 PolarHBondContact O-N 3.23Å; E114-L117 VanDerWaalsContact O-N 3.15Å; P115-L117 VanDerWaalsContact C-N 3.28Å; L117-F119 PolarHBondContact O-N 3Å; L117-T129 HydrophobicContact CD2-CG2 3.51Å; L117-T129 HydrophobicContact CG-CG2 4.3Å; L117-I133 HydrophobicContact CD1-CD1 3.95Å; L117-I133 HydrophobicContact CD2-CD1 4.16Å; L117-Y151 HydrophobicContact CD1-CD1 4.49Å; L117-Y151 HydrophobicContact CD1-CE1 3.87Å; L117-L154 HydrophobicContact CB-CD2 4.27Å; L117-L154 HydrophobicContact CD1-CD2 3.3Å; L117-L154 HydrophobicContact CG-CD2 4.39Å
118	D	95.9	Very high	97.2	Very high	77 Å²	77	51.7 Å²	51.7	41%	0.412	26%	0.263	S	S	.	.	S	Bend	trans	-63.6	130.1	173.7	-173.2	-56.1	0	0	0	110.3	K120 Q121 R126	D118-K120 PolarHBondContact O-N 3.14Å; D118-K120 WeakPolarHBondContact OD1-CB 3.43Å; D118-K120 VanDerWaalsContact OD1-CG 3.23Å; D118-K120 WeakPolarHBondContact OD1-CG 3.37Å; D118-K120 PolarHBondContact OD1-N 3.28Å; D118-Q121 WeakPolarHBondContact O-CB 3.26Å; D118-Q121 WeakPolarHBondContact O-CG 3.38Å; D118-Q121 PolarHBondContact O-N 3.13Å; D118-R126 WeakPolarHBondContact O-CD 3.16Å
119	F	95.3	Very high	97.4	Very high	94 Å²	94	47 Å²	47	41%	0.412	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-13.3	-179.5	-67.9	-74.9	0	0	0	114.8	L117 Q121 N161 E162	L117-F119 PolarHBondContact O-N 3Å; F119-Q121 VanDerWaalsContact C-N 3.34Å; F119-N161 HydrophobicContact CE1-CB 3.79Å; F119-N161 HydrophobicContact CE2-CB 4.14Å; F119-N161 HydrophobicContact CZ-CB 3.5Å; F119-N161 VanDerWaalsContact CZ-CB 3.5Å; F119-E162 HydrophobicContact CE1-CG 3.72Å; F119-E162 HydrophobicContact CZ-CG 4.33Å
120	K	95.2	Very high	97.4	Very high	186 Å²	186	47 Å²	47	81%	0.809	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-16.9	172.3	-63.1	168.5	-175.8	166.3	0	113.2	D118	D118-K120 PolarHBondContact O-N 3.14Å; D118-K120 WeakPolarHBondContact OD1-CB 3.43Å; D118-K120 VanDerWaalsContact OD1-CG 3.23Å; D118-K120 WeakPolarHBondContact OD1-CG 3.37Å; D118-K120 PolarHBondContact OD1-N 3.28Å
121	Q	96.4	Very high	97.5	Very high	43 Å²	43	50.5 Å²	50.5	20%	0.201	25%	0.25	C	C	.	.	S	Bend	trans	-69.6	149.3	174.2	-64.3	-68.5	-14.2	0	0	110.2	D118 F119 I125 R126	D118-Q121 WeakPolarHBondContact O-CB 3.26Å; D118-Q121 WeakPolarHBondContact O-CG 3.38Å; D118-Q121 PolarHBondContact O-N 3.13Å; F119-Q121 VanDerWaalsContact C-N 3.34Å; Q121-I125 HydrophobicContact CB-CG2 4.44Å; Q121-R126 HydrophobicContact CB-CG 3.93Å; Q121-R126 PolarHBondContact O-NH1 3.41Å
122	P	97	Very high	97.5	Very high	44 Å²	44	44 Å²	44	29%	0.286	22%	0.219	S	C	.	.			trans	-53.4	140.4	169.8	-26.2	33.1	0	0	0	113.1	I81 V124 I125 R126	I81-P122 HydrophobicContact CD1-CG 4.26Å; I81-P122 HydrophobicContact CG1-CG 4.48Å; I81-P122 HydrophobicContact CG2-CG 4.06Å; P122-V124 HydrophobicContact CB-CG1 4.12Å; P122-V124 PolarHBondContact O-N 3.48Å; P122-V124 VanDerWaalsContact O-N 3.14Å; P122-I125 HydrophobicContact CB-CG1 4.5Å; P122-I125 HydrophobicContact CG-CD1 4.22Å; P122-I125 WeakPolarHBondContact O-CB 3.5Å; P122-I125 PolarHBondContact O-N 2.92Å; P122-R126 PolarHBondContact O-N 2.9Å
123	D	96.9	Very high	97.6	Very high	87 Å²	87	43.5 Å²	43.5	47%	0.465	22%	0.216	S	C	.	.	H	α-helix	trans	-52.6	-39.6	-178.2	-67.2	-2.9	0	0	0	112.9	I125 R126 L127	D123-I125 VanDerWaalsContact C-N 3.29Å; D123-I125 PolarHBondContact O-N 3.05Å; D123-R126 PolarHBondContact O-N 3.3Å; D123-R126 IonicContact OD1-CZ 2.71Å; D123-R126 IonicContact OD1-NH1 2.72Å; D123-R126 PolarHBondContact OD1-NH1 3.09Å; D123-R126 IonicContact OD1-NH2 3.13Å; D123-R126 PolarHBondContact OD1-NH2 3.43Å; D123-L127 VanDerWaalsContact O-CB 3.23Å; D123-L127 WeakPolarHBondContact O-CB 3.35Å; D123-L127 PolarHBondContact O-N 3.34Å
124	V	97.5	Very high	97.6	Very high	65 Å²	65	45.3 Å²	45.3	39%	0.394	22%	0.224	S	C	.	.	H	α-helix	trans	-60.4	-35.4	178	60.7	0	0	0	0	113	V85 P122 N128	V85-V124 HydrophobicContact CG1-CG2 4.03Å; V85-V124 HydrophobicContact CG2-CG1 3.76Å; P122-V124 HydrophobicContact CB-CG1 4.12Å; P122-V124 PolarHBondContact O-N 3.48Å; P122-V124 VanDerWaalsContact O-N 3.14Å; V124-N128 WeakPolarHBondContact O-CB 3.46Å; V124-N128 PolarHBondContact O-N 2.87Å; V124-N128 VanDerWaalsContact O-N 3.08Å
125	I	98.3	Very high	97.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-71.4	-46.2	177.1	-69.5	-178.5	0	0	0	109.5	I81 R84 V85 T88 L116 Q121 P122 D123 L127 N128 T129	I81-I125 HydrophobicContact CG2-CD1 4.31Å; R84-I125 HydrophobicContact CB-CD1 3.63Å; R84-I125 HydrophobicContact CB-CG1 4.49Å; V85-I125 HydrophobicContact CG2-CD1 4.05Å; V85-I125 HydrophobicContact CG2-CG1 3.61Å; T88-I125 HydrophobicContact CG2-CG2 4.22Å; L116-I125 HydrophobicContact CB-CG2 4.04Å; L116-I125 HydrophobicContact CD1-CG2 4.3Å; L116-I125 HydrophobicContact CD2-CG2 3.98Å; L116-I125 HydrophobicContact CG-CG2 4.35Å; Q121-I125 HydrophobicContact CB-CG2 4.44Å; P122-I125 HydrophobicContact CB-CG1 4.5Å; P122-I125 HydrophobicContact CG-CD1 4.22Å; P122-I125 WeakPolarHBondContact O-CB 3.5Å; P122-I125 PolarHBondContact O-N 2.92Å; D123-I125 VanDerWaalsContact C-N 3.29Å; D123-I125 PolarHBondContact O-N 3.05Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 2.89Å; I125-N128 PolarHBondContact O-N 2.72Å; I125-T129 VanDerWaalsContact O-CB 3.31Å; I125-T129 WeakPolarHBondContact O-CB 3.43Å; I125-T129 PolarHBondContact O-N 3.43Å; I125-T129 PolarHBondContact O-OG1 3.41Å
126	R	98.3	Very high	97.7	Very high	8 Å²	8	38.5 Å²	38.5	3%	0.03	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-43.8	178.6	-55.7	-158.6	-50.1	-72.3	-7.8	111	L116 D118 Q121 P122 D123 T129 H130 E162 I166	L116-R126 WeakPolarHBondContact O-CG 3.25Å; D118-R126 WeakPolarHBondContact O-CD 3.16Å; Q121-R126 HydrophobicContact CB-CG 3.93Å; Q121-R126 PolarHBondContact O-NH1 3.41Å; P122-R126 PolarHBondContact O-N 2.9Å; D123-R126 PolarHBondContact O-N 3.3Å; D123-R126 IonicContact OD1-CZ 2.71Å; D123-R126 IonicContact OD1-NH1 2.72Å; D123-R126 PolarHBondContact OD1-NH1 3.09Å; D123-R126 IonicContact OD1-NH2 3.13Å; D123-R126 PolarHBondContact OD1-NH2 3.43Å; R126-T129 PolarHBondContact O-N 2.7Å; R126-H130 WeakPolarHBondContact O-CB 3.22Å; R126-H130 PolarHBondContact O-CD2 2.92Å; R126-H130 VanDerWaalsContact O-CD2 3.22Å; R126-H130 PolarHBondContact O-N 3.44Å; R126-E162 WeakPolarHBondContact CD-OE1 3.34Å; R126-E162 IonicContact CZ-OE1 2.7Å; R126-E162 IonicContact CZ-OE2 3.38Å; R126-E162 IonicContact NE-OE1 2.79Å; R126-E162 PolarHBondContact NE-OE1 2.84Å; R126-E162 IonicContact NE-OE2 2.76Å; R126-E162 PolarHBondContact NE-OE2 3.05Å; R126-E162 IonicContact NH2-OE1 3.91Å; R126-E162 IonicContact NH2-OE2 3.17Å; R126-E162 PolarHBondContact NH2-OE2 3.32Å; R126-I166 HydrophobicContact CB-CD1 3.78Å
127	L	98.5	Very high	97.7	Very high	19 Å²	19	38.4 Å²	38.4	10%	0.099	19%	0.187	C	C	.	.	H	α-helix	trans	-56.9	-53.8	176.3	179.4	66.3	0	0	0	111.9	D123 I125 T129 H130 R131 E165 I166 I169	D123-L127 VanDerWaalsContact O-CB 3.23Å; D123-L127 WeakPolarHBondContact O-CB 3.35Å; D123-L127 PolarHBondContact O-N 3.34Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 2.89Å; L127-T129 VanDerWaalsContact C-N 3.31Å; L127-T129 PolarHBondContact O-N 3.31Å; L127-H130 PolarHBondContact O-N 2.74Å; L127-R131 WeakPolarHBondContact O-CG 3.4Å; L127-R131 PolarHBondContact O-N 2.86Å; L127-E165 HydrophobicContact CD1-CG 3.87Å; L127-I166 HydrophobicContact CB-CD1 4.15Å; L127-I166 HydrophobicContact CB-CG1 4.11Å; L127-I166 HydrophobicContact CD1-CG1 3.88Å; L127-I169 HydrophobicContact CD1-CD1 3.41Å; L127-I169 VanDerWaalsContact CD1-CD1 3.41Å
128	N	98.5	Very high	97.6	Very high	14 Å²	14	41.5 Å²	41.5	8%	0.075	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-38.9	179.2	-73.8	-11.6	0	0	0	111.7	T88 V92 V124 I125 R131 A132	T88-N128 VanDerWaalsContact OG1-CB 3.24Å; T88-N128 WeakPolarHBondContact OG1-CB 3.49Å; T88-N128 PolarHBondContact OG1-ND2 3.16Å; V92-N128 HydrophobicContact CG2-CB 4.14Å; V92-N128 WeakPolarHBondContact CG2-O 3.42Å; V124-N128 WeakPolarHBondContact O-CB 3.46Å; V124-N128 PolarHBondContact O-N 2.87Å; V124-N128 VanDerWaalsContact O-N 3.08Å; I125-N128 PolarHBondContact O-N 2.72Å; N128-R131 PolarHBondContact O-N 2.96Å; N128-A132 WeakPolarHBondContact O-CB 3.32Å; N128-A132 PolarHBondContact O-N 3.18Å
129	T	98.7	Very high	97.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-47.1	177.5	-54.5	0	0	0	0	110.9	F113 L116 L117 I125 R126 L127 R131 A132 I133	F113-T129 HydrophobicContact CB-CG2 3.64Å; F113-T129 HydrophobicContact CD1-CG2 3.85Å; F113-T129 HydrophobicContact CD2-CG2 4.27Å; F113-T129 HydrophobicContact CG-CG2 3.69Å; L116-T129 HydrophobicContact CB-CG2 4.11Å; L117-T129 HydrophobicContact CD2-CG2 3.51Å; L117-T129 HydrophobicContact CG-CG2 4.3Å; I125-T129 VanDerWaalsContact O-CB 3.31Å; I125-T129 WeakPolarHBondContact O-CB 3.43Å; I125-T129 PolarHBondContact O-N 3.43Å; I125-T129 PolarHBondContact O-OG1 3.41Å; R126-T129 PolarHBondContact O-N 2.7Å; L127-T129 VanDerWaalsContact C-N 3.31Å; L127-T129 PolarHBondContact O-N 3.31Å; T129-R131 PolarHBondContact O-N 3.08Å; T129-A132 PolarHBondContact O-N 3.25Å; T129-I133 HydrophobicContact CG2-CD1 4.07Å; T129-I133 WeakPolarHBondContact O-CG1 3.15Å; T129-I133 PolarHBondContact O-N 3.28Å
130	H	98.7	Very high	97.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-38.6	176.4	-79.7	-61.6	0	0	0	112.7	R126 L127 I133 E134 I166 I169 V170	R126-H130 WeakPolarHBondContact O-CB 3.22Å; R126-H130 PolarHBondContact O-CD2 2.92Å; R126-H130 VanDerWaalsContact O-CD2 3.22Å; R126-H130 PolarHBondContact O-N 3.44Å; L127-H130 PolarHBondContact O-N 2.74Å; H130-I133 PolarHBondContact O-N 3.33Å; H130-E134 WeakPolarHBondContact O-CB 3.34Å; H130-E134 PolarHBondContact O-N 3.04Å; H130-I166 HydrophobicContact CB-CG2 4.34Å; H130-I166 WeakPolarHBondContact CD2-CG2 3.28Å; H130-I169 HydrophobicContact CB-CG2 3.84Å; H130-I169 WeakPolarHBondContact O-CG2 3.31Å; H130-V170 WeakPolarHBondContact ND1-CG2 3.32Å
131	R	98.6	Very high	97.4	Very high	86 Å²	86	33.1 Å²	33.1	33%	0.325	18%	0.176	S	C	.	.	H	α-helix	trans	-61.2	-43.6	173.1	-75.2	-179.9	175.4	155	4.4	111.9	V92 L127 N128 T129 E134 L135 E165 I169	V92-R131 HydrophobicContact CG1-CB 4.36Å; V92-R131 HydrophobicContact CG2-CB 3.85Å; L127-R131 WeakPolarHBondContact O-CG 3.4Å; L127-R131 PolarHBondContact O-N 2.86Å; N128-R131 PolarHBondContact O-N 2.96Å; T129-R131 PolarHBondContact O-N 3.08Å; R131-E134 PolarHBondContact O-N 2.84Å; R131-L135 VanDerWaalsContact O-CG 3.32Å; R131-L135 WeakPolarHBondContact O-CG 3.41Å; R131-L135 PolarHBondContact O-N 2.97Å; R131-E165 IonicContact CZ-OE1 3.29Å; R131-E165 IonicContact NH2-OE1 3.3Å; R131-E165 PolarHBondContact NH2-OE1 2.93Å; R131-I169 HydrophobicContact CG-CD1 3.61Å; R131-I169 HydrophobicContact CG-CG1 4.36Å; R131-I169 HydrophobicContact CG-CG2 4.47Å
132	A	98.6	Very high	97.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-44.8	176.3	0	0	0	0	0	110.8	F91 V92 F113 N128 T129 L135 L136	F91-A132 HydrophobicContact CB-CB 4.26Å; V92-A132 HydrophobicContact CG2-CB 4.17Å; F113-A132 HydrophobicContact CE2-CB 3.77Å; F113-A132 HydrophobicContact CZ-CB 3.67Å; N128-A132 WeakPolarHBondContact O-CB 3.32Å; N128-A132 PolarHBondContact O-N 3.18Å; T129-A132 PolarHBondContact O-N 3.25Å; A132-L135 PolarHBondContact O-N 3.35Å; A132-L136 WeakPolarHBondContact O-CG 3.27Å; A132-L136 PolarHBondContact O-N 3.24Å
133	I	98.6	Very high	97.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.2	-46.4	175.7	-69.7	165.9	0	0	0	111.8	L110 F113 L117 T129 H130 L135 L136 T137 I146 Y151 T173	L110-I133 HydrophobicContact CD2-CG1 4.47Å; F113-I133 HydrophobicContact CB-CD1 4.38Å; F113-I133 HydrophobicContact CD2-CD1 4.26Å; F113-I133 HydrophobicContact CD2-CG1 3.72Å; F113-I133 HydrophobicContact CE2-CG1 4.26Å; L117-I133 HydrophobicContact CD1-CD1 3.95Å; L117-I133 HydrophobicContact CD2-CD1 4.16Å; T129-I133 HydrophobicContact CG2-CD1 4.07Å; T129-I133 WeakPolarHBondContact O-CG1 3.15Å; T129-I133 PolarHBondContact O-N 3.28Å; H130-I133 PolarHBondContact O-N 3.33Å; I133-L135 VanDerWaalsContact C-N 3.31Å; I133-L135 PolarHBondContact O-N 3.15Å; I133-L136 WeakPolarHBondContact O-CB 3.4Å; I133-L136 PolarHBondContact O-N 3.37Å; I133-L136 VanDerWaalsContact O-N 3.14Å; I133-T137 PolarHBondContact O-N 3.46Å; I133-I146 HydrophobicContact CG2-CD1 3.74Å; I133-Y151 HydrophobicContact CD1-CD1 4.45Å; I133-Y151 HydrophobicContact CD1-CE1 3.95Å; I133-T173 HydrophobicContact CG2-CG2 3.76Å
134	E	98.6	Very high	97.4	Very high	39 Å²	39	30 Å²	30	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-56.6	-47	176.3	-177	-171.5	-161.6	0	0	110.6	H130 R131 L136 T137 I169 N172 T173	H130-E134 WeakPolarHBondContact O-CB 3.34Å; H130-E134 PolarHBondContact O-N 3.04Å; R131-E134 PolarHBondContact O-N 2.84Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.31Å; E134-T137 PolarHBondContact O-N 3.04Å; E134-T137 PolarHBondContact O-OG1 3.29Å; E134-I169 HydrophobicContact CB-CG2 3.9Å; E134-I169 HydrophobicContact CG-CG2 4.49Å; E134-N172 HydrophobicContact CG-CB 4.28Å; E134-N172 WeakPolarHBondContact OE1-CB 3.24Å; E134-N172 PolarHBondContact OE1-ND2 3.03Å; E134-T173 WeakPolarHBondContact CA-OG1 3.35Å; E134-T173 WeakPolarHBondContact CB-OG1 3.34Å
135	L	98.5	Very high	97.4	Very high	36 Å²	36	28.1 Å²	28.1	19%	0.188	15%	0.147	C	C	.	.	H	α-helix	trans	-59.6	-41.2	177.7	-73.2	168.1	0	0	0	111.8	V92 Q96 R101 R131 A132 I133 T137 T138	V92-L135 HydrophobicContact CG1-CD1 4.05Å; V92-L135 VanDerWaalsContact O-CD1 3.28Å; V92-L135 WeakPolarHBondContact O-CD1 3.2Å; Q96-L135 HydrophobicContact CG-CD1 4Å; Q96-L135 HydrophobicContact CG-CD2 4.39Å; R101-L135 WeakPolarHBondContact CD-O 3.3Å; R131-L135 VanDerWaalsContact O-CG 3.32Å; R131-L135 WeakPolarHBondContact O-CG 3.41Å; R131-L135 PolarHBondContact O-N 2.97Å; A132-L135 PolarHBondContact O-N 3.35Å; I133-L135 VanDerWaalsContact C-N 3.31Å; I133-L135 PolarHBondContact O-N 3.15Å; L135-T137 PolarHBondContact O-N 3.29Å; L135-T138 WeakPolarHBondContact O-CB 3.42Å; L135-T138 WeakPolarHBondContact O-CG2 3.47Å; L135-T138 PolarHBondContact O-N 3.21Å; L135-T138 PolarHBondContact O-OG1 3.39Å
136	L	98.2	Very high	97.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.3	-40.1	174.8	-64.6	177.3	0	0	0	111.5	R101 A104 L105 I109 L110 F113 A132 I133 E134 T138 N139 G142	R101-L136 HydrophobicContact CB-CD2 3.98Å; R101-L136 HydrophobicContact CG-CD2 4.13Å; A104-L136 HydrophobicContact CB-CD2 4.31Å; L105-L136 HydrophobicContact CD2-CD1 4.08Å; L105-L136 HydrophobicContact CD2-CD2 4.33Å; L105-L136 HydrophobicContact CG-CD2 4.15Å; I109-L136 HydrophobicContact CG2-CD1 3.8Å; L110-L136 HydrophobicContact CD2-CD1 3.94Å; F113-L136 HydrophobicContact CE2-CD1 4.32Å; A132-L136 WeakPolarHBondContact O-CG 3.27Å; A132-L136 PolarHBondContact O-N 3.24Å; I133-L136 WeakPolarHBondContact O-CB 3.4Å; I133-L136 PolarHBondContact O-N 3.37Å; I133-L136 VanDerWaalsContact O-N 3.14Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.31Å; L136-T138 PolarHBondContact O-N 2.97Å; L136-N139 PolarHBondContact O-OD1 3.2Å; L136-G142 WeakPolarHBondContact O-CA 3.48Å
137	T	97.5	Very high	97.3	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	0.2	-178.2	63.1	0	0	0	0	115.7	I133 E134 L135 N139 V143 I146 T173 H176	I133-T137 PolarHBondContact O-N 3.46Å; E134-T137 PolarHBondContact O-N 3.04Å; E134-T137 PolarHBondContact O-OG1 3.29Å; L135-T137 PolarHBondContact O-N 3.29Å; T137-N139 PolarHBondContact O-N 3.32Å; T137-N139 VanDerWaalsContact O-N 3.14Å; T137-V143 HydrophobicContact CG2-CG2 4.37Å; T137-I146 HydrophobicContact CG2-CG1 3.83Å; T137-T173 HydrophobicContact CG2-CG2 3.8Å; T137-H176 PolarHBondContact OG1-ND1 3.1Å
138	T	95.1	Very high	97.2	Very high	72 Å²	72	37.3 Å²	37.3	44%	0.442	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-7	175.8	59.4	0	0	0	0	113.9	R101 L135 L136	R101-T138 PolarHBondContact NE-OG1 3.22Å; L135-T138 WeakPolarHBondContact O-CB 3.42Å; L135-T138 WeakPolarHBondContact O-CG2 3.47Å; L135-T138 PolarHBondContact O-N 3.21Å; L135-T138 PolarHBondContact O-OG1 3.39Å; L136-T138 PolarHBondContact O-N 2.97Å
139	N	91.5	Very high	97.1	Very high	37 Å²	37	38.5 Å²	38.5	20%	0.198	20%	0.199	C	C	.	.	S	Bend	trans	-133.1	163.2	172.5	67.7	26.7	0	0	0	111.6	L136 T137 T141 G142 V143	L136-N139 PolarHBondContact O-OD1 3.2Å; T137-N139 PolarHBondContact O-N 3.32Å; T137-N139 VanDerWaalsContact O-N 3.14Å; N139-T141 VanDerWaalsContact C-N 3.34Å; N139-T141 PolarHBondContact O-N 3.42Å; N139-T141 PolarHBondContact OD1-N 3.36Å; N139-G142 PolarHBondContact O-N 3.2Å; N139-G142 PolarHBondContact OD1-N 3.08Å; N139-V143 PolarHBondContact O-N 3.14Å
140	L	95	Very high	96.9	Very high	83 Å²	83	46.7 Å²	46.7	44%	0.435	24%	0.235	S	C	.	.	H	α-helix	trans	-59.8	-41.9	-178	177.3	59.8	0	0	0	112.3	G142 V143 E144 F180	L140-G142 VanDerWaalsContact C-N 3.3Å; L140-G142 PolarHBondContact O-N 3.24Å; L140-V143 WeakPolarHBondContact O-CB 3.45Å; L140-V143 PolarHBondContact O-N 3.36Å; L140-V143 VanDerWaalsContact O-N 3.09Å; L140-E144 HydrophobicContact CD1-CG 4.06Å; L140-E144 HydrophobicContact CG-CG 4.25Å; L140-E144 WeakPolarHBondContact O-CG 3.48Å; L140-E144 PolarHBondContact O-N 3.4Å; L140-F180 HydrophobicContact CB-CE1 4.21Å; L140-F180 HydrophobicContact CB-CZ 4.38Å; L140-F180 HydrophobicContact CD1-CB 4.19Å; L140-F180 HydrophobicContact CD1-CD1 3.56Å; L140-F180 HydrophobicContact CD1-CD2 4.45Å; L140-F180 HydrophobicContact CD1-CE1 3.97Å; L140-F180 HydrophobicContact CD1-CG 3.81Å
141	T	96.2	Very high	96.8	Very high	62 Å²	62	46.8 Å²	46.8	38%	0.38	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-38.3	-179.1	-52.6	0	0	0	0	112.9	M102 L105 N139 A145	M102-T141 HydrophobicContact CE-CG2 4.13Å; M102-T141 HydrophobicContact SD-CG2 4.19Å; L105-T141 HydrophobicContact CD1-CG2 4.15Å; N139-T141 VanDerWaalsContact C-N 3.34Å; N139-T141 PolarHBondContact O-N 3.42Å; N139-T141 PolarHBondContact OD1-N 3.36Å; T141-A145 WeakPolarHBondContact O-CB 3.2Å; T141-A145 PolarHBondContact O-N 3.4Å
142	G	97.4	Very high	96.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.3	-37.6	175	0	0	0	0	0	112.7	L136 N139 L140 A145 I146	L136-G142 WeakPolarHBondContact O-CA 3.48Å; N139-G142 PolarHBondContact O-N 3.2Å; N139-G142 PolarHBondContact OD1-N 3.08Å; L140-G142 VanDerWaalsContact C-N 3.3Å; L140-G142 PolarHBondContact O-N 3.24Å; G142-A145 PolarHBondContact O-N 2.82Å; G142-I146 VanDerWaalsContact O-CG1 3.3Å; G142-I146 WeakPolarHBondContact O-CG1 3.49Å; G142-I146 PolarHBondContact O-N 3.08Å
143	V	97.1	Very high	96.5	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-48.1	173.4	171	0	0	0	0	111.2	T137 N139 L140 A145 I146 I147 C177 F180	T137-V143 HydrophobicContact CG2-CG2 4.37Å; N139-V143 PolarHBondContact O-N 3.14Å; L140-V143 WeakPolarHBondContact O-CB 3.45Å; L140-V143 PolarHBondContact O-N 3.36Å; L140-V143 VanDerWaalsContact O-N 3.09Å; V143-A145 VanDerWaalsContact C-N 3.26Å; V143-A145 PolarHBondContact O-N 3.08Å; V143-I146 PolarHBondContact O-N 3.32Å; V143-I147 HydrophobicContact CG1-CD1 3.8Å; V143-I147 HydrophobicContact CG1-CG1 4.48Å; V143-I147 WeakPolarHBondContact O-CG1 2.99Å; V143-I147 PolarHBondContact O-N 2.91Å; V143-C177 HydrophobicContact CG1-CB 4.29Å; V143-F180 HydrophobicContact CB-CD2 4.03Å; V143-F180 HydrophobicContact CB-CE2 4.47Å; V143-F180 HydrophobicContact CG1-CB 4.16Å; V143-F180 HydrophobicContact CG1-CD2 3.89Å; V143-F180 HydrophobicContact CG1-CG 4.37Å; V143-F180 HydrophobicContact CG2-CD2 3.73Å; V143-F180 HydrophobicContact CG2-CE2 3.87Å
144	E	96.8	Very high	96.4	Very high	106 Å²	106	49.3 Å²	49.3	50%	0.495	26%	0.255	S	S	.	.	H	α-helix	trans	-57.6	-39.7	175.7	-70.6	173.1	157.9	0	0	111.7	L140 K148	L140-E144 HydrophobicContact CD1-CG 4.06Å; L140-E144 HydrophobicContact CG-CG 4.25Å; L140-E144 WeakPolarHBondContact O-CG 3.48Å; L140-E144 PolarHBondContact O-N 3.4Å; E144-K148 WeakPolarHBondContact O-CB 3.45Å; E144-K148 PolarHBondContact O-N 2.94Å
145	A	97.5	Very high	96.3	Very high	26 Å²	26	47.5 Å²	47.5	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-42.8	177.2	0	0	0	0	0	112.6	L105 L110 T141 G142 V143 K148 A149	L105-A145 HydrophobicContact CD2-CB 3.67Å; L110-A145 HydrophobicContact CD1-CB 4.03Å; T141-A145 WeakPolarHBondContact O-CB 3.2Å; T141-A145 PolarHBondContact O-N 3.4Å; G142-A145 PolarHBondContact O-N 2.82Å; V143-A145 VanDerWaalsContact C-N 3.26Å; V143-A145 PolarHBondContact O-N 3.08Å; A145-K148 PolarHBondContact O-N 3.18Å; A145-A149 VanDerWaalsContact O-CB 3.23Å; A145-A149 WeakPolarHBondContact O-CB 3.27Å; A145-A149 PolarHBondContact O-N 3.36Å
146	I	97.8	Very high	96.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-45.2	177	-72.2	-70.2	0	0	0	111.2	L110 I133 T137 G142 V143 A149 K150 Y151 I152 L155	L110-I146 HydrophobicContact CD1-CD1 3.87Å; L110-I146 HydrophobicContact CD1-CG1 4.34Å; L110-I146 HydrophobicContact CD2-CD1 3.56Å; L110-I146 HydrophobicContact CG-CD1 4.39Å; I133-I146 HydrophobicContact CG2-CD1 3.74Å; T137-I146 HydrophobicContact CG2-CG1 3.83Å; G142-I146 VanDerWaalsContact O-CG1 3.3Å; G142-I146 WeakPolarHBondContact O-CG1 3.49Å; G142-I146 PolarHBondContact O-N 3.08Å; V143-I146 PolarHBondContact O-N 3.32Å; I146-A149 PolarHBondContact O-N 2.89Å; I146-K150 PolarHBondContact O-N 2.91Å; I146-Y151 HydrophobicContact CD1-CD1 3.96Å; I146-Y151 HydrophobicContact CD1-CG 4.1Å; I146-Y151 PolarHBondContact O-N 3.22Å; I146-Y151 VanDerWaalsContact O-N 3.08Å; I146-I152 HydrophobicContact CG2-CD1 4.05Å; I146-L155 HydrophobicContact CG2-CD1 4.22Å
147	I	95.8	Very high	95.9	Very high	34 Å²	34	53.9 Å²	53.9	17%	0.174	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-48.3	177.7	-65.8	169.8	0	0	0	110.2	V143 A149 K150 I152 E181 E184	V143-I147 HydrophobicContact CG1-CD1 3.8Å; V143-I147 HydrophobicContact CG1-CG1 4.48Å; V143-I147 WeakPolarHBondContact O-CG1 2.99Å; V143-I147 PolarHBondContact O-N 2.91Å; I147-A149 PolarHBondContact O-N 3.25Å; I147-K150 WeakPolarHBondContact O-CA 3.49Å; I147-K150 PolarHBondContact O-N 3.4Å; I147-I152 HydrophobicContact CG1-CD1 4.39Å; I147-I152 HydrophobicContact CG1-CG1 4.4Å; I147-E181 HydrophobicContact CD1-CB 3.76Å; I147-E181 HydrophobicContact CD1-CG 3.74Å; I147-E184 HydrophobicContact CD1-CG 4.16Å; I147-E184 HydrophobicContact CG1-CG 4.24Å; I147-E184 HydrophobicContact CG2-CG 4.04Å
148	K	96	Very high	95.9	Very high	186 Å²	186	54.1 Å²	54.1	81%	0.809	27%	0.271	S	S	*	.	H	α-helix	trans	-59.6	-36.2	178	-176.2	179.7	178.1	-175.6	0	112.5	E144 A145 K150	E144-K148 WeakPolarHBondContact O-CB 3.45Å; E144-K148 PolarHBondContact O-N 2.94Å; A145-K148 PolarHBondContact O-N 3.18Å; K148-K150 PolarHBondContact O-N 3.07Å
149	A	96.2	Very high	95.9	Very high	40 Å²	40	50.7 Å²	50.7	33%	0.331	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	0.5	176.2	0	0	0	0	0	113.6	L110 A145 I146 I147 Y151	L110-A149 HydrophobicContact CB-CB 4.47Å; L110-A149 HydrophobicContact CD1-CB 3.86Å; A145-A149 VanDerWaalsContact O-CB 3.23Å; A145-A149 WeakPolarHBondContact O-CB 3.27Å; A145-A149 PolarHBondContact O-N 3.36Å; I146-A149 PolarHBondContact O-N 2.89Å; I147-A149 PolarHBondContact O-N 3.25Å; A149-Y151 VanDerWaalsContact C-N 3.27Å; A149-Y151 HydrophobicContact CB-CD2 3.54Å; A149-Y151 HydrophobicContact CB-CE2 3.83Å; A149-Y151 PolarHBondContact O-N 3.35Å
150	K	95.3	Very high	95.9	Very high	171 Å²	171	54 Å²	54	74%	0.743	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	34.8	-179.4	-56.1	-174.5	176.7	-174.8	0	114.1	I146 I147 K148 I152	I146-K150 PolarHBondContact O-N 2.91Å; I147-K150 WeakPolarHBondContact O-CA 3.49Å; I147-K150 PolarHBondContact O-N 3.4Å; K148-K150 PolarHBondContact O-N 3.07Å; K150-I152 VanDerWaalsContact C-N 3.28Å; K150-I152 PolarHBondContact O-N 3.21Å
151	Y	97.3	Very high	95.9	Very high	3 Å²	3	55 Å²	55	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-73	-19.1	-179.5	-95.2	-121.4	0	0	0	113.4	L110 E114 L117 I133 I146 A149 D153 L154 L155	L110-Y151 VanDerWaalsContact C-OH 3.28Å; L110-Y151 HydrophobicContact CB-CE2 3.99Å; L110-Y151 HydrophobicContact CD2-CE1 4.37Å; L110-Y151 PolarHBondContact O-OH 3.38Å; E114-Y151 WeakPolarHBondContact CA-OH 3.14Å; E114-Y151 WeakPolarHBondContact CB-OH 3.42Å; E114-Y151 PolarHBondContact N-OH 2.91Å; E114-Y151 VanDerWaalsContact N-OH 3.13Å; L117-Y151 HydrophobicContact CD1-CD1 4.49Å; L117-Y151 HydrophobicContact CD1-CE1 3.87Å; I133-Y151 HydrophobicContact CD1-CD1 4.45Å; I133-Y151 HydrophobicContact CD1-CE1 3.95Å; I146-Y151 HydrophobicContact CD1-CD1 3.96Å; I146-Y151 HydrophobicContact CD1-CG 4.1Å; I146-Y151 PolarHBondContact O-N 3.22Å; I146-Y151 VanDerWaalsContact O-N 3.08Å; A149-Y151 VanDerWaalsContact C-N 3.27Å; A149-Y151 HydrophobicContact CB-CD2 3.54Å; A149-Y151 HydrophobicContact CB-CE2 3.83Å; A149-Y151 PolarHBondContact O-N 3.35Å; Y151-D153 PolarHBondContact O-N 3.06Å; Y151-L154 WeakPolarHBondContact O-CB 3.45Å; Y151-L154 PolarHBondContact O-N 3.29Å; Y151-L154 VanDerWaalsContact O-N 3.08Å; Y151-L155 WeakPolarHBondContact O-CB 3.38Å; Y151-L155 VanDerWaalsContact O-CG 3.27Å; Y151-L155 WeakPolarHBondContact O-CG 3.31Å; Y151-L155 PolarHBondContact O-N 2.92Å
152	I	96.7	Very high	95.9	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-49.3	-173.1	-57.1	-61.3	0	0	0	111.6	I146 I147 K150 L154 L155 V156 C177 F178 E184 A188	I146-I152 HydrophobicContact CG2-CD1 4.05Å; I147-I152 HydrophobicContact CG1-CD1 4.39Å; I147-I152 HydrophobicContact CG1-CG1 4.4Å; K150-I152 VanDerWaalsContact C-N 3.28Å; K150-I152 PolarHBondContact O-N 3.21Å; I152-L154 VanDerWaalsContact C-N 3.26Å; I152-L154 PolarHBondContact O-N 3.49Å; I152-L155 PolarHBondContact O-N 3.13Å; I152-V156 WeakPolarHBondContact O-CG2 3.23Å; I152-V156 PolarHBondContact O-N 3Å; I152-C177 HydrophobicContact CD1-CB 3.84Å; I152-F178 HydrophobicContact CD1-CE1 4.39Å; I152-F178 HydrophobicContact CG2-CE1 4.07Å; I152-F178 HydrophobicContact CG2-CZ 4.39Å; I152-E184 HydrophobicContact CG1-CB 4.24Å; I152-E184 HydrophobicContact CG2-CB 4.49Å; I152-A188 HydrophobicContact CG2-CB 3.78Å
153	D	93.5	Very high	95.9	Very high	96 Å²	96	55.5 Å²	55.5	51%	0.513	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-34.6	177.5	-67.8	-34.7	0	0	0	112.6	Y151 R157	Y151-D153 PolarHBondContact O-N 3.06Å; D153-R157 WeakPolarHBondContact O-CB 3.26Å; D153-R157 PolarHBondContact O-N 3.4Å
154	L	95.6	Very high	95.9	Very high	39 Å²	39	57.9 Å²	57.9	20%	0.204	29%	0.285	C	S	.	.	H	α-helix	trans	-70	-46.1	177.4	-177.3	140.8	0	0	0	110.8	E114 L117 Y151 I152 R157 C158	E114-L154 HydrophobicContact CG-CD1 4.2Å; L117-L154 HydrophobicContact CB-CD2 4.27Å; L117-L154 HydrophobicContact CD1-CD2 3.3Å; L117-L154 HydrophobicContact CG-CD2 4.39Å; Y151-L154 WeakPolarHBondContact O-CB 3.45Å; Y151-L154 PolarHBondContact O-N 3.29Å; Y151-L154 VanDerWaalsContact O-N 3.08Å; I152-L154 VanDerWaalsContact C-N 3.26Å; I152-L154 PolarHBondContact O-N 3.49Å; L154-R157 WeakPolarHBondContact O-CB 3.37Å; L154-R157 PolarHBondContact O-N 2.89Å; L154-C158 PolarHBondContact O-N 3.46Å; L154-C158 PolarHBondContact O-SG 3.44Å
155	L	97.7	Very high	95.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-42.8	178.2	-67.4	172.4	0	0	0	111.5	I146 Y151 I152 R157 C158 V159 V170 T173 L174	I146-L155 HydrophobicContact CG2-CD1 4.22Å; Y151-L155 WeakPolarHBondContact O-CB 3.38Å; Y151-L155 VanDerWaalsContact O-CG 3.27Å; Y151-L155 WeakPolarHBondContact O-CG 3.31Å; Y151-L155 PolarHBondContact O-N 2.92Å; I152-L155 PolarHBondContact O-N 3.13Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 3.13Å; L155-C158 WeakPolarHBondContact O-CB 3.46Å; L155-C158 PolarHBondContact O-N 2.97Å; L155-V159 WeakPolarHBondContact O-CG2 3.36Å; L155-V159 PolarHBondContact O-N 2.94Å; L155-V159 VanDerWaalsContact O-N 3.12Å; L155-V170 HydrophobicContact CB-CG1 3.93Å; L155-V170 HydrophobicContact CD2-CG1 4.05Å; L155-V170 VanDerWaalsContact O-CG1 3.29Å; L155-V170 WeakPolarHBondContact O-CG1 3.07Å; L155-T173 HydrophobicContact CD1-CG2 3.8Å; L155-L174 HydrophobicContact CB-CD2 3.7Å; L155-L174 HydrophobicContact CB-CG 4.2Å; L155-L174 HydrophobicContact CD1-CD2 4.15Å
156	V	95.5	Very high	96	Very high	16 Å²	16	56.7 Å²	56.7	10%	0.097	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-43.1	174	165.5	0	0	0	0	111.1	I152 V159 L174 A188 L193	I152-V156 WeakPolarHBondContact O-CG2 3.23Å; I152-V156 PolarHBondContact O-N 3Å; V156-V159 PolarHBondContact O-N 3.18Å; V156-L174 HydrophobicContact CG2-CD1 4.29Å; V156-L174 HydrophobicContact CG2-CD2 4.27Å; V156-A188 HydrophobicContact CG2-CB 3.85Å; V156-L193 HydrophobicContact CB-CD2 4.34Å; V156-L193 HydrophobicContact CG1-CD2 3.71Å
157	R	93.3	Very high	96	Very high	155 Å²	155	57.5 Å²	57.5	59%	0.585	28%	0.279	S	S	*	.	H	α-helix	trans	-68.4	-34	177.1	-155	-171.6	-48.7	166.8	7.3	113.3	D153 L154 L155 V159 E160 N161	D153-R157 WeakPolarHBondContact O-CB 3.26Å; D153-R157 PolarHBondContact O-N 3.4Å; L154-R157 WeakPolarHBondContact O-CB 3.37Å; L154-R157 PolarHBondContact O-N 2.89Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 3.13Å; R157-V159 VanDerWaalsContact C-N 3.33Å; R157-E160 PolarHBondContact O-N 2.92Å; R157-N161 PolarHBondContact O-ND2 3.47Å; R157-N161 VanDerWaalsContact O-ND2 3.16Å
158	C	96.1	Very high	96.1	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.034	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-42.6	173.7	-70.9	0	0	0	0	111.1	L154 L155 E160 N161 E162 V170	L154-C158 PolarHBondContact O-N 3.46Å; L154-C158 PolarHBondContact O-SG 3.44Å; L155-C158 WeakPolarHBondContact O-CB 3.46Å; L155-C158 PolarHBondContact O-N 2.97Å; C158-E160 PolarHBondContact O-N 3.48Å; C158-N161 PolarHBondContact O-N 3.11Å; C158-N161 VanDerWaalsContact O-N 3.16Å; C158-E162 HydrophobicContact CB-CG 4.15Å; C158-E162 VanDerWaalsContact O-CB 3.22Å; C158-E162 WeakPolarHBondContact O-CB 3.41Å; C158-E162 WeakPolarHBondContact O-CG 3.48Å; C158-E162 PolarHBondContact O-N 2.89Å; C158-V170 HydrophobicContact CB-CG1 4.37Å; C158-V170 HydrophobicContact CB-CG2 4.34Å
159	V	96.6	Very high	96.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-34.2	-179	173.9	0	0	0	0	112.7	L155 V156 R157 K167 V170 L171 L174 L193 L197	L155-V159 WeakPolarHBondContact O-CG2 3.36Å; L155-V159 PolarHBondContact O-N 2.94Å; L155-V159 VanDerWaalsContact O-N 3.12Å; V156-V159 PolarHBondContact O-N 3.18Å; R157-V159 VanDerWaalsContact C-N 3.33Å; V159-K167 HydrophobicContact CB-CG 4.44Å; V159-K167 HydrophobicContact CG1-CD 4.26Å; V159-K167 HydrophobicContact CG1-CG 3.88Å; V159-K167 WeakPolarHBondContact O-CD 3.14Å; V159-K167 WeakPolarHBondContact O-CE 3.19Å; V159-K167 WeakPolarHBondContact O-CG 3.21Å; V159-V170 HydrophobicContact CG2-CB 3.97Å; V159-V170 HydrophobicContact CG2-CG1 3.42Å; V159-V170 VanDerWaalsContact CG2-CG1 3.42Å; V159-L171 HydrophobicContact CG1-CD2 3.93Å; V159-L171 HydrophobicContact CG1-CG 4.29Å; V159-L171 HydrophobicContact CG2-CD2 4.06Å; V159-L171 HydrophobicContact CG2-CG 4.21Å; V159-L174 HydrophobicContact CG2-CD1 3.87Å; V159-L193 HydrophobicContact CB-CD2 4.03Å; V159-L193 HydrophobicContact CG1-CD1 4.29Å; V159-L193 HydrophobicContact CG1-CD2 4.01Å; V159-L193 HydrophobicContact CG1-CG 4.39Å; V159-L197 HydrophobicContact CG1-CD1 3.35Å; V159-L197 HydrophobicContact CG1-CG 4.5Å
160	E	91.5	Very high	96.4	Very high	108 Å²	108	47.2 Å²	47.2	51%	0.505	23%	0.227	S	C	.	.	H	α-helix	trans	-69.5	-33.4	-179.1	-67	-174.8	143.1	0	0	113.4	R157 C158 L193	R157-E160 PolarHBondContact O-N 2.92Å; C158-E160 PolarHBondContact O-N 3.48Å; E160-L193 HydrophobicContact CG-CD1 3.64Å
161	N	93.2	Very high	96.5	Very high	104 Å²	104	39.1 Å²	39.1	56%	0.556	19%	0.192	S	C	*	.	H	α-helix	trans	-118.6	-13.9	-165.4	-59.9	-73.5	0	0	0	114	F119 R157 C158	F119-N161 HydrophobicContact CE1-CB 3.79Å; F119-N161 HydrophobicContact CE2-CB 4.14Å; F119-N161 HydrophobicContact CZ-CB 3.5Å; F119-N161 VanDerWaalsContact CZ-CB 3.5Å; R157-N161 PolarHBondContact O-ND2 3.47Å; R157-N161 VanDerWaalsContact O-ND2 3.16Å; C158-N161 PolarHBondContact O-N 3.11Å; C158-N161 VanDerWaalsContact O-N 3.16Å
162	E	96.9	Very high	96.6	Very high	7 Å²	7	40 Å²	40	3%	0.033	20%	0.197	C	C	.	.	S	Bend	trans	-74.5	156.3	-179	-83.3	-66.3	-177.9	0	0	113.8	F119 R126 C158 I166 K167	F119-E162 HydrophobicContact CE1-CG 3.72Å; F119-E162 HydrophobicContact CZ-CG 4.33Å; R126-E162 WeakPolarHBondContact CD-OE1 3.34Å; R126-E162 IonicContact CZ-OE1 2.7Å; R126-E162 IonicContact CZ-OE2 3.38Å; R126-E162 IonicContact NE-OE1 2.79Å; R126-E162 PolarHBondContact NE-OE1 2.84Å; R126-E162 IonicContact NE-OE2 2.76Å; R126-E162 PolarHBondContact NE-OE2 3.05Å; R126-E162 IonicContact NH2-OE1 3.91Å; R126-E162 IonicContact NH2-OE2 3.17Å; R126-E162 PolarHBondContact NH2-OE2 3.32Å; C158-E162 HydrophobicContact CB-CG 4.15Å; C158-E162 VanDerWaalsContact O-CB 3.22Å; C158-E162 WeakPolarHBondContact O-CB 3.41Å; C158-E162 WeakPolarHBondContact O-CG 3.48Å; C158-E162 PolarHBondContact O-N 2.89Å; E162-I166 HydrophobicContact CB-CB 4.1Å; E162-I166 HydrophobicContact CB-CG2 3.96Å; E162-I166 HydrophobicContact CG-CB 4.22Å; E162-I166 HydrophobicContact CG-CG2 3.62Å; E162-I166 WeakPolarHBondContact OE2-CD1 3.42Å; E162-K167 VanDerWaalsContact O-CE 3.24Å; E162-K167 WeakPolarHBondContact O-CE 3.4Å; E162-K167 PolarHBondContact O-NZ 3.49Å
163	V	96.9	Very high	96.7	Very high	65 Å²	65	39.8 Å²	39.8	39%	0.394	20%	0.196	S	C	.	.			trans	-63.9	152	168.9	-61.5	0	0	0	0	110.6	E165 I166 K167	V163-E165 VanDerWaalsContact C-N 3.29Å; V163-E165 PolarHBondContact O-N 3.01Å; V163-E165 VanDerWaalsContact O-N 3.16Å; V163-I166 HydrophobicContact CG2-CB 4.15Å; V163-I166 HydrophobicContact CG2-CD1 3.91Å; V163-I166 HydrophobicContact CG2-CG1 3.84Å; V163-I166 PolarHBondContact O-N 2.63Å; V163-K167 PolarHBondContact O-N 2.85Å
164	D	98	Very high	96.9	Very high	51 Å²	51	35.2 Å²	35.2	27%	0.273	17%	0.171	S	C	.	.	H	α-helix	trans	-55.5	-39.5	-170.3	-81	5.9	0	0	0	114.5	I166 K167 I168 H200 N202 I205	D164-I166 VanDerWaalsContact C-N 3.33Å; D164-I166 PolarHBondContact O-N 3.17Å; D164-K167 PolarHBondContact O-N 3.31Å; D164-K167 IonicContact OD1-NZ 2.88Å; D164-K167 PolarHBondContact OD1-NZ 3.4Å; D164-I168 WeakPolarHBondContact O-CD1 3.44Å; D164-I168 VanDerWaalsContact O-CG1 3.3Å; D164-I168 WeakPolarHBondContact O-CG1 3.3Å; D164-I168 PolarHBondContact O-N 3.14Å; D164-I168 VanDerWaalsContact O-N 3.11Å; D164-H200 IonicContact OD1-CE1 3.72Å; D164-H200 PolarHBondContact OD1-CE1 3.24Å; D164-H200 IonicContact OD1-NE2 3.74Å; D164-H200 PolarHBondContact OD1-NE2 3.21Å; D164-H200 IonicContact OD2-CE1 3.73Å; D164-H200 PolarHBondContact OD2-CE1 3.44Å; D164-N202 WeakPolarHBondContact OD2-CB 3.35Å; D164-N202 PolarHBondContact OD2-ND2 3.09Å; D164-N202 VanDerWaalsContact OD2-ND2 3.11Å; D164-I205 HydrophobicContact CB-CD1 3.75Å; D164-I205 WeakPolarHBondContact OD1-CD1 3.15Å
165	E	97.5	Very high	97	Very high	105 Å²	105	35.7 Å²	35.7	49%	0.491	17%	0.171	S	C	.	.	H	α-helix	trans	-60	-43.4	178.4	-170.9	179.9	176.5	0	0	111.7	L127 R131 V163 I169	L127-E165 HydrophobicContact CD1-CG 3.87Å; R131-E165 IonicContact CZ-OE1 3.29Å; R131-E165 IonicContact NH2-OE1 3.3Å; R131-E165 PolarHBondContact NH2-OE1 2.93Å; V163-E165 VanDerWaalsContact C-N 3.29Å; V163-E165 PolarHBondContact O-N 3.01Å; V163-E165 VanDerWaalsContact O-N 3.16Å; E165-I169 WeakPolarHBondContact O-CD1 3.5Å
166	I	98.4	Very high	97	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-73	-40.9	178.3	-63.6	-178.1	0	0	0	110.4	R126 L127 H130 E162 V163 D164 I168 I169 V170	R126-I166 HydrophobicContact CB-CD1 3.78Å; L127-I166 HydrophobicContact CB-CD1 4.15Å; L127-I166 HydrophobicContact CB-CG1 4.11Å; L127-I166 HydrophobicContact CD1-CG1 3.88Å; H130-I166 HydrophobicContact CB-CG2 4.34Å; H130-I166 WeakPolarHBondContact CD2-CG2 3.28Å; E162-I166 HydrophobicContact CB-CB 4.1Å; E162-I166 HydrophobicContact CB-CG2 3.96Å; E162-I166 HydrophobicContact CG-CB 4.22Å; E162-I166 HydrophobicContact CG-CG2 3.62Å; E162-I166 WeakPolarHBondContact OE2-CD1 3.42Å; V163-I166 HydrophobicContact CG2-CB 4.15Å; V163-I166 HydrophobicContact CG2-CD1 3.91Å; V163-I166 HydrophobicContact CG2-CG1 3.84Å; V163-I166 PolarHBondContact O-N 2.63Å; D164-I166 VanDerWaalsContact C-N 3.33Å; D164-I166 PolarHBondContact O-N 3.17Å; I166-I168 VanDerWaalsContact C-N 3.26Å; I166-I168 PolarHBondContact O-N 2.97Å; I166-I169 WeakPolarHBondContact O-CB 3.33Å; I166-I169 PolarHBondContact O-N 2.64Å; I166-V170 HydrophobicContact CG2-CG2 4.04Å; I166-V170 WeakPolarHBondContact O-CG2 3.22Å; I166-V170 PolarHBondContact O-N 2.85Å
167	K	98.3	Very high	97.1	Very high	16 Å²	16	37.2 Å²	37.2	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-41.5	179.6	-163.1	179.9	-60.9	144.8	0	112.1	V159 E162 V163 D164 V170 L171 L197 H200 I205	V159-K167 HydrophobicContact CB-CG 4.44Å; V159-K167 HydrophobicContact CG1-CD 4.26Å; V159-K167 HydrophobicContact CG1-CG 3.88Å; V159-K167 WeakPolarHBondContact O-CD 3.14Å; V159-K167 WeakPolarHBondContact O-CE 3.19Å; V159-K167 WeakPolarHBondContact O-CG 3.21Å; E162-K167 VanDerWaalsContact O-CE 3.24Å; E162-K167 WeakPolarHBondContact O-CE 3.4Å; E162-K167 PolarHBondContact O-NZ 3.49Å; V163-K167 PolarHBondContact O-N 2.85Å; D164-K167 PolarHBondContact O-N 3.31Å; D164-K167 IonicContact OD1-NZ 2.88Å; D164-K167 PolarHBondContact OD1-NZ 3.4Å; K167-V170 PolarHBondContact O-N 3.46Å; K167-L171 HydrophobicContact CG-CD1 4.25Å; K167-L171 WeakPolarHBondContact O-CB 3.39Å; K167-L171 VanDerWaalsContact O-CG 3.24Å; K167-L171 WeakPolarHBondContact O-CG 3.12Å; K167-L171 PolarHBondContact O-N 3.39Å; K167-L197 HydrophobicContact CD-CD2 4.32Å; K167-H200 PolarHBondContact NZ-NE2 3.2Å; K167-H200 VanDerWaalsContact NZ-NE2 3.18Å; K167-I205 HydrophobicContact CB-CD1 4.32Å; K167-I205 HydrophobicContact CD-CD1 3.72Å; K167-I205 HydrophobicContact CD-CG1 4.16Å; K167-I205 HydrophobicContact CD-CG2 4.14Å; K167-I205 HydrophobicContact CG-CD1 4.4Å
168	I	98.5	Very high	97.2	Very high	33 Å²	33	29.8 Å²	29.8	17%	0.169	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-45.4	177.3	-67.3	160.2	0	0	0	111.2	D164 I166 L171 N172 E204 I205 R208	D164-I168 WeakPolarHBondContact O-CD1 3.44Å; D164-I168 VanDerWaalsContact O-CG1 3.3Å; D164-I168 WeakPolarHBondContact O-CG1 3.3Å; D164-I168 PolarHBondContact O-N 3.14Å; D164-I168 VanDerWaalsContact O-N 3.11Å; I166-I168 VanDerWaalsContact C-N 3.26Å; I166-I168 PolarHBondContact O-N 2.97Å; I168-L171 PolarHBondContact O-N 2.63Å; I168-N172 PolarHBondContact O-N 2.7Å; I168-E204 HydrophobicContact CD1-CB 3.93Å; I168-E204 HydrophobicContact CD1-CG 3.64Å; I168-E204 HydrophobicContact CG1-CB 4.35Å; I168-E204 HydrophobicContact CG1-CG 3.86Å; I168-E204 HydrophobicContact CG2-CG 3.94Å; I168-I205 HydrophobicContact CG1-CG1 3.86Å; I168-R208 HydrophobicContact CG2-CG 4.39Å
169	I	98.6	Very high	97	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.062	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-42	178.9	-66.1	157.7	0	0	0	111	L127 H130 R131 E134 E165 I166 N172 T173	L127-I169 HydrophobicContact CD1-CD1 3.41Å; L127-I169 VanDerWaalsContact CD1-CD1 3.41Å; H130-I169 HydrophobicContact CB-CG2 3.84Å; H130-I169 WeakPolarHBondContact O-CG2 3.31Å; R131-I169 HydrophobicContact CG-CD1 3.61Å; R131-I169 HydrophobicContact CG-CG1 4.36Å; R131-I169 HydrophobicContact CG-CG2 4.47Å; E134-I169 HydrophobicContact CB-CG2 3.9Å; E134-I169 HydrophobicContact CG-CG2 4.49Å; E165-I169 WeakPolarHBondContact O-CD1 3.5Å; I166-I169 WeakPolarHBondContact O-CB 3.33Å; I166-I169 PolarHBondContact O-N 2.64Å; I169-N172 PolarHBondContact O-N 3.13Å; I169-T173 PolarHBondContact O-N 3.26Å; I169-T173 PolarHBondContact O-OG1 3.19Å
170	V	98.6	Very high	96.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-42	177.3	-178.5	0	0	0	0	110.8	H130 L155 C158 V159 I166 K167 N172 T173 L174	H130-V170 WeakPolarHBondContact ND1-CG2 3.32Å; L155-V170 HydrophobicContact CB-CG1 3.93Å; L155-V170 HydrophobicContact CD2-CG1 4.05Å; L155-V170 VanDerWaalsContact O-CG1 3.29Å; L155-V170 WeakPolarHBondContact O-CG1 3.07Å; C158-V170 HydrophobicContact CB-CG1 4.37Å; C158-V170 HydrophobicContact CB-CG2 4.34Å; V159-V170 HydrophobicContact CG2-CB 3.97Å; V159-V170 HydrophobicContact CG2-CG1 3.42Å; V159-V170 VanDerWaalsContact CG2-CG1 3.42Å; I166-V170 HydrophobicContact CG2-CG2 4.04Å; I166-V170 WeakPolarHBondContact O-CG2 3.22Å; I166-V170 PolarHBondContact O-N 2.85Å; K167-V170 PolarHBondContact O-N 3.46Å; V170-N172 VanDerWaalsContact C-N 3.34Å; V170-N172 PolarHBondContact O-N 3.16Å; V170-T173 WeakPolarHBondContact O-CB 3.32Å; V170-T173 PolarHBondContact O-N 2.93Å; V170-L174 HydrophobicContact CG1-CD1 4.26Å; V170-L174 HydrophobicContact CG1-CG 4.48Å; V170-L174 WeakPolarHBondContact O-CG 3.36Å; V170-L174 PolarHBondContact O-N 3.12Å
171	L	98.6	Very high	96.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-35.7	176.9	-71.1	167.2	0	0	0	112.8	V159 K167 I168 Y175 F194 L197 I205 R208 N212	V159-L171 HydrophobicContact CG1-CD2 3.93Å; V159-L171 HydrophobicContact CG1-CG 4.29Å; V159-L171 HydrophobicContact CG2-CD2 4.06Å; V159-L171 HydrophobicContact CG2-CG 4.21Å; K167-L171 HydrophobicContact CG-CD1 4.25Å; K167-L171 WeakPolarHBondContact O-CB 3.39Å; K167-L171 VanDerWaalsContact O-CG 3.24Å; K167-L171 WeakPolarHBondContact O-CG 3.12Å; K167-L171 PolarHBondContact O-N 3.39Å; I168-L171 PolarHBondContact O-N 2.63Å; L171-Y175 WeakPolarHBondContact O-CB 3.34Å; L171-Y175 PolarHBondContact O-N 3.36Å; L171-F194 HydrophobicContact CD2-CD1 3.83Å; L171-F194 HydrophobicContact CD2-CE1 3.52Å; L171-L197 HydrophobicContact CD1-CD1 4.42Å; L171-L197 HydrophobicContact CD2-CD1 4.09Å; L171-I205 HydrophobicContact CD1-CG2 4.23Å; L171-R208 HydrophobicContact CB-CB 3.64Å; L171-R208 HydrophobicContact CB-CG 4.38Å; L171-R208 HydrophobicContact CD1-CB 3.79Å; L171-R208 HydrophobicContact CG-CB 4.3Å; L171-N212 PolarHBondContact O-ND2 3Å
172	N	98.3	Very high	96.7	Very high	22 Å²	22	32.7 Å²	32.7	12%	0.118	16%	0.164	C	C	.	.	H	α-helix	trans	-66.4	-42.8	172.1	-73.5	-18.2	0	0	0	111.9	E134 I168 I169 V170 L174 Y175 H176 R208	E134-N172 HydrophobicContact CG-CB 4.28Å; E134-N172 WeakPolarHBondContact OE1-CB 3.24Å; E134-N172 PolarHBondContact OE1-ND2 3.03Å; I168-N172 PolarHBondContact O-N 2.7Å; I169-N172 PolarHBondContact O-N 3.13Å; V170-N172 VanDerWaalsContact C-N 3.34Å; V170-N172 PolarHBondContact O-N 3.16Å; N172-L174 VanDerWaalsContact C-N 3.34Å; N172-L174 PolarHBondContact O-N 2.89Å; N172-Y175 WeakPolarHBondContact O-CB 3.47Å; N172-Y175 PolarHBondContact O-N 3.24Å; N172-H176 PolarHBondContact O-N 3.35Å; N172-R208 WeakPolarHBondContact OD1-CD 3.38Å; N172-R208 PolarHBondContact OD1-NE 2.77Å; N172-R208 PolarHBondContact OD1-NH1 3.18Å; N172-R208 VanDerWaalsContact OD1-NH1 3.15Å
173	T	98.5	Very high	96.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-47	176.3	-56.3	0	0	0	0	110.9	I133 E134 T137 L155 I169 V170 Y175 H176 C177	I133-T173 HydrophobicContact CG2-CG2 3.76Å; E134-T173 WeakPolarHBondContact CA-OG1 3.35Å; E134-T173 WeakPolarHBondContact CB-OG1 3.34Å; T137-T173 HydrophobicContact CG2-CG2 3.8Å; L155-T173 HydrophobicContact CD1-CG2 3.8Å; I169-T173 PolarHBondContact O-N 3.26Å; I169-T173 PolarHBondContact O-OG1 3.19Å; V170-T173 WeakPolarHBondContact O-CB 3.32Å; V170-T173 PolarHBondContact O-N 2.93Å; T173-Y175 VanDerWaalsContact C-N 3.35Å; T173-Y175 PolarHBondContact O-N 3.18Å; T173-H176 PolarHBondContact O-N 3.44Å; T173-C177 PolarHBondContact O-N 3.16Å; T173-C177 PolarHBondContact O-SG 3.25Å
174	L	98.2	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-42.9	175.7	-70.7	173.3	0	0	0	111.3	L155 V156 V159 V170 N172 H176 C177 F178 F194	L155-L174 HydrophobicContact CB-CD2 3.7Å; L155-L174 HydrophobicContact CB-CG 4.2Å; L155-L174 HydrophobicContact CD1-CD2 4.15Å; V156-L174 HydrophobicContact CG2-CD1 4.29Å; V156-L174 HydrophobicContact CG2-CD2 4.27Å; V159-L174 HydrophobicContact CG2-CD1 3.87Å; V170-L174 HydrophobicContact CG1-CD1 4.26Å; V170-L174 HydrophobicContact CG1-CG 4.48Å; V170-L174 WeakPolarHBondContact O-CG 3.36Å; V170-L174 PolarHBondContact O-N 3.12Å; N172-L174 VanDerWaalsContact C-N 3.34Å; N172-L174 PolarHBondContact O-N 2.89Å; L174-H176 VanDerWaalsContact C-N 3.34Å; L174-H176 PolarHBondContact O-N 2.78Å; L174-C177 PolarHBondContact O-N 3.44Å; L174-C177 VanDerWaalsContact O-N 3.13Å; L174-F178 HydrophobicContact CB-CD2 4.37Å; L174-F178 HydrophobicContact CB-CE2 3.76Å; L174-F178 HydrophobicContact CB-CZ 4Å; L174-F178 HydrophobicContact CD2-CE1 4.33Å; L174-F178 HydrophobicContact CD2-CE2 4.35Å; L174-F178 HydrophobicContact CD2-CZ 3.73Å; L174-F178 HydrophobicContact CG-CZ 4.36Å; L174-F178 VanDerWaalsContact O-CD2 3.25Å; L174-F178 WeakPolarHBondContact O-CD2 3.38Å; L174-F178 WeakPolarHBondContact O-CG 3.24Å; L174-F178 PolarHBondContact O-N 2.92Å; L174-F194 HydrophobicContact CD1-CE1 4.21Å; L174-F194 HydrophobicContact CD1-CZ 4.09Å
175	Y	98	Very high	96.5	Very high	49 Å²	49	33.1 Å²	33.1	19%	0.192	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-41.6	176.2	170.3	-100.2	0	0	0	112.6	L171 N172 T173 S179 Q211 N212 R215	L171-Y175 WeakPolarHBondContact O-CB 3.34Å; L171-Y175 PolarHBondContact O-N 3.36Å; N172-Y175 WeakPolarHBondContact O-CB 3.47Å; N172-Y175 PolarHBondContact O-N 3.24Å; T173-Y175 VanDerWaalsContact C-N 3.35Å; T173-Y175 PolarHBondContact O-N 3.18Å; Y175-S179 WeakPolarHBondContact O-CB 3.33Å; Y175-S179 PolarHBondContact O-N 2.96Å; Y175-S179 PolarHBondContact O-OG 3.35Å; Y175-Q211 HydrophobicContact CD2-CG 3.63Å; Y175-Q211 HydrophobicContact CE2-CG 3.64Å; Y175-Q211 HydrophobicContact CG-CG 4.2Å; Y175-N212 VanDerWaalsContact CA-OD1 3.26Å; Y175-N212 WeakPolarHBondContact CA-OD1 3.47Å; Y175-N212 PolarHBondContact N-OD1 3.13Å; Y175-N212 VanDerWaalsContact N-OD1 3.13Å; Y175-R215 HydrophobicContact CD2-CB 4.19Å; Y175-R215 HydrophobicContact CE2-CB 4.22Å; Y175-R215 PolarHBondContact OH-NH2 3.25Å
176	H	97.4	Very high	96.4	Very high	47 Å²	47	28.2 Å²	28.2	22%	0.218	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-45.5	173.9	-64.2	157.4	0	0	0	111.1	T137 N172 T173 L174 S179 F180	T137-H176 PolarHBondContact OG1-ND1 3.1Å; N172-H176 PolarHBondContact O-N 3.35Å; T173-H176 PolarHBondContact O-N 3.44Å; L174-H176 VanDerWaalsContact C-N 3.34Å; L174-H176 PolarHBondContact O-N 2.78Å; H176-S179 WeakPolarHBondContact O-CB 3.37Å; H176-S179 PolarHBondContact O-N 3.44Å; H176-F180 VanDerWaalsContact O-CD2 3.25Å; H176-F180 WeakPolarHBondContact O-CD2 3.29Å
177	C	97.5	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-48	179.3	-62.1	0	0	0	0	112.1	V143 I152 T173 L174 S179 F180 E181	V143-C177 HydrophobicContact CG1-CB 4.29Å; I152-C177 HydrophobicContact CD1-CB 3.84Å; T173-C177 PolarHBondContact O-N 3.16Å; T173-C177 PolarHBondContact O-SG 3.25Å; L174-C177 PolarHBondContact O-N 3.44Å; L174-C177 VanDerWaalsContact O-N 3.13Å; C177-S179 PolarHBondContact O-N 3.44Å; C177-F180 PolarHBondContact O-N 2.88Å; C177-F180 VanDerWaalsContact O-N 3.08Å; C177-E181 PolarHBondContact O-N 3.08Å
178	F	95.8	Very high	96.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-73.4	-12.8	-178.2	-52.6	-25.4	0	0	0	113.4	I152 L174 F180 T182 G185 F194 N212 R215 L216	I152-F178 HydrophobicContact CD1-CE1 4.39Å; I152-F178 HydrophobicContact CG2-CE1 4.07Å; I152-F178 HydrophobicContact CG2-CZ 4.39Å; L174-F178 HydrophobicContact CB-CD2 4.37Å; L174-F178 HydrophobicContact CB-CE2 3.76Å; L174-F178 HydrophobicContact CB-CZ 4Å; L174-F178 HydrophobicContact CD2-CE1 4.33Å; L174-F178 HydrophobicContact CD2-CE2 4.35Å; L174-F178 HydrophobicContact CD2-CZ 3.73Å; L174-F178 HydrophobicContact CG-CZ 4.36Å; L174-F178 VanDerWaalsContact O-CD2 3.25Å; L174-F178 WeakPolarHBondContact O-CD2 3.38Å; L174-F178 WeakPolarHBondContact O-CG 3.24Å; L174-F178 PolarHBondContact O-N 2.92Å; F178-F180 PolarHBondContact O-N 2.9Å; F178-T182 VanDerWaalsContact O-CG2 3.3Å; F178-T182 WeakPolarHBondContact O-CG2 3.37Å; F178-G185 VanDerWaalsContact CE1-N 3.33Å; F178-F194 HydrophobicContact CD2-CE2 4.46Å; F178-F194 AromaticContact CE2-CE2 3.79Å; F178-F194 HydrophobicContact CE2-CE2 3.79Å; F178-F194 AromaticContact CE2-CZ 3.78Å; F178-F194 HydrophobicContact CE2-CZ 3.78Å; F178-N212 WeakPolarHBondContact CD2-OD1 3.48Å; F178-R215 HydrophobicContact CB-CG 3.77Å; F178-R215 WeakPolarHBondContact O-CD 3.47Å; F178-R215 WeakPolarHBondContact O-CG 3.45Å; F178-L216 HydrophobicContact CB-CD2 4.06Å; F178-L216 HydrophobicContact CD2-CD2 3.93Å; F178-L216 HydrophobicContact CD2-CG 4.29Å; F178-L216 HydrophobicContact CG-CD2 3.95Å
179	S	92.4	Very high	96.1	Very high	41 Å²	41	32.8 Å²	32.8	29%	0.287	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.3	169.9	-64.4	0	0	0	0	112.6	Y175 H176 C177 R215	Y175-S179 WeakPolarHBondContact O-CB 3.33Å; Y175-S179 PolarHBondContact O-N 2.96Å; Y175-S179 PolarHBondContact O-OG 3.35Å; H176-S179 WeakPolarHBondContact O-CB 3.37Å; H176-S179 PolarHBondContact O-N 3.44Å; C177-S179 PolarHBondContact O-N 3.44Å; S179-R215 PolarHBondContact OG-NE 2.96Å
180	F	90.1	Very high	96	Very high	102 Å²	102	32.2 Å²	32.2	45%	0.447	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-43.1	175.2	-59.2	-80.8	0	0	0	112.2	L140 V143 H176 C177 F178	L140-F180 HydrophobicContact CB-CE1 4.21Å; L140-F180 HydrophobicContact CB-CZ 4.38Å; L140-F180 HydrophobicContact CD1-CB 4.19Å; L140-F180 HydrophobicContact CD1-CD1 3.56Å; L140-F180 HydrophobicContact CD1-CD2 4.45Å; L140-F180 HydrophobicContact CD1-CE1 3.97Å; L140-F180 HydrophobicContact CD1-CG 3.81Å; V143-F180 HydrophobicContact CB-CD2 4.03Å; V143-F180 HydrophobicContact CB-CE2 4.47Å; V143-F180 HydrophobicContact CG1-CB 4.16Å; V143-F180 HydrophobicContact CG1-CD2 3.89Å; V143-F180 HydrophobicContact CG1-CG 4.37Å; V143-F180 HydrophobicContact CG2-CD2 3.73Å; V143-F180 HydrophobicContact CG2-CE2 3.87Å; H176-F180 VanDerWaalsContact O-CD2 3.25Å; H176-F180 WeakPolarHBondContact O-CD2 3.29Å; C177-F180 PolarHBondContact O-N 2.88Å; C177-F180 VanDerWaalsContact O-N 3.08Å; F178-F180 PolarHBondContact O-N 2.9Å
181	E	90.5	Very high	95.9	Very high	103 Å²	103	32.2 Å²	32.2	48%	0.481	17%	0.169	S	C	.	.			trans	-129.7	89.5	-176	-68.4	-64.1	173.7	0	0	111.9	I147 C177 E183 E184	I147-E181 HydrophobicContact CD1-CB 3.76Å; I147-E181 HydrophobicContact CD1-CG 3.74Å; C177-E181 PolarHBondContact O-N 3.08Å; E181-E183 VanDerWaalsContact C-N 3.31Å; E181-E183 PolarHBondContact O-N 3.4Å; E181-E184 HydrophobicContact CB-CG 4Å
182	T	94.4	Very high	95.9	Very high	31 Å²	31	34.1 Å²	34.1	19%	0.19	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-30.7	-179.5	57	0	0	0	0	113.5	F178 E184 G185 L186 L216	F178-T182 VanDerWaalsContact O-CG2 3.3Å; F178-T182 WeakPolarHBondContact O-CG2 3.37Å; T182-E184 VanDerWaalsContact C-N 3.3Å; T182-E184 PolarHBondContact O-N 3.03Å; T182-G185 PolarHBondContact O-N 3.04Å; T182-L186 WeakPolarHBondContact O-CG 3.22Å; T182-L186 PolarHBondContact O-N 3.2Å; T182-L216 WeakPolarHBondContact O-CD2 3.32Å
183	E	95.6	Very high	95.8	Very high	65 Å²	65	33.6 Å²	33.6	30%	0.304	18%	0.179	S	C	.	.	H	α-helix	trans	-64.9	-33.4	-177.6	-72.5	-60.7	145.5	0	0	112.5	E181 G185 L186 N187 N219 R221	E181-E183 VanDerWaalsContact C-N 3.31Å; E181-E183 PolarHBondContact O-N 3.4Å; E183-G185 VanDerWaalsContact C-N 3.29Å; E183-G185 PolarHBondContact O-N 2.87Å; E183-L186 PolarHBondContact O-N 2.64Å; E183-N187 WeakPolarHBondContact O-CB 3.36Å; E183-N187 PolarHBondContact O-N 2.98Å; E183-N187 PolarHBondContact O-ND2 3.34Å; E183-N219 PolarHBondContact OE1-ND2 2.87Å; E183-R221 IonicContact OE2-CZ 2.78Å; E183-R221 IonicContact OE2-NH1 3.44Å; E183-R221 PolarHBondContact OE2-NH1 3.37Å
184	E	95.6	Very high	95.8	Very high	67 Å²	67	33.6 Å²	33.6	31%	0.313	18%	0.179	S	C	.	.	H	α-helix	trans	-59	-42.6	175.1	-67.6	-61.5	135.9	0	0	111.4	I147 I152 E181 T182 A188	I147-E184 HydrophobicContact CD1-CG 4.16Å; I147-E184 HydrophobicContact CG1-CG 4.24Å; I147-E184 HydrophobicContact CG2-CG 4.04Å; I152-E184 HydrophobicContact CG1-CB 4.24Å; I152-E184 HydrophobicContact CG2-CB 4.49Å; E181-E184 HydrophobicContact CB-CG 4Å; T182-E184 VanDerWaalsContact C-N 3.3Å; T182-E184 PolarHBondContact O-N 3.03Å; E184-A188 WeakPolarHBondContact O-CB 3.37Å; E184-A188 PolarHBondContact O-N 3.05Å; E184-A188 VanDerWaalsContact O-N 3.09Å
185	G	95.1	Very high	95.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-34.2	177.7	0	0	0	0	0	113.7	F178 T182 E183 G190	F178-G185 VanDerWaalsContact CE1-N 3.33Å; T182-G185 PolarHBondContact O-N 3.04Å; E183-G185 VanDerWaalsContact C-N 3.29Å; E183-G185 PolarHBondContact O-N 2.87Å; G185-G190 WeakPolarHBondContact O-CA 3.38Å; G185-G190 PolarHBondContact O-N 3.03Å
186	L	96.9	Very high	95.8	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-71.7	-41.9	175.5	-62.1	174.2	0	0	0	111.4	T182 E183 A188 G189 I191 L216 N219 R221	T182-L186 WeakPolarHBondContact O-CG 3.22Å; T182-L186 PolarHBondContact O-N 3.2Å; E183-L186 PolarHBondContact O-N 2.64Å; L186-A188 VanDerWaalsContact C-N 3.26Å; L186-A188 PolarHBondContact O-N 3.33Å; L186-G189 PolarHBondContact O-N 2.71Å; L186-G189 VanDerWaalsContact O-N 3.09Å; L186-I191 HydrophobicContact CD2-CG1 3.88Å; L186-L216 HydrophobicContact CD2-CB 4.13Å; L186-L216 HydrophobicContact CD2-CD1 4.27Å; L186-L216 HydrophobicContact CD2-CD2 4.38Å; L186-L216 HydrophobicContact CD2-CG 4.49Å; L186-L216 HydrophobicContact CG-CD2 4.34Å; L186-N219 HydrophobicContact CD1-CB 4.29Å; L186-R221 HydrophobicContact CD1-CB 3.93Å; L186-R221 HydrophobicContact CD1-CG 3.95Å; L186-R221 PolarHBondContact O-NH2 2.85Å
187	N	96.2	Very high	95.9	Very high	100 Å²	100	37 Å²	37	54%	0.535	20%	0.197	S	C	.	.	H	α-helix	trans	-61.5	-35.6	175.8	-70.4	-23	0	0	0	112.3	E183 G189 R221	E183-N187 WeakPolarHBondContact O-CB 3.36Å; E183-N187 PolarHBondContact O-N 2.98Å; E183-N187 PolarHBondContact O-ND2 3.34Å; N187-G189 PolarHBondContact O-N 3.43Å; N187-R221 PolarHBondContact OD1-NH1 2.93Å; N187-R221 PolarHBondContact OD1-NH2 3.29Å
188	A	95.1	Very high	95.9	Very high	16 Å²	16	37.3 Å²	37.3	13%	0.132	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	7.9	176.9	0	0	0	0	0	114.2	I152 V156 E184 L186 G190	I152-A188 HydrophobicContact CG2-CB 3.78Å; V156-A188 HydrophobicContact CG2-CB 3.85Å; E184-A188 WeakPolarHBondContact O-CB 3.37Å; E184-A188 PolarHBondContact O-N 3.05Å; E184-A188 VanDerWaalsContact O-N 3.09Å; L186-A188 VanDerWaalsContact C-N 3.26Å; L186-A188 PolarHBondContact O-N 3.33Å; A188-G190 VanDerWaalsContact C-N 3.34Å; A188-G190 PolarHBondContact O-N 3.29Å
189	G	95.8	Very high	96	Very high	31 Å²	31	42.3 Å²	42.3	32%	0.32	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	26.6	179	0	0	0	0	0	114.1	L186 N187 I191 S192 L193	L186-G189 PolarHBondContact O-N 2.71Å; L186-G189 VanDerWaalsContact O-N 3.09Å; N187-G189 PolarHBondContact O-N 3.43Å; G189-I191 VanDerWaalsContact C-N 3.34Å; G189-I191 PolarHBondContact O-N 2.92Å; G189-S192 PolarHBondContact O-N 3.22Å; G189-S192 VanDerWaalsContact O-N 3.15Å; G189-L193 PolarHBondContact O-N 2.72Å
190	G	96.4	Very high	96.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-56.3	-41.4	-173.7	0	0	0	0	0	113.7	G185 A188 S192 L193 F194	G185-G190 WeakPolarHBondContact O-CA 3.38Å; G185-G190 PolarHBondContact O-N 3.03Å; A188-G190 VanDerWaalsContact C-N 3.34Å; A188-G190 PolarHBondContact O-N 3.29Å; G190-S192 VanDerWaalsContact C-N 3.34Å; G190-S192 PolarHBondContact O-N 3.24Å; G190-L193 PolarHBondContact O-N 3.16Å; G190-F194 VanDerWaalsContact C-CD2 3.46Å; G190-F194 WeakPolarHBondContact O-CB 3.48Å; G190-F194 WeakPolarHBondContact O-CD2 3.28Å; G190-F194 WeakPolarHBondContact O-CE2 3.37Å; G190-F194 WeakPolarHBondContact O-CG 3.23Å; G190-F194 PolarHBondContact O-N 3.49Å
191	I	97.9	Very high	96.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-44.8	178.5	-66.9	-66.2	0	0	0	111.6	L186 G189 T195 L216 E225 A226 N229	L186-I191 HydrophobicContact CD2-CG1 3.88Å; G189-I191 VanDerWaalsContact C-N 3.34Å; G189-I191 PolarHBondContact O-N 2.92Å; I191-T195 VanDerWaalsContact O-CB 3.3Å; I191-T195 WeakPolarHBondContact O-CB 3.4Å; I191-T195 PolarHBondContact O-N 3.08Å; I191-T195 PolarHBondContact O-OG1 2.84Å; I191-L216 HydrophobicContact CD1-CB 3.68Å; I191-L216 HydrophobicContact CD1-CD1 3.91Å; I191-L216 HydrophobicContact CD1-CG 4.45Å; I191-L216 HydrophobicContact CG1-CB 4.37Å; I191-L216 HydrophobicContact CG1-CD1 4.08Å; I191-E225 HydrophobicContact CB-CB 4.07Å; I191-E225 HydrophobicContact CG1-CB 4.03Å; I191-E225 HydrophobicContact CG2-CB 4.07Å; I191-A226 HydrophobicContact CG2-CB 4.27Å; I191-N229 HydrophobicContact CG2-CB 4.2Å
192	S	97.8	Very high	97	Very high	40 Å²	40	39.8 Å²	39.8	28%	0.28	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-45.5	179.7	-161.9	0	0	0	0	111.3	G189 G190 T195 K196 N229	G189-S192 PolarHBondContact O-N 3.22Å; G189-S192 VanDerWaalsContact O-N 3.15Å; G190-S192 VanDerWaalsContact C-N 3.34Å; G190-S192 PolarHBondContact O-N 3.24Å; S192-T195 PolarHBondContact O-N 3.17Å; S192-K196 WeakPolarHBondContact O-CG 3.05Å; S192-K196 PolarHBondContact O-N 3.41Å; S192-N229 WeakPolarHBondContact CA-OD1 3.41Å; S192-N229 WeakPolarHBondContact CB-OD1 3.15Å; S192-N229 PolarHBondContact OG-OD1 3.05Å
193	L	97.4	Very high	97.1	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-53.3	177.5	172.1	61.9	0	0	0	111.5	V156 V159 E160 G189 G190 T195 K196 L197	V156-L193 HydrophobicContact CB-CD2 4.34Å; V156-L193 HydrophobicContact CG1-CD2 3.71Å; V159-L193 HydrophobicContact CB-CD2 4.03Å; V159-L193 HydrophobicContact CG1-CD1 4.29Å; V159-L193 HydrophobicContact CG1-CD2 4.01Å; V159-L193 HydrophobicContact CG1-CG 4.39Å; E160-L193 HydrophobicContact CG-CD1 3.64Å; G189-L193 PolarHBondContact O-N 2.72Å; G190-L193 PolarHBondContact O-N 3.16Å; L193-T195 VanDerWaalsContact C-N 3.28Å; L193-T195 PolarHBondContact O-N 3.02Å; L193-K196 WeakPolarHBondContact O-CB 3.4Å; L193-K196 PolarHBondContact O-N 2.66Å; L193-L197 HydrophobicContact CD1-CD1 4.26Å; L193-L197 HydrophobicContact CD1-CG 4.48Å; L193-L197 HydrophobicContact CG-CD1 4.25Å; L193-L197 PolarHBondContact O-N 3.23Å
194	F	98.3	Very high	97.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.5	-32.6	-175.6	-56.7	-39.2	0	0	0	111.9	L171 L174 F178 G190 K196 L197 L198 A209 N212 I213 L216	L171-F194 HydrophobicContact CD2-CD1 3.83Å; L171-F194 HydrophobicContact CD2-CE1 3.52Å; L174-F194 HydrophobicContact CD1-CE1 4.21Å; L174-F194 HydrophobicContact CD1-CZ 4.09Å; F178-F194 HydrophobicContact CD2-CE2 4.46Å; F178-F194 AromaticContact CE2-CE2 3.79Å; F178-F194 HydrophobicContact CE2-CE2 3.79Å; F178-F194 AromaticContact CE2-CZ 3.78Å; F178-F194 HydrophobicContact CE2-CZ 3.78Å; G190-F194 VanDerWaalsContact C-CD2 3.46Å; G190-F194 WeakPolarHBondContact O-CB 3.48Å; G190-F194 WeakPolarHBondContact O-CD2 3.28Å; G190-F194 WeakPolarHBondContact O-CE2 3.37Å; G190-F194 WeakPolarHBondContact O-CG 3.23Å; G190-F194 PolarHBondContact O-N 3.49Å; F194-K196 VanDerWaalsContact C-N 3.34Å; F194-K196 PolarHBondContact O-N 2.9Å; F194-L197 HydrophobicContact CD1-CD1 4.23Å; F194-L197 PolarHBondContact O-N 3.05Å; F194-L197 VanDerWaalsContact O-N 3.14Å; F194-L198 WeakPolarHBondContact O-CG 3.5Å; F194-L198 PolarHBondContact O-N 3.31Å; F194-A209 HydrophobicContact CB-CB 4.24Å; F194-N212 HydrophobicContact CD1-CB 4.25Å; F194-N212 HydrophobicContact CD2-CB 3.52Å; F194-N212 HydrophobicContact CE1-CB 4.22Å; F194-N212 HydrophobicContact CE2-CB 3.49Å; F194-N212 VanDerWaalsContact CE2-CB 3.49Å; F194-N212 HydrophobicContact CG-CB 3.96Å; F194-N212 HydrophobicContact CZ-CB 3.86Å; F194-I213 HydrophobicContact CB-CD1 3.82Å; F194-I213 HydrophobicContact CB-CG1 3.54Å; F194-I213 HydrophobicContact CD2-CG1 4.45Å; F194-I213 HydrophobicContact CG-CG1 4.45Å; F194-L216 HydrophobicContact CD2-CD1 4.09Å; F194-L216 HydrophobicContact CE2-CD1 3.85Å
195	T	98.6	Very high	97.4	Very high	19 Å²	19	37 Å²	37	12%	0.117	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-43	174.4	-58.4	0	0	0	0	111.5	I191 S192 L193 L197 L198 N229 T231 A234	I191-T195 VanDerWaalsContact O-CB 3.3Å; I191-T195 WeakPolarHBondContact O-CB 3.4Å; I191-T195 PolarHBondContact O-N 3.08Å; I191-T195 PolarHBondContact O-OG1 2.84Å; S192-T195 PolarHBondContact O-N 3.17Å; L193-T195 VanDerWaalsContact C-N 3.28Å; L193-T195 PolarHBondContact O-N 3.02Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 3.37Å; T195-L198 WeakPolarHBondContact O-CB 3.36Å; T195-L198 PolarHBondContact O-N 3.14Å; T195-N229 WeakPolarHBondContact CG2-O 3.32Å; T195-T231 HydrophobicContact CG2-CG2 4.45Å; T195-T231 PolarHBondContact OG1-OG1 2.76Å; T195-A234 HydrophobicContact CG2-CB 4.41Å
196	K	97.9	Very high	97.6	Very high	132 Å²	132	38.4 Å²	38.4	57%	0.574	23%	0.225	S	C	*	.	H	α-helix	trans	-61.8	-36.2	174.3	-65.7	171.5	-173.4	172.4	0	112.3	S192 L193 F194 L198 S199	S192-K196 WeakPolarHBondContact O-CG 3.05Å; S192-K196 PolarHBondContact O-N 3.41Å; L193-K196 WeakPolarHBondContact O-CB 3.4Å; L193-K196 PolarHBondContact O-N 2.66Å; F194-K196 VanDerWaalsContact C-N 3.34Å; F194-K196 PolarHBondContact O-N 2.9Å; K196-L198 PolarHBondContact O-N 3.39Å; K196-S199 PolarHBondContact O-N 3.01Å; K196-S199 PolarHBondContact O-OG 3.4Å; K196-S199 VanDerWaalsContact O-OG 3.1Å
197	L	98.3	Very high	97.7	Very high	16 Å²	16	38.4 Å²	38.4	8%	0.084	23%	0.225	C	C	.	.	H	α-helix	trans	-73.2	-13.7	179.3	-65.2	172.5	0	0	0	113.7	V159 K167 L171 L193 F194 T195 S199 H200 I205 A209	V159-L197 HydrophobicContact CG1-CD1 3.35Å; V159-L197 HydrophobicContact CG1-CG 4.5Å; K167-L197 HydrophobicContact CD-CD2 4.32Å; L171-L197 HydrophobicContact CD1-CD1 4.42Å; L171-L197 HydrophobicContact CD2-CD1 4.09Å; L193-L197 HydrophobicContact CD1-CD1 4.26Å; L193-L197 HydrophobicContact CD1-CG 4.48Å; L193-L197 HydrophobicContact CG-CD1 4.25Å; L193-L197 PolarHBondContact O-N 3.23Å; F194-L197 HydrophobicContact CD1-CD1 4.23Å; F194-L197 PolarHBondContact O-N 3.05Å; F194-L197 VanDerWaalsContact O-N 3.14Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 3.37Å; L197-S199 PolarHBondContact O-N 3.29Å; L197-H200 WeakPolarHBondContact O-CB 3.43Å; L197-H200 PolarHBondContact O-N 3.21Å; L197-H200 VanDerWaalsContact O-N 3.08Å; L197-I205 HydrophobicContact CB-CG2 4.21Å; L197-I205 HydrophobicContact CD2-CG2 4.09Å; L197-A209 HydrophobicContact CB-CB 3.66Å
198	L	98.5	Very high	97.8	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.7	173.7	-65	-178.3	0	0	0	112.9	F194 T195 K196 R206 A209 A210 I213 T231 A234 L235 L238	F194-L198 WeakPolarHBondContact O-CG 3.5Å; F194-L198 PolarHBondContact O-N 3.31Å; T195-L198 WeakPolarHBondContact O-CB 3.36Å; T195-L198 PolarHBondContact O-N 3.14Å; K196-L198 PolarHBondContact O-N 3.39Å; L198-R206 WeakPolarHBondContact O-CD 3.29Å; L198-A209 HydrophobicContact CD2-CB 4.08Å; L198-A210 HydrophobicContact CD2-CB 4Å; L198-I213 HydrophobicContact CD1-CD1 3.71Å; L198-I213 HydrophobicContact CD2-CD1 3.96Å; L198-I213 HydrophobicContact CG-CD1 3.92Å; L198-T231 HydrophobicContact CD1-CG2 4.4Å; L198-A234 HydrophobicContact CB-CB 4.31Å; L198-A234 HydrophobicContact CD1-CB 3.67Å; L198-L235 HydrophobicContact CD1-CD2 3.67Å; L198-L235 HydrophobicContact CD1-CG 4.02Å; L198-L235 HydrophobicContact CD2-CD2 4.3Å; L198-L238 HydrophobicContact CB-CD1 3.99Å; L198-L238 HydrophobicContact CD1-CD1 4.31Å; L198-L238 HydrophobicContact CD2-CD1 3.71Å; L198-L238 HydrophobicContact CG-CD1 4.21Å
199	S	97.7	Very high	98	Very high	106 Å²	106	35.8 Å²	35.8	74%	0.741	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	11	173.8	65.8	0	0	0	0	113.7	K196 L197	K196-S199 PolarHBondContact O-N 3.01Å; K196-S199 PolarHBondContact O-OG 3.4Å; K196-S199 VanDerWaalsContact O-OG 3.1Å; L197-S199 PolarHBondContact O-N 3.29Å
200	H	98	Very high	98.1	Very high	40 Å²	40	34.3 Å²	34.3	19%	0.185	19%	0.189	C	C	.	.			trans	-65.7	146	-179.4	-162	-84.8	0	0	0	111.5	D164 K167 L197 N202 I205 R206	D164-H200 IonicContact OD1-CE1 3.72Å; D164-H200 PolarHBondContact OD1-CE1 3.24Å; D164-H200 IonicContact OD1-NE2 3.74Å; D164-H200 PolarHBondContact OD1-NE2 3.21Å; D164-H200 IonicContact OD2-CE1 3.73Å; D164-H200 PolarHBondContact OD2-CE1 3.44Å; K167-H200 PolarHBondContact NZ-NE2 3.2Å; K167-H200 VanDerWaalsContact NZ-NE2 3.18Å; L197-H200 WeakPolarHBondContact O-CB 3.43Å; L197-H200 PolarHBondContact O-N 3.21Å; L197-H200 VanDerWaalsContact O-N 3.08Å; H200-N202 VanDerWaalsContact C-N 3.35Å; H200-N202 WeakPolarHBondContact ND1-CB 3.23Å; H200-N202 PolarHBondContact ND1-N 3Å; H200-N202 VanDerWaalsContact ND1-N 3.16Å; H200-N202 PolarHBondContact O-N 2.89Å; H200-I205 HydrophobicContact CB-CB 4.32Å; H200-I205 HydrophobicContact CB-CG2 3.76Å; H200-I205 WeakPolarHBondContact CE1-CD1 3.3Å; H200-R206 HydrophobicContact CB-CG 4.28Å; H200-R206 VanDerWaalsContact O-CD 3.32Å; H200-R206 WeakPolarHBondContact O-CD 3.31Å; H200-R206 WeakPolarHBondContact O-CG 3.47Å; H200-R206 PolarHBondContact O-NH1 3.15Å
201	S	97.2	Very high	98.2	Very high	105 Å²	105	35.1 Å²	35.1	73%	0.734	19%	0.193	S	C	*	.	S	Bend	trans	-63.7	-39.5	-178.9	56	0	0	0	0	112.6	T203 R206	S201-T203 PolarHBondContact O-N 3.23Å; S201-R206 PolarHBondContact O-NH1 3.03Å
202	N	97.7	Very high	98.2	Very high	48 Å²	48	35.1 Å²	35.1	26%	0.257	19%	0.193	S	C	.	.	S	Bend	trans	-74.5	118.4	176.7	-169.4	-31.4	0	0	0	112.4	D164 H200 E204 I205 R206	D164-N202 WeakPolarHBondContact OD2-CB 3.35Å; D164-N202 PolarHBondContact OD2-ND2 3.09Å; D164-N202 VanDerWaalsContact OD2-ND2 3.11Å; H200-N202 VanDerWaalsContact C-N 3.35Å; H200-N202 WeakPolarHBondContact ND1-CB 3.23Å; H200-N202 PolarHBondContact ND1-N 3Å; H200-N202 VanDerWaalsContact ND1-N 3.16Å; H200-N202 PolarHBondContact O-N 2.89Å; N202-E204 VanDerWaalsContact C-N 3.3Å; N202-E204 PolarHBondContact O-N 3.39Å; N202-E204 WeakPolarHBondContact OD1-CB 2.94Å; N202-E204 PolarHBondContact OD1-N 3.2Å; N202-I205 HydrophobicContact CB-CB 4.33Å; N202-I205 HydrophobicContact CB-CD1 3.88Å; N202-I205 HydrophobicContact CB-CG1 4.3Å; N202-I205 PolarHBondContact O-N 3.24Å; N202-R206 PolarHBondContact O-N 3.08Å
203	T	98.2	Very high	98.3	Very high	48 Å²	48	33.2 Å²	33.2	29%	0.294	18%	0.18	S	C	.	.	H	α-helix	trans	-59.5	-36.7	179.8	-54.2	0	0	0	0	112.9	S201 I205 R206 T207 N243 L246	S201-T203 PolarHBondContact O-N 3.23Å; T203-I205 VanDerWaalsContact C-N 3.33Å; T203-I205 PolarHBondContact O-N 3.2Å; T203-R206 PolarHBondContact O-N 3.38Å; T203-R206 PolarHBondContact OG1-NH2 3.43Å; T203-T207 PolarHBondContact O-N 3.37Å; T203-T207 PolarHBondContact O-OG1 3.46Å; T203-N243 HydrophobicContact CG2-CB 3.68Å; T203-L246 HydrophobicContact CG2-CD2 4.22Å
204	E	98.3	Very high	98.3	Very high	56 Å²	56	34.2 Å²	34.2	26%	0.262	19%	0.185	S	C	.	.	H	α-helix	trans	-66.1	-38.5	-179.2	-173.6	61.3	-167.4	0	0	111.3	I168 N202 T207 R208	I168-E204 HydrophobicContact CD1-CB 3.93Å; I168-E204 HydrophobicContact CD1-CG 3.64Å; I168-E204 HydrophobicContact CG1-CB 4.35Å; I168-E204 HydrophobicContact CG1-CG 3.86Å; I168-E204 HydrophobicContact CG2-CG 3.94Å; N202-E204 VanDerWaalsContact C-N 3.3Å; N202-E204 PolarHBondContact O-N 3.39Å; N202-E204 WeakPolarHBondContact OD1-CB 2.94Å; N202-E204 PolarHBondContact OD1-N 3.2Å; E204-T207 WeakPolarHBondContact O-CB 3.37Å; E204-T207 PolarHBondContact O-N 3.44Å; E204-R208 WeakPolarHBondContact O-CG 3.44Å; E204-R208 PolarHBondContact O-N 2.96Å; E204-R208 IonicContact OE1-CZ 2.77Å; E204-R208 IonicContact OE1-NE 2.64Å; E204-R208 PolarHBondContact OE1-NE 3.49Å; E204-R208 IonicContact OE1-NH2 3.47Å; E204-R208 PolarHBondContact OE1-NH2 2.7Å
205	I	98.6	Very high	98.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-43.4	174.8	-72.2	164.5	0	0	0	110.9	D164 K167 I168 L171 L197 H200 N202 T203 T207 R208 A209	D164-I205 HydrophobicContact CB-CD1 3.75Å; D164-I205 WeakPolarHBondContact OD1-CD1 3.15Å; K167-I205 HydrophobicContact CB-CD1 4.32Å; K167-I205 HydrophobicContact CD-CD1 3.72Å; K167-I205 HydrophobicContact CD-CG1 4.16Å; K167-I205 HydrophobicContact CD-CG2 4.14Å; K167-I205 HydrophobicContact CG-CD1 4.4Å; I168-I205 HydrophobicContact CG1-CG1 3.86Å; L171-I205 HydrophobicContact CD1-CG2 4.23Å; L197-I205 HydrophobicContact CB-CG2 4.21Å; L197-I205 HydrophobicContact CD2-CG2 4.09Å; H200-I205 HydrophobicContact CB-CB 4.32Å; H200-I205 HydrophobicContact CB-CG2 3.76Å; H200-I205 WeakPolarHBondContact CE1-CD1 3.3Å; N202-I205 HydrophobicContact CB-CB 4.33Å; N202-I205 HydrophobicContact CB-CD1 3.88Å; N202-I205 HydrophobicContact CB-CG1 4.3Å; N202-I205 PolarHBondContact O-N 3.24Å; T203-I205 VanDerWaalsContact C-N 3.33Å; T203-I205 PolarHBondContact O-N 3.2Å; I205-T207 VanDerWaalsContact C-N 3.31Å; I205-T207 PolarHBondContact O-N 2.9Å; I205-R208 PolarHBondContact O-N 3.46Å; I205-A209 VanDerWaalsContact O-CB 3.31Å; I205-A209 WeakPolarHBondContact O-CB 3.23Å; I205-A209 PolarHBondContact O-N 3.47Å
206	R	98.6	Very high	98.3	Very high	30 Å²	30	36.8 Å²	36.8	11%	0.113	19%	0.192	C	C	.	.	H	α-helix	trans	-58.8	-44.3	173.6	-62.4	-162.7	-61.8	-78.4	2.8	111.2	L198 H200 S201 N202 T203 A209 A210 D241 L246	L198-R206 WeakPolarHBondContact O-CD 3.29Å; H200-R206 HydrophobicContact CB-CG 4.28Å; H200-R206 VanDerWaalsContact O-CD 3.32Å; H200-R206 WeakPolarHBondContact O-CD 3.31Å; H200-R206 WeakPolarHBondContact O-CG 3.47Å; H200-R206 PolarHBondContact O-NH1 3.15Å; S201-R206 PolarHBondContact O-NH1 3.03Å; N202-R206 PolarHBondContact O-N 3.08Å; T203-R206 PolarHBondContact O-N 3.38Å; T203-R206 PolarHBondContact OG1-NH2 3.43Å; R206-A209 PolarHBondContact O-N 2.99Å; R206-A210 WeakPolarHBondContact O-CB 3.07Å; R206-A210 PolarHBondContact O-N 3.11Å; R206-D241 IonicContact CZ-OD2 3.93Å; R206-D241 IonicContact NE-OD2 2.63Å; R206-D241 IonicContact NH2-OD2 2.91Å; R206-D241 PolarHBondContact NH2-OD2 2.79Å; R206-L246 HydrophobicContact CB-CD1 4.08Å; R206-L246 HydrophobicContact CB-CD2 3.92Å
207	T	98.8	Very high	98.3	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-49	177.5	-58.9	0	0	0	0	111.7	T203 E204 I205 A210 Q211 D245 F249	T203-T207 PolarHBondContact O-N 3.37Å; T203-T207 PolarHBondContact O-OG1 3.46Å; E204-T207 WeakPolarHBondContact O-CB 3.37Å; E204-T207 PolarHBondContact O-N 3.44Å; I205-T207 VanDerWaalsContact C-N 3.31Å; I205-T207 PolarHBondContact O-N 2.9Å; T207-A210 PolarHBondContact O-N 3.47Å; T207-Q211 WeakPolarHBondContact O-CB 3.18Å; T207-Q211 PolarHBondContact O-N 2.99Å; T207-D245 HydrophobicContact CG2-CB 3.67Å; T207-F249 HydrophobicContact CG2-CD2 3.8Å; T207-F249 HydrophobicContact CG2-CE2 3.76Å
208	R	98.7	Very high	98.2	Very high	62 Å²	62	33 Å²	33	23%	0.234	18%	0.181	C	C	.	.	H	α-helix	trans	-70	-32.9	179.4	-58.6	-49.5	173.4	165.8	-3.9	113.1	I168 L171 N172 E204 I205 Q211 N212	I168-R208 HydrophobicContact CG2-CG 4.39Å; L171-R208 HydrophobicContact CB-CB 3.64Å; L171-R208 HydrophobicContact CB-CG 4.38Å; L171-R208 HydrophobicContact CD1-CB 3.79Å; L171-R208 HydrophobicContact CG-CB 4.3Å; N172-R208 WeakPolarHBondContact OD1-CD 3.38Å; N172-R208 PolarHBondContact OD1-NE 2.77Å; N172-R208 PolarHBondContact OD1-NH1 3.18Å; N172-R208 VanDerWaalsContact OD1-NH1 3.15Å; E204-R208 WeakPolarHBondContact O-CG 3.44Å; E204-R208 PolarHBondContact O-N 2.96Å; E204-R208 IonicContact OE1-CZ 2.77Å; E204-R208 IonicContact OE1-NE 2.64Å; E204-R208 PolarHBondContact OE1-NE 3.49Å; E204-R208 IonicContact OE1-NH2 3.47Å; E204-R208 PolarHBondContact OE1-NH2 2.7Å; I205-R208 PolarHBondContact O-N 3.46Å; R208-Q211 PolarHBondContact O-N 3.46Å; R208-N212 PolarHBondContact O-N 3.19Å; R208-N212 PolarHBondContact O-ND2 3.15Å
209	A	98.7	Very high	98	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-49.2	171.9	0	0	0	0	0	111.3	F194 L197 L198 I205 R206 Q211 N212 I213	F194-A209 HydrophobicContact CB-CB 4.24Å; L197-A209 HydrophobicContact CB-CB 3.66Å; L198-A209 HydrophobicContact CD2-CB 4.08Å; I205-A209 VanDerWaalsContact O-CB 3.31Å; I205-A209 WeakPolarHBondContact O-CB 3.23Å; I205-A209 PolarHBondContact O-N 3.47Å; R206-A209 PolarHBondContact O-N 2.99Å; A209-Q211 VanDerWaalsContact C-N 3.29Å; A209-Q211 PolarHBondContact O-N 3.2Å; A209-N212 PolarHBondContact O-N 3.16Å; A209-I213 WeakPolarHBondContact O-CG1 3.35Å; A209-I213 PolarHBondContact O-N 3.38Å
210	A	98.8	Very high	98	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-38	175.4	0	0	0	0	0	112.2	L198 R206 T207 I213 L214 L246 F249	L198-A210 HydrophobicContact CD2-CB 4Å; R206-A210 WeakPolarHBondContact O-CB 3.07Å; R206-A210 PolarHBondContact O-N 3.11Å; T207-A210 PolarHBondContact O-N 3.47Å; A210-I213 PolarHBondContact O-N 2.95Å; A210-L214 WeakPolarHBondContact O-CB 3.42Å; A210-L214 PolarHBondContact O-N 3.3Å; A210-L246 HydrophobicContact CB-CD1 3.88Å; A210-F249 HydrophobicContact CB-CB 3.85Å
211	Q	98.7	Very high	97.9	Very high	16 Å²	16	37.5 Å²	37.5	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-42.4	175.3	-170.7	-178.2	23.1	0	0	112.4	Y175 T207 R208 A209 R215 F249	Y175-Q211 HydrophobicContact CD2-CG 3.63Å; Y175-Q211 HydrophobicContact CE2-CG 3.64Å; Y175-Q211 HydrophobicContact CG-CG 4.2Å; T207-Q211 WeakPolarHBondContact O-CB 3.18Å; T207-Q211 PolarHBondContact O-N 2.99Å; R208-Q211 PolarHBondContact O-N 3.46Å; A209-Q211 VanDerWaalsContact C-N 3.29Å; A209-Q211 PolarHBondContact O-N 3.2Å; Q211-R215 PolarHBondContact O-N 3.06Å; Q211-R215 VanDerWaalsContact O-N 3.13Å; Q211-F249 HydrophobicContact CB-CD1 4.36Å; Q211-F249 HydrophobicContact CB-CD2 3.81Å; Q211-F249 HydrophobicContact CB-CE1 4.44Å; Q211-F249 HydrophobicContact CB-CE2 3.9Å; Q211-F249 HydrophobicContact CB-CG 4.06Å; Q211-F249 HydrophobicContact CB-CZ 4.22Å; Q211-F249 HydrophobicContact CG-CD1 4.27Å; Q211-F249 HydrophobicContact CG-CD2 4.33Å; Q211-F249 HydrophobicContact CG-CE1 3.97Å; Q211-F249 HydrophobicContact CG-CE2 4.03Å; Q211-F249 HydrophobicContact CG-CG 4.46Å; Q211-F249 HydrophobicContact CG-CZ 3.84Å
212	N	98.6	Very high	98	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.2	-40.2	176.6	-83.4	-81.6	0	0	0	112.1	L171 Y175 F178 F194 R208 A209 L214 R215 L216	L171-N212 PolarHBondContact O-ND2 3Å; Y175-N212 VanDerWaalsContact CA-OD1 3.26Å; Y175-N212 WeakPolarHBondContact CA-OD1 3.47Å; Y175-N212 PolarHBondContact N-OD1 3.13Å; Y175-N212 VanDerWaalsContact N-OD1 3.13Å; F178-N212 WeakPolarHBondContact CD2-OD1 3.48Å; F194-N212 HydrophobicContact CD1-CB 4.25Å; F194-N212 HydrophobicContact CD2-CB 3.52Å; F194-N212 HydrophobicContact CE1-CB 4.22Å; F194-N212 HydrophobicContact CE2-CB 3.49Å; F194-N212 VanDerWaalsContact CE2-CB 3.49Å; F194-N212 HydrophobicContact CG-CB 3.96Å; F194-N212 HydrophobicContact CZ-CB 3.86Å; R208-N212 PolarHBondContact O-N 3.19Å; R208-N212 PolarHBondContact O-ND2 3.15Å; A209-N212 PolarHBondContact O-N 3.16Å; N212-L214 PolarHBondContact O-N 2.9Å; N212-R215 WeakPolarHBondContact O-CB 3.45Å; N212-R215 PolarHBondContact O-N 2.97Å; N212-R215 VanDerWaalsContact O-N 3.14Å; N212-L216 WeakPolarHBondContact O-CG 3.5Å; N212-L216 PolarHBondContact O-N 3.25Å
213	I	98.7	Very high	98	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-47.3	173.8	-68.5	164.8	0	0	0	110.6	F194 L198 A209 A210 R215 L216 C217 T231 L235 A253	F194-I213 HydrophobicContact CB-CD1 3.82Å; F194-I213 HydrophobicContact CB-CG1 3.54Å; F194-I213 HydrophobicContact CD2-CG1 4.45Å; F194-I213 HydrophobicContact CG-CG1 4.45Å; L198-I213 HydrophobicContact CD1-CD1 3.71Å; L198-I213 HydrophobicContact CD2-CD1 3.96Å; L198-I213 HydrophobicContact CG-CD1 3.92Å; A209-I213 WeakPolarHBondContact O-CG1 3.35Å; A209-I213 PolarHBondContact O-N 3.38Å; A210-I213 PolarHBondContact O-N 2.95Å; I213-R215 PolarHBondContact O-N 3.22Å; I213-L216 PolarHBondContact O-N 3.02Å; I213-C217 WeakPolarHBondContact O-CB 3.18Å; I213-C217 PolarHBondContact O-N 3.43Å; I213-C217 PolarHBondContact O-SG 2.91Å; I213-T231 HydrophobicContact CD1-CG2 3.89Å; I213-T231 HydrophobicContact CG2-CG2 3.85Å; I213-L235 HydrophobicContact CG2-CD1 4.31Å; I213-A253 HydrophobicContact CG2-CB 4.05Å
214	L	98.4	Very high	98	Very high	32 Å²	32	33.4 Å²	33.4	17%	0.168	16%	0.155	C	C	.	.	H	α-helix	trans	-52.5	-45.3	174.6	167	60.8	0	0	0	111.1	A210 N212 F249 G252 A253 F256	A210-L214 WeakPolarHBondContact O-CB 3.42Å; A210-L214 PolarHBondContact O-N 3.3Å; N212-L214 PolarHBondContact O-N 2.9Å; L214-F249 HydrophobicContact CD2-CD1 3.69Å; L214-F249 HydrophobicContact CD2-CE1 4.46Å; L214-G252 VanDerWaalsContact CD1-C 3.48Å; L214-A253 HydrophobicContact CB-CB 4.15Å; L214-F256 HydrophobicContact CD1-CD2 3.46Å; L214-F256 VanDerWaalsContact CD1-CD2 3.46Å; L214-F256 HydrophobicContact CD1-CE2 3.6Å
215	R	98.1	Very high	98	Very high	72 Å²	72	32.2 Å²	32.2	27%	0.272	15%	0.149	S	C	.	.	H	α-helix	trans	-63.9	-47.5	-179.9	-177.6	55.4	63.9	-175.7	-4.5	112.3	Y175 F178 S179 Q211 N212 I213 C217 V218	Y175-R215 HydrophobicContact CD2-CB 4.19Å; Y175-R215 HydrophobicContact CE2-CB 4.22Å; Y175-R215 PolarHBondContact OH-NH2 3.25Å; F178-R215 HydrophobicContact CB-CG 3.77Å; F178-R215 WeakPolarHBondContact O-CD 3.47Å; F178-R215 WeakPolarHBondContact O-CG 3.45Å; S179-R215 PolarHBondContact OG-NE 2.96Å; Q211-R215 PolarHBondContact O-N 3.06Å; Q211-R215 VanDerWaalsContact O-N 3.13Å; N212-R215 WeakPolarHBondContact O-CB 3.45Å; N212-R215 PolarHBondContact O-N 2.97Å; N212-R215 VanDerWaalsContact O-N 3.14Å; I213-R215 PolarHBondContact O-N 3.22Å; R215-C217 VanDerWaalsContact C-N 3.35Å; R215-V218 WeakPolarHBondContact O-CB 3.4Å; R215-V218 WeakPolarHBondContact O-CG2 3.45Å; R215-V218 PolarHBondContact O-N 3.16Å
216	L	98.2	Very high	98	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.9	-32.8	-178.8	-66.5	-177.7	0	0	0	112.5	F178 T182 L186 I191 F194 N212 I213 V218 N219	F178-L216 HydrophobicContact CB-CD2 4.06Å; F178-L216 HydrophobicContact CD2-CD2 3.93Å; F178-L216 HydrophobicContact CD2-CG 4.29Å; F178-L216 HydrophobicContact CG-CD2 3.95Å; T182-L216 WeakPolarHBondContact O-CD2 3.32Å; L186-L216 HydrophobicContact CD2-CB 4.13Å; L186-L216 HydrophobicContact CD2-CD1 4.27Å; L186-L216 HydrophobicContact CD2-CD2 4.38Å; L186-L216 HydrophobicContact CD2-CG 4.49Å; L186-L216 HydrophobicContact CG-CD2 4.34Å; I191-L216 HydrophobicContact CD1-CB 3.68Å; I191-L216 HydrophobicContact CD1-CD1 3.91Å; I191-L216 HydrophobicContact CD1-CG 4.45Å; I191-L216 HydrophobicContact CG1-CB 4.37Å; I191-L216 HydrophobicContact CG1-CD1 4.08Å; F194-L216 HydrophobicContact CD2-CD1 4.09Å; F194-L216 HydrophobicContact CE2-CD1 3.85Å; N212-L216 WeakPolarHBondContact O-CG 3.5Å; N212-L216 PolarHBondContact O-N 3.25Å; I213-L216 PolarHBondContact O-N 3.02Å; L216-V218 PolarHBondContact O-N 3.11Å; L216-V218 VanDerWaalsContact O-N 3.16Å; L216-N219 PolarHBondContact O-N 2.97Å; L216-N219 VanDerWaalsContact O-N 3.16Å
217	C	98.1	Very high	98	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.1	178.3	-69.5	0	0	0	0	114.4	I213 R215 N219 K223 F256 I257	I213-C217 WeakPolarHBondContact O-CB 3.18Å; I213-C217 PolarHBondContact O-N 3.43Å; I213-C217 PolarHBondContact O-SG 2.91Å; R215-C217 VanDerWaalsContact C-N 3.35Å; C217-N219 PolarHBondContact O-N 2.91Å; C217-K223 HydrophobicContact CB-CG 4.4Å; C217-K223 WeakPolarHBondContact O-CE 3.46Å; C217-K223 VanDerWaalsContact O-CG 3.23Å; C217-K223 WeakPolarHBondContact O-CG 3.23Å; C217-F256 HydrophobicContact CB-CB 4.06Å; C217-F256 WeakPolarHBondContact O-CB 3.42Å; C217-I257 HydrophobicContact CB-CG1 4.28Å
218	V	96.2	Very high	98	Very high	69 Å²	69	36.8 Å²	36.8	42%	0.418	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.8	167	179.6	0	0	0	0	110.2	R215 L216 F256	R215-V218 WeakPolarHBondContact O-CB 3.4Å; R215-V218 WeakPolarHBondContact O-CG2 3.45Å; R215-V218 PolarHBondContact O-N 3.16Å; L216-V218 PolarHBondContact O-N 3.11Å; L216-V218 VanDerWaalsContact O-N 3.16Å; V218-F256 HydrophobicContact CB-CE1 4.44Å; V218-F256 HydrophobicContact CG1-CE1 4.41Å; V218-F256 HydrophobicContact CG2-CD1 4.48Å; V218-F256 HydrophobicContact CG2-CE1 4.02Å; V218-F256 HydrophobicContact CG2-CE2 4.13Å; V218-F256 HydrophobicContact CG2-CZ 3.82Å
219	N	94.3	Very high	97.9	Very high	39 Å²	39	36.3 Å²	36.3	21%	0.209	18%	0.178	C	C	.	.	S	Bend	trans	-81	144.1	177.6	-170.5	-49	0	0	0	111.3	E183 L186 L216 C217 R221 G222 K223	E183-N219 PolarHBondContact OE1-ND2 2.87Å; L186-N219 HydrophobicContact CD1-CB 4.29Å; L216-N219 PolarHBondContact O-N 2.97Å; L216-N219 VanDerWaalsContact O-N 3.16Å; C217-N219 PolarHBondContact O-N 2.91Å; N219-R221 VanDerWaalsContact C-N 3.33Å; N219-R221 PolarHBondContact O-N 3.27Å; N219-R221 WeakPolarHBondContact OD1-CB 3.39Å; N219-R221 PolarHBondContact OD1-N 3.49Å; N219-G222 PolarHBondContact O-N 3.37Å; N219-K223 WeakPolarHBondContact O-CG 3.3Å; N219-K223 PolarHBondContact O-N 3.38Å; N219-K223 VanDerWaalsContact O-N 3.13Å
220	L	96.4	Very high	97.8	Very high	120 Å²	120	43.6 Å²	43.6	63%	0.628	21%	0.212	S	C	*	.	H	α-helix	trans	-59.3	-41.7	176.4	-178.2	62.2	0	0	0	112.5	G222 K223 Q224 T260	L220-G222 VanDerWaalsContact C-N 3.34Å; L220-G222 PolarHBondContact O-N 2.97Å; L220-K223 WeakPolarHBondContact O-CB 3.45Å; L220-K223 PolarHBondContact O-N 2.95Å; L220-Q224 PolarHBondContact O-N 2.95Å; L220-Q224 VanDerWaalsContact O-N 3.08Å; L220-T260 HydrophobicContact CD1-CG2 4.29Å
221	R	97.6	Very high	97.8	Very high	89 Å²	89	43.6 Å²	43.6	34%	0.336	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-43.4	176.4	178.3	-177.5	165.1	-167.6	0.7	111.1	E183 L186 N187 N219 K223 Q224 E225	E183-R221 IonicContact OE2-CZ 2.78Å; E183-R221 IonicContact OE2-NH1 3.44Å; E183-R221 PolarHBondContact OE2-NH1 3.37Å; L186-R221 HydrophobicContact CD1-CB 3.93Å; L186-R221 HydrophobicContact CD1-CG 3.95Å; L186-R221 PolarHBondContact O-NH2 2.85Å; N187-R221 PolarHBondContact OD1-NH1 2.93Å; N187-R221 PolarHBondContact OD1-NH2 3.29Å; N219-R221 VanDerWaalsContact C-N 3.33Å; N219-R221 PolarHBondContact O-N 3.27Å; N219-R221 WeakPolarHBondContact OD1-CB 3.39Å; N219-R221 PolarHBondContact OD1-N 3.49Å; R221-K223 VanDerWaalsContact C-N 3.32Å; R221-K223 PolarHBondContact O-N 3.41Å; R221-Q224 PolarHBondContact O-N 3.18Å; R221-Q224 VanDerWaalsContact O-N 3.13Å; R221-E225 HydrophobicContact CG-CG 4.47Å; R221-E225 IonicContact CZ-OE1 3.46Å; R221-E225 IonicContact NE-OE1 2.96Å; R221-E225 PolarHBondContact NE-OE1 2.96Å; R221-E225 IonicContact NH2-OE1 3.7Å; R221-E225 PolarHBondContact NH2-OE1 3.3Å; R221-E225 PolarHBondContact O-N 2.69Å
222	G	98.2	Very high	97.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-37.1	175.8	0	0	0	0	0	113.5	N219 L220 A226	N219-G222 PolarHBondContact O-N 3.37Å; L220-G222 VanDerWaalsContact C-N 3.34Å; L220-G222 PolarHBondContact O-N 2.97Å; G222-A226 WeakPolarHBondContact O-CB 3.44Å; G222-A226 PolarHBondContact O-N 2.96Å
223	K	98.3	Very high	97.8	Very high	27 Å²	27	45.8 Å²	45.8	12%	0.117	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-41.2	173.4	-61.9	170.6	-166.8	175.7	0	111.9	C217 N219 L220 R221 A226 L227 F256 T259 T260	C217-K223 HydrophobicContact CB-CG 4.4Å; C217-K223 WeakPolarHBondContact O-CE 3.46Å; C217-K223 VanDerWaalsContact O-CG 3.23Å; C217-K223 WeakPolarHBondContact O-CG 3.23Å; N219-K223 WeakPolarHBondContact O-CG 3.3Å; N219-K223 PolarHBondContact O-N 3.38Å; N219-K223 VanDerWaalsContact O-N 3.13Å; L220-K223 WeakPolarHBondContact O-CB 3.45Å; L220-K223 PolarHBondContact O-N 2.95Å; R221-K223 VanDerWaalsContact C-N 3.32Å; R221-K223 PolarHBondContact O-N 3.41Å; K223-A226 PolarHBondContact O-N 3.31Å; K223-L227 PolarHBondContact O-N 3.19Å; K223-F256 WeakPolarHBondContact CD-O 3.23Å; K223-F256 WeakPolarHBondContact CE-O 3.06Å; K223-T259 PolarHBondContact NZ-OG1 3.23Å; K223-T260 HydrophobicContact CB-CG2 4.42Å; K223-T260 HydrophobicContact CD-CG2 3.96Å
224	Q	98.2	Very high	97.8	Very high	87 Å²	87	46.9 Å²	46.9	41%	0.407	24%	0.237	S	C	.	.	H	α-helix	trans	-67.1	-46.9	177.7	-175.6	57.2	52	0	0	111.2	L220 R221 A226 L227 D228	L220-Q224 PolarHBondContact O-N 2.95Å; L220-Q224 VanDerWaalsContact O-N 3.08Å; R221-Q224 PolarHBondContact O-N 3.18Å; R221-Q224 VanDerWaalsContact O-N 3.13Å; Q224-A226 PolarHBondContact O-N 3.29Å; Q224-L227 WeakPolarHBondContact O-CA 3.5Å; Q224-L227 VanDerWaalsContact O-CB 3.31Å; Q224-L227 WeakPolarHBondContact O-CB 3.39Å; Q224-L227 PolarHBondContact O-N 2.88Å; Q224-D228 PolarHBondContact NE2-OD1 3.47Å; Q224-D228 VanDerWaalsContact O-CG 3.22Å; Q224-D228 PolarHBondContact O-N 3.29Å
225	E	98.4	Very high	97.8	Very high	32 Å²	32	45.4 Å²	45.4	15%	0.15	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-34	176.5	-72.3	-176.3	-156.6	0	0	112	I191 R221 L227 D228 N229	I191-E225 HydrophobicContact CB-CB 4.07Å; I191-E225 HydrophobicContact CG1-CB 4.03Å; I191-E225 HydrophobicContact CG2-CB 4.07Å; R221-E225 HydrophobicContact CG-CG 4.47Å; R221-E225 IonicContact CZ-OE1 3.46Å; R221-E225 IonicContact NE-OE1 2.96Å; R221-E225 PolarHBondContact NE-OE1 2.96Å; R221-E225 IonicContact NH2-OE1 3.7Å; R221-E225 PolarHBondContact NH2-OE1 3.3Å; R221-E225 PolarHBondContact O-N 2.69Å; E225-L227 VanDerWaalsContact C-N 3.3Å; E225-L227 PolarHBondContact O-N 3.31Å; E225-D228 PolarHBondContact O-N 3.02Å; E225-N229 WeakPolarHBondContact O-CB 3.48Å; E225-N229 PolarHBondContact O-N 3.29Å; E225-N229 PolarHBondContact O-ND2 3.17Å
226	A	98.6	Very high	97.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-31.4	175.8	0	0	0	0	0	112.7	I191 G222 K223 Q224 T231 I257	I191-A226 HydrophobicContact CG2-CB 4.27Å; G222-A226 WeakPolarHBondContact O-CB 3.44Å; G222-A226 PolarHBondContact O-N 2.96Å; K223-A226 PolarHBondContact O-N 3.31Å; Q224-A226 PolarHBondContact O-N 3.29Å; A226-T231 WeakPolarHBondContact CA-OG1 3.41Å; A226-T231 HydrophobicContact CB-CG2 4.31Å; A226-T231 WeakPolarHBondContact O-CB 3.28Å; A226-T231 PolarHBondContact O-N 2.97Å; A226-T231 PolarHBondContact O-OG1 2.7Å; A226-T231 VanDerWaalsContact O-OG1 3.13Å; A226-I257 HydrophobicContact CB-CD1 3.88Å; A226-I257 HydrophobicContact CB-CG1 4.3Å
227	L	98.1	Very high	97.8	Very high	22 Å²	22	47 Å²	47	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-44.8	170.4	-75.3	155	0	0	0	110.7	K223 Q224 E225 N229 I232 H262 T266	K223-L227 PolarHBondContact O-N 3.19Å; Q224-L227 WeakPolarHBondContact O-CA 3.5Å; Q224-L227 VanDerWaalsContact O-CB 3.31Å; Q224-L227 WeakPolarHBondContact O-CB 3.39Å; Q224-L227 PolarHBondContact O-N 2.88Å; E225-L227 VanDerWaalsContact C-N 3.3Å; E225-L227 PolarHBondContact O-N 3.31Å; L227-N229 VanDerWaalsContact C-N 3.26Å; L227-N229 PolarHBondContact O-N 3.07Å; L227-I232 HydrophobicContact CD2-CD1 3.42Å; L227-I232 VanDerWaalsContact CD2-CD1 3.42Å; L227-I232 HydrophobicContact CG-CD1 4.14Å; L227-H262 HydrophobicContact CD1-CB 3.93Å; L227-H262 HydrophobicContact CD2-CB 4.41Å; L227-T266 HydrophobicContact CD2-CG2 4.26Å
228	D	97.9	Very high	97.8	Very high	106 Å²	106	47.6 Å²	47.6	57%	0.567	25%	0.25	S	C	*	.	H	α-helix	trans	-69.1	-22.2	-176.3	-58.7	-23.9	0	0	0	113.2	Q224 E225	Q224-D228 PolarHBondContact NE2-OD1 3.47Å; Q224-D228 VanDerWaalsContact O-CG 3.22Å; Q224-D228 PolarHBondContact O-N 3.29Å; E225-D228 PolarHBondContact O-N 3.02Å
229	N	97.9	Very high	97.8	Very high	51 Å²	51	44.3 Å²	44.3	27%	0.273	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	16.6	-177.3	-74.9	-93.7	0	0	0	114.4	I191 S192 T195 E225 L227 T231	I191-N229 HydrophobicContact CG2-CB 4.2Å; S192-N229 WeakPolarHBondContact CA-OD1 3.41Å; S192-N229 WeakPolarHBondContact CB-OD1 3.15Å; S192-N229 PolarHBondContact OG-OD1 3.05Å; T195-N229 WeakPolarHBondContact CG2-O 3.32Å; E225-N229 WeakPolarHBondContact O-CB 3.48Å; E225-N229 PolarHBondContact O-N 3.29Å; E225-N229 PolarHBondContact O-ND2 3.17Å; L227-N229 VanDerWaalsContact C-N 3.26Å; L227-N229 PolarHBondContact O-N 3.07Å; N229-T231 PolarHBondContact O-N 3.32Å; N229-T231 VanDerWaalsContact O-N 3.13Å
230	E	97	Very high	97.9	Very high	154 Å²	154	47 Å²	47	72%	0.72	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	28.6	-178.1	-56.2	-173.4	155.8	0	0	113.9	I232 P233	E230-I232 VanDerWaalsContact C-N 3.29Å; E230-I232 PolarHBondContact O-N 3.26Å; E230-P233 WeakPolarHBondContact O-CD 3.44Å
231	T	98.7	Very high	97.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.2	-33.5	-177.6	-50.3	0	0	0	0	111.7	T195 L198 I213 A226 N229 A234 L235	T195-T231 HydrophobicContact CG2-CG2 4.45Å; T195-T231 PolarHBondContact OG1-OG1 2.76Å; L198-T231 HydrophobicContact CD1-CG2 4.4Å; I213-T231 HydrophobicContact CD1-CG2 3.89Å; I213-T231 HydrophobicContact CG2-CG2 3.85Å; A226-T231 WeakPolarHBondContact CA-OG1 3.41Å; A226-T231 HydrophobicContact CB-CG2 4.31Å; A226-T231 WeakPolarHBondContact O-CB 3.28Å; A226-T231 PolarHBondContact O-N 2.97Å; A226-T231 PolarHBondContact O-OG1 2.7Å; A226-T231 VanDerWaalsContact O-OG1 3.13Å; N229-T231 PolarHBondContact O-N 3.32Å; N229-T231 VanDerWaalsContact O-N 3.13Å; T231-A234 PolarHBondContact O-N 2.68Å; T231-L235 HydrophobicContact CG2-CD1 3.86Å; T231-L235 HydrophobicContact CG2-CG 4.02Å; T231-L235 VanDerWaalsContact O-CG 3.28Å; T231-L235 WeakPolarHBondContact O-CG 3.34Å; T231-L235 PolarHBondContact O-N 2.88Å
232	I	98.7	Very high	97.8	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-55.9	-177.5	-65.5	169.3	0	0	0	111.7	L227 E230 A234 L235 V236 L254 I257 T266 T267 A270	L227-I232 HydrophobicContact CD2-CD1 3.42Å; L227-I232 VanDerWaalsContact CD2-CD1 3.42Å; L227-I232 HydrophobicContact CG-CD1 4.14Å; E230-I232 VanDerWaalsContact C-N 3.29Å; E230-I232 PolarHBondContact O-N 3.26Å; I232-A234 VanDerWaalsContact C-N 3.27Å; I232-A234 PolarHBondContact O-N 3.22Å; I232-L235 PolarHBondContact O-N 2.67Å; I232-L235 VanDerWaalsContact O-N 3.17Å; I232-V236 HydrophobicContact CG2-CG2 4.36Å; I232-V236 WeakPolarHBondContact O-CG2 3.46Å; I232-V236 PolarHBondContact O-N 2.92Å; I232-L254 HydrophobicContact CB-CD2 4.43Å; I232-L254 HydrophobicContact CG1-CD2 4.42Å; I232-L254 HydrophobicContact CG2-CD2 3.94Å; I232-I257 HydrophobicContact CD1-CG2 3.54Å; I232-I257 HydrophobicContact CG1-CD1 4.17Å; I232-I257 HydrophobicContact CG1-CG2 3.88Å; I232-T266 HydrophobicContact CB-CG2 4.18Å; I232-T266 HydrophobicContact CD1-CG2 3.67Å; I232-T266 HydrophobicContact CG2-CG2 4.21Å; I232-T267 WeakPolarHBondContact CG2-OG1 3.27Å; I232-A270 HydrophobicContact CG2-CB 4.34Å
233	P	98.2	Very high	97.7	Very high	60 Å²	60	46 Å²	46	39%	0.39	25%	0.253	S	S	.	.	H	α-helix	trans	-51.2	-45.7	173.9	-28.8	33.1	0	0	0	113.1	E230 L235 V236 T237	E230-P233 WeakPolarHBondContact O-CD 3.44Å; P233-L235 PolarHBondContact O-N 3.45Å; P233-V236 PolarHBondContact O-N 3.49Å; P233-T237 WeakPolarHBondContact O-CG2 3.07Å; P233-T237 PolarHBondContact O-N 3.13Å; P233-T237 VanDerWaalsContact O-N 3.12Å
234	A	98.2	Very high	97.7	Very high	24 Å²	24	48 Å²	48	20%	0.198	26%	0.263	C	S	.	.	H	α-helix	trans	-59.1	-47.6	178.6	0	0	0	0	0	111.9	T195 L198 T231 I232 V236 T237 L238	T195-A234 HydrophobicContact CG2-CB 4.41Å; L198-A234 HydrophobicContact CB-CB 4.31Å; L198-A234 HydrophobicContact CD1-CB 3.67Å; T231-A234 PolarHBondContact O-N 2.68Å; I232-A234 VanDerWaalsContact C-N 3.27Å; I232-A234 PolarHBondContact O-N 3.22Å; A234-V236 VanDerWaalsContact C-N 3.33Å; A234-V236 PolarHBondContact O-N 2.8Å; A234-T237 PolarHBondContact O-N 2.85Å; A234-T237 PolarHBondContact O-OG1 3.29Å; A234-L238 WeakPolarHBondContact O-CG 3.34Å
235	L	98.7	Very high	97.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-36.1	176.3	-67.9	173.7	0	0	0	112.9	L198 I213 T231 I232 P233 L238 A253 L254 I257	L198-L235 HydrophobicContact CD1-CD2 3.67Å; L198-L235 HydrophobicContact CD1-CG 4.02Å; L198-L235 HydrophobicContact CD2-CD2 4.3Å; I213-L235 HydrophobicContact CG2-CD1 4.31Å; T231-L235 HydrophobicContact CG2-CD1 3.86Å; T231-L235 HydrophobicContact CG2-CG 4.02Å; T231-L235 VanDerWaalsContact O-CG 3.28Å; T231-L235 WeakPolarHBondContact O-CG 3.34Å; T231-L235 PolarHBondContact O-N 2.88Å; I232-L235 PolarHBondContact O-N 2.67Å; I232-L235 VanDerWaalsContact O-N 3.17Å; P233-L235 PolarHBondContact O-N 3.45Å; L235-L238 PolarHBondContact O-N 3.32Å; L235-A253 HydrophobicContact CD1-CB 3.72Å; L235-A253 HydrophobicContact CD2-CB 4.5Å; L235-L254 HydrophobicContact CB-CD1 4.32Å; L235-L254 HydrophobicContact CB-CD2 4.05Å; L235-L254 HydrophobicContact CB-CG 4.03Å; L235-L254 HydrophobicContact CD1-CD2 4.16Å; L235-L254 HydrophobicContact CD1-CG 4.22Å; L235-I257 HydrophobicContact CD1-CD1 4.07Å
236	V	98.5	Very high	97.7	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-40.1	178.4	173.2	0	0	0	0	111.2	I232 P233 A234 L238 L239 L254 A270 A272 L275	I232-V236 HydrophobicContact CG2-CG2 4.36Å; I232-V236 WeakPolarHBondContact O-CG2 3.46Å; I232-V236 PolarHBondContact O-N 2.92Å; P233-V236 PolarHBondContact O-N 3.49Å; A234-V236 VanDerWaalsContact C-N 3.33Å; A234-V236 PolarHBondContact O-N 2.8Å; V236-L238 PolarHBondContact O-N 3.02Å; V236-L239 HydrophobicContact CG1-CD1 4.3Å; V236-L239 WeakPolarHBondContact O-CB 3.31Å; V236-L239 WeakPolarHBondContact O-CG 3.46Å; V236-L239 PolarHBondContact O-N 3.48Å; V236-L239 VanDerWaalsContact O-N 3.15Å; V236-L254 HydrophobicContact CG2-CD1 4.06Å; V236-L254 HydrophobicContact CG2-CD2 4.31Å; V236-A270 HydrophobicContact CB-CB 4.42Å; V236-A270 WeakPolarHBondContact CG1-O 3.18Å; V236-A270 HydrophobicContact CG2-CB 4.01Å; V236-A272 HydrophobicContact CG1-CB 4.08Å; V236-A272 HydrophobicContact CG2-CB 3.8Å; V236-L275 HydrophobicContact CG1-CD1 3.87Å; V236-L275 WeakPolarHBondContact O-CD1 3.35Å
237	T	97.1	Very high	97.7	Very high	100 Å²	100	46.8 Å²	46.8	61%	0.613	26%	0.259	S	S	*	.	H	α-helix	trans	-60.1	-28.8	176.1	67.2	0	0	0	0	113.3	P233 A234 L239	P233-T237 WeakPolarHBondContact O-CG2 3.07Å; P233-T237 PolarHBondContact O-N 3.13Å; P233-T237 VanDerWaalsContact O-N 3.12Å; A234-T237 PolarHBondContact O-N 2.85Å; A234-T237 PolarHBondContact O-OG1 3.29Å; T237-L239 VanDerWaalsContact C-N 3.32Å; T237-L239 PolarHBondContact O-N 3Å
238	L	97.9	Very high	97.7	Very high	11 Å²	11	45.8 Å²	45.8	6%	0.058	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-82.8	-7.3	-177.4	-59.7	172.6	0	0	0	113.4	L198 A234 L235 V236 N240 D241 L246	L198-L238 HydrophobicContact CB-CD1 3.99Å; L198-L238 HydrophobicContact CD1-CD1 4.31Å; L198-L238 HydrophobicContact CD2-CD1 3.71Å; L198-L238 HydrophobicContact CG-CD1 4.21Å; A234-L238 WeakPolarHBondContact O-CG 3.34Å; L235-L238 PolarHBondContact O-N 3.32Å; V236-L238 PolarHBondContact O-N 3.02Å; L238-N240 PolarHBondContact O-N 3.3Å; L238-D241 WeakPolarHBondContact O-CB 3.48Å; L238-D241 PolarHBondContact O-N 3.31Å; L238-D241 VanDerWaalsContact O-N 3.07Å; L238-L246 HydrophobicContact CB-CG 4.45Å; L238-L246 HydrophobicContact CD1-CD1 3.98Å; L238-L246 HydrophobicContact CD2-CD2 4.31Å
239	L	97.9	Very high	97.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-63.6	-22.9	178.8	-65.1	-178.4	0	0	0	113.3	V236 T237 K247 T251 L254 L275 L276 L279	V236-L239 HydrophobicContact CG1-CD1 4.3Å; V236-L239 WeakPolarHBondContact O-CB 3.31Å; V236-L239 WeakPolarHBondContact O-CG 3.46Å; V236-L239 PolarHBondContact O-N 3.48Å; V236-L239 VanDerWaalsContact O-N 3.15Å; T237-L239 VanDerWaalsContact C-N 3.32Å; T237-L239 PolarHBondContact O-N 3Å; L239-K247 WeakPolarHBondContact O-CD 3.37Å; L239-T251 HydrophobicContact CD2-CG2 3.33Å; L239-L254 HydrophobicContact CD1-CD1 4.12Å; L239-L254 HydrophobicContact CD2-CD1 4.12Å; L239-L254 HydrophobicContact CG-CD1 4.41Å; L239-L275 HydrophobicContact CB-CB 4.01Å; L239-L275 HydrophobicContact CB-CD1 4.18Å; L239-L275 HydrophobicContact CD1-CB 3.97Å; L239-L275 HydrophobicContact CD1-CD1 4.46Å; L239-L276 HydrophobicContact CD1-CD2 3.98Å; L239-L276 HydrophobicContact CD1-CG 4.07Å; L239-L279 HydrophobicContact CB-CD1 4.14Å; L239-L279 HydrophobicContact CD2-CD1 4.15Å
240	N	94.5	Very high	97.7	Very high	96 Å²	96	39.5 Å²	39.5	51%	0.513	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-96.8	2.8	176.1	-75.5	-22.4	0	0	0	113.8	L238 L275	L238-N240 PolarHBondContact O-N 3.3Å; N240-L275 WeakPolarHBondContact ND2-CD2 2.77Å
241	D	96.5	Very high	97.8	Very high	23 Å²	23	32.1 Å²	32.1	12%	0.123	19%	0.185	C	C	.	.			trans	-64.8	139.4	-179.4	-166.3	-67.4	0	0	0	110.3	R206 L238 N243 L246 K247	R206-D241 IonicContact CZ-OD2 3.93Å; R206-D241 IonicContact NE-OD2 2.63Å; R206-D241 IonicContact NH2-OD2 2.91Å; R206-D241 PolarHBondContact NH2-OD2 2.79Å; L238-D241 WeakPolarHBondContact O-CB 3.48Å; L238-D241 PolarHBondContact O-N 3.31Å; L238-D241 VanDerWaalsContact O-N 3.07Å; D241-N243 PolarHBondContact O-N 3.03Å; D241-N243 VanDerWaalsContact OD1-CB 3.23Å; D241-N243 WeakPolarHBondContact OD1-CB 3.23Å; D241-N243 PolarHBondContact OD1-N 3.43Å; D241-L246 HydrophobicContact CB-CD2 3.96Å; D241-L246 HydrophobicContact CB-CG 4.37Å; D241-L246 VanDerWaalsContact CG-CD2 3.47Å; D241-L246 WeakPolarHBondContact OD2-CD2 3.15Å; D241-K247 WeakPolarHBondContact O-CD 3.29Å; D241-K247 WeakPolarHBondContact O-CE 3.43Å; D241-K247 WeakPolarHBondContact O-CG 3.24Å
242	P	95.9	Very high	97.8	Very high	122 Å²	122	32.4 Å²	32.4	79%	0.792	19%	0.187	S	C	*	.	S	Bend	trans	-63.3	-21.8	177.6	25.2	-36.1	0	0	0	113.6	E244	P242-E244 PolarHBondContact O-N 3.34Å
243	N	97.4	Very high	97.8	Very high	43 Å²	43	32.3 Å²	32.3	23%	0.23	19%	0.187	C	C	.	.			trans	-73.6	121.1	-179.5	-174.7	-72	0	0	0	111.6	T203 D241 D245 L246 K247	T203-N243 HydrophobicContact CG2-CB 3.68Å; D241-N243 PolarHBondContact O-N 3.03Å; D241-N243 VanDerWaalsContact OD1-CB 3.23Å; D241-N243 WeakPolarHBondContact OD1-CB 3.23Å; D241-N243 PolarHBondContact OD1-N 3.43Å; N243-D245 WeakPolarHBondContact OD1-CA 3.5Å; N243-D245 WeakPolarHBondContact OD1-CB 3.44Å; N243-D245 PolarHBondContact OD1-N 2.93Å; N243-L246 HydrophobicContact CB-CB 3.91Å; N243-L246 WeakPolarHBondContact OD1-CB 3.43Å; N243-L246 PolarHBondContact OD1-N 2.79Å; N243-K247 PolarHBondContact O-N 3.45Å; N243-K247 VanDerWaalsContact O-N 3.11Å
244	E	97.4	Very high	97.8	Very high	68 Å²	68	29.5 Å²	29.5	32%	0.318	17%	0.168	S	C	.	.	H	α-helix	trans	-66.7	-40.7	-176.8	-176.9	177.2	138.3	0	0	113	P242 A248 K283 S284 V287	P242-E244 PolarHBondContact O-N 3.34Å; E244-A248 WeakPolarHBondContact O-CB 3.46Å; E244-A248 PolarHBondContact O-N 2.8Å; E244-K283 VanDerWaalsContact OE2-CE 3.29Å; E244-K283 WeakPolarHBondContact OE2-CE 3.37Å; E244-S284 VanDerWaalsContact CG-CB 3.46Å; E244-S284 WeakPolarHBondContact CG-OG 3.45Å; E244-S284 WeakPolarHBondContact OE1-CB 3.1Å; E244-S284 PolarHBondContact OE1-OG 3.15Å; E244-V287 HydrophobicContact CG-CG2 4.27Å
245	D	98	Very high	97.8	Very high	71 Å²	71	28.8 Å²	28.8	38%	0.38	16%	0.164	S	C	.	.	H	α-helix	trans	-65.4	-45.6	178.6	-72	-55.2	0	0	0	111.3	T207 N243 K247 A248 F249 R286	T207-D245 HydrophobicContact CG2-CB 3.67Å; N243-D245 WeakPolarHBondContact OD1-CA 3.5Å; N243-D245 WeakPolarHBondContact OD1-CB 3.44Å; N243-D245 PolarHBondContact OD1-N 2.93Å; D245-K247 PolarHBondContact O-N 2.88Å; D245-A248 PolarHBondContact O-N 3.36Å; D245-F249 HydrophobicContact CB-CD2 4.34Å; D245-F249 HydrophobicContact CB-CE2 3.97Å; D245-F249 WeakPolarHBondContact O-CD2 3.41Å; D245-F249 WeakPolarHBondContact O-CG 3.5Å; D245-F249 PolarHBondContact O-N 3.13Å; D245-R286 IonicContact OD1-CZ 2.99Å; D245-R286 IonicContact OD1-NH1 3.2Å; D245-R286 PolarHBondContact OD1-NH1 3.08Å; D245-R286 IonicContact OD1-NH2 3.28Å; D245-R286 PolarHBondContact OD1-NH2 3.11Å
246	L	98.5	Very high	97.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-47.3	177.1	-177.6	49.5	0	0	0	111.8	T203 R206 A210 L238 D241 N243 A248 F249 S250	T203-L246 HydrophobicContact CG2-CD2 4.22Å; R206-L246 HydrophobicContact CB-CD1 4.08Å; R206-L246 HydrophobicContact CB-CD2 3.92Å; A210-L246 HydrophobicContact CB-CD1 3.88Å; L238-L246 HydrophobicContact CB-CG 4.45Å; L238-L246 HydrophobicContact CD1-CD1 3.98Å; L238-L246 HydrophobicContact CD2-CD2 4.31Å; D241-L246 HydrophobicContact CB-CD2 3.96Å; D241-L246 HydrophobicContact CB-CG 4.37Å; D241-L246 VanDerWaalsContact CG-CD2 3.47Å; D241-L246 WeakPolarHBondContact OD2-CD2 3.15Å; N243-L246 HydrophobicContact CB-CB 3.91Å; N243-L246 WeakPolarHBondContact OD1-CB 3.43Å; N243-L246 PolarHBondContact OD1-N 2.79Å; L246-A248 VanDerWaalsContact C-N 3.35Å; L246-A248 PolarHBondContact O-N 3.08Å; L246-F249 PolarHBondContact O-N 3.5Å; L246-S250 VanDerWaalsContact O-CB 3.26Å; L246-S250 WeakPolarHBondContact O-CB 3.48Å; L246-S250 PolarHBondContact O-N 3.05Å; L246-S250 PolarHBondContact O-OG 3.38Å
247	K	98.1	Very high	97.8	Very high	24 Å²	24	32.1 Å²	32.1	10%	0.104	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-45	173.9	-77	-168.6	-68.2	179.6	0	112	L239 D241 N243 D245 S250 T251 L279 D282 V287	L239-K247 WeakPolarHBondContact O-CD 3.37Å; D241-K247 WeakPolarHBondContact O-CD 3.29Å; D241-K247 WeakPolarHBondContact O-CE 3.43Å; D241-K247 WeakPolarHBondContact O-CG 3.24Å; N243-K247 PolarHBondContact O-N 3.45Å; N243-K247 VanDerWaalsContact O-N 3.11Å; D245-K247 PolarHBondContact O-N 2.88Å; K247-S250 PolarHBondContact O-N 3.2Å; K247-T251 WeakPolarHBondContact O-CB 3.48Å; K247-T251 WeakPolarHBondContact O-CG2 3.45Å; K247-T251 PolarHBondContact O-N 3.32Å; K247-T251 PolarHBondContact O-OG1 3.5Å; K247-L279 HydrophobicContact CD-CD2 3.83Å; K247-D282 IonicContact NZ-OD2 3.77Å; K247-D282 PolarHBondContact NZ-OD2 2.78Å; K247-V287 HydrophobicContact CB-CG1 4.49Å; K247-V287 HydrophobicContact CB-CG2 4.04Å
248	A	98.3	Very high	97.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-66.8	-40.4	-177.6	0	0	0	0	0	112.5	E244 D245 L246 T251 G252 R286 V287 N290	E244-A248 WeakPolarHBondContact O-CB 3.46Å; E244-A248 PolarHBondContact O-N 2.8Å; D245-A248 PolarHBondContact O-N 3.36Å; L246-A248 VanDerWaalsContact C-N 3.35Å; L246-A248 PolarHBondContact O-N 3.08Å; A248-T251 WeakPolarHBondContact CA-OG1 3.21Å; A248-T251 PolarHBondContact O-OG1 3.47Å; A248-G252 PolarHBondContact O-N 3.34Å; A248-R286 HydrophobicContact CB-CB 4.4Å; A248-R286 HydrophobicContact CB-CG 4.13Å; A248-V287 HydrophobicContact CB-CG2 3.82Å; A248-N290 PolarHBondContact O-ND2 3.16Å
249	F	98.7	Very high	97.8	Very high	24 Å²	24	30.2 Å²	30.2	11%	0.105	17%	0.166	C	C	.	.	H	α-helix	trans	-69.9	-40.1	175.5	-63.8	-42.2	0	0	0	111.6	T207 A210 Q211 L214 D245 L246 G252 A253	T207-F249 HydrophobicContact CG2-CD2 3.8Å; T207-F249 HydrophobicContact CG2-CE2 3.76Å; A210-F249 HydrophobicContact CB-CB 3.85Å; Q211-F249 HydrophobicContact CB-CD1 4.36Å; Q211-F249 HydrophobicContact CB-CD2 3.81Å; Q211-F249 HydrophobicContact CB-CE1 4.44Å; Q211-F249 HydrophobicContact CB-CE2 3.9Å; Q211-F249 HydrophobicContact CB-CG 4.06Å; Q211-F249 HydrophobicContact CB-CZ 4.22Å; Q211-F249 HydrophobicContact CG-CD1 4.27Å; Q211-F249 HydrophobicContact CG-CD2 4.33Å; Q211-F249 HydrophobicContact CG-CE1 3.97Å; Q211-F249 HydrophobicContact CG-CE2 4.03Å; Q211-F249 HydrophobicContact CG-CG 4.46Å; Q211-F249 HydrophobicContact CG-CZ 3.84Å; L214-F249 HydrophobicContact CD2-CD1 3.69Å; L214-F249 HydrophobicContact CD2-CE1 4.46Å; D245-F249 HydrophobicContact CB-CD2 4.34Å; D245-F249 HydrophobicContact CB-CE2 3.97Å; D245-F249 WeakPolarHBondContact O-CD2 3.41Å; D245-F249 WeakPolarHBondContact O-CG 3.5Å; D245-F249 PolarHBondContact O-N 3.13Å; L246-F249 PolarHBondContact O-N 3.5Å; F249-G252 PolarHBondContact O-N 3.03Å; F249-A253 WeakPolarHBondContact O-CB 3.38Å; F249-A253 PolarHBondContact O-N 2.89Å
250	S	98.7	Very high	97.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.5	-48.8	178.8	-55.1	0	0	0	0	112.1	L246 K247 G252 A253 L254	L246-S250 VanDerWaalsContact O-CB 3.26Å; L246-S250 WeakPolarHBondContact O-CB 3.48Å; L246-S250 PolarHBondContact O-N 3.05Å; L246-S250 PolarHBondContact O-OG 3.38Å; K247-S250 PolarHBondContact O-N 3.2Å; S250-G252 VanDerWaalsContact C-N 3.31Å; S250-G252 PolarHBondContact O-N 3.29Å; S250-A253 PolarHBondContact O-N 3.09Å; S250-L254 WeakPolarHBondContact O-CG 3.4Å; S250-L254 PolarHBondContact O-N 3.3Å
251	T	98.3	Very high	97.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-39	172.8	49.3	0	0	0	0	112	L239 K247 A248 G255 L276 L279 N290 V294	L239-T251 HydrophobicContact CD2-CG2 3.33Å; K247-T251 WeakPolarHBondContact O-CB 3.48Å; K247-T251 WeakPolarHBondContact O-CG2 3.45Å; K247-T251 PolarHBondContact O-N 3.32Å; K247-T251 PolarHBondContact O-OG1 3.5Å; A248-T251 WeakPolarHBondContact CA-OG1 3.21Å; A248-T251 PolarHBondContact O-OG1 3.47Å; T251-G255 PolarHBondContact O-N 3.39Å; T251-L276 HydrophobicContact CG2-CD2 4.36Å; T251-L279 HydrophobicContact CG2-CD1 3.87Å; T251-N290 VanDerWaalsContact OG1-CB 3.27Å; T251-N290 WeakPolarHBondContact OG1-CB 3.48Å; T251-V294 WeakPolarHBondContact O-CG2 3.46Å
252	G	98.5	Very high	97.9	Very high	5 Å²	5	35.9 Å²	35.9	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-46.1	176.4	0	0	0	0	0	112.3	L214 A248 F249 S250 G255 F256 N290	L214-G252 VanDerWaalsContact CD1-C 3.48Å; A248-G252 PolarHBondContact O-N 3.34Å; F249-G252 PolarHBondContact O-N 3.03Å; S250-G252 VanDerWaalsContact C-N 3.31Å; S250-G252 PolarHBondContact O-N 3.29Å; G252-G255 WeakPolarHBondContact O-CA 3.47Å; G252-G255 PolarHBondContact O-N 2.97Å; G252-G255 VanDerWaalsContact O-N 3.12Å; G252-F256 WeakPolarHBondContact O-CD2 3.47Å; G252-F256 PolarHBondContact O-N 3.28Å; G252-F256 VanDerWaalsContact O-N 3.09Å; G252-N290 WeakPolarHBondContact CA-ND2 3.2Å
253	A	98.7	Very high	98	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-46.5	179.3	0	0	0	0	0	110.7	I213 L214 L235 F249 S250 G255 F256 I257	I213-A253 HydrophobicContact CG2-CB 4.05Å; L214-A253 HydrophobicContact CB-CB 4.15Å; L235-A253 HydrophobicContact CD1-CB 3.72Å; L235-A253 HydrophobicContact CD2-CB 4.5Å; F249-A253 WeakPolarHBondContact O-CB 3.38Å; F249-A253 PolarHBondContact O-N 2.89Å; S250-A253 PolarHBondContact O-N 3.09Å; A253-G255 PolarHBondContact O-N 2.87Å; A253-F256 PolarHBondContact O-N 3Å; A253-F256 VanDerWaalsContact O-N 3.15Å; A253-I257 VanDerWaalsContact O-CG1 3.31Å; A253-I257 WeakPolarHBondContact O-CG1 3.35Å; A253-I257 PolarHBondContact O-N 3.48Å
254	L	98.7	Very high	98.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.2	-39.6	171.6	-70.9	173.5	0	0	0	111.6	I232 L235 V236 L239 S250 F256 I257 C258 T267 V294	I232-L254 HydrophobicContact CB-CD2 4.43Å; I232-L254 HydrophobicContact CG1-CD2 4.42Å; I232-L254 HydrophobicContact CG2-CD2 3.94Å; L235-L254 HydrophobicContact CB-CD1 4.32Å; L235-L254 HydrophobicContact CB-CD2 4.05Å; L235-L254 HydrophobicContact CB-CG 4.03Å; L235-L254 HydrophobicContact CD1-CD2 4.16Å; L235-L254 HydrophobicContact CD1-CG 4.22Å; V236-L254 HydrophobicContact CG2-CD1 4.06Å; V236-L254 HydrophobicContact CG2-CD2 4.31Å; L239-L254 HydrophobicContact CD1-CD1 4.12Å; L239-L254 HydrophobicContact CD2-CD1 4.12Å; L239-L254 HydrophobicContact CG-CD1 4.41Å; S250-L254 WeakPolarHBondContact O-CG 3.4Å; S250-L254 PolarHBondContact O-N 3.3Å; L254-F256 VanDerWaalsContact C-N 3.35Å; L254-F256 PolarHBondContact O-N 3.39Å; L254-I257 PolarHBondContact O-N 3.34Å; L254-C258 VanDerWaalsContact O-CB 3.24Å; L254-C258 WeakPolarHBondContact O-CB 3.45Å; L254-C258 PolarHBondContact O-N 2.98Å; L254-C258 PolarHBondContact O-SG 3.32Å; L254-T267 HydrophobicContact CD2-CG2 4.26Å; L254-V294 HydrophobicContact CB-CG2 3.89Å
255	G	98	Very high	98.1	Very high	10 Å²	10	30.4 Å²	30.4	10%	0.103	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-42.1	177.4	0	0	0	0	0	112.7	T251 G252 A253	T251-G255 PolarHBondContact O-N 3.39Å; G252-G255 WeakPolarHBondContact O-CA 3.47Å; G252-G255 PolarHBondContact O-N 2.97Å; G252-G255 VanDerWaalsContact O-N 3.12Å; A253-G255 PolarHBondContact O-N 2.87Å
256	F	98.3	Very high	98.1	Very high	77 Å²	77	28.7 Å²	28.7	34%	0.338	15%	0.145	S	C	.	.	H	α-helix	trans	-69.2	-43.3	173.6	-83.4	-73.9	0	0	0	112.6	L214 C217 V218 K223 G252 A253 L254 C258 T259	L214-F256 HydrophobicContact CD1-CD2 3.46Å; L214-F256 VanDerWaalsContact CD1-CD2 3.46Å; L214-F256 HydrophobicContact CD1-CE2 3.6Å; C217-F256 HydrophobicContact CB-CB 4.06Å; C217-F256 WeakPolarHBondContact O-CB 3.42Å; V218-F256 HydrophobicContact CB-CE1 4.44Å; V218-F256 HydrophobicContact CG1-CE1 4.41Å; V218-F256 HydrophobicContact CG2-CD1 4.48Å; V218-F256 HydrophobicContact CG2-CE1 4.02Å; V218-F256 HydrophobicContact CG2-CE2 4.13Å; V218-F256 HydrophobicContact CG2-CZ 3.82Å; K223-F256 WeakPolarHBondContact CD-O 3.23Å; K223-F256 WeakPolarHBondContact CE-O 3.06Å; G252-F256 WeakPolarHBondContact O-CD2 3.47Å; G252-F256 PolarHBondContact O-N 3.28Å; G252-F256 VanDerWaalsContact O-N 3.09Å; A253-F256 PolarHBondContact O-N 3Å; A253-F256 VanDerWaalsContact O-N 3.15Å; L254-F256 VanDerWaalsContact C-N 3.35Å; L254-F256 PolarHBondContact O-N 3.39Å; F256-C258 PolarHBondContact O-N 3.33Å; F256-T259 WeakPolarHBondContact O-CB 3.47Å; F256-T259 WeakPolarHBondContact O-CG2 3.38Å; F256-T259 PolarHBondContact O-N 2.96Å; F256-T259 PolarHBondContact O-OG1 3.5Å
257	I	98.6	Very high	98.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-42.3	-179.9	-66.5	163.7	0	0	0	111	C217 A226 I232 L235 A253 L254 T259 T260	C217-I257 HydrophobicContact CB-CG1 4.28Å; A226-I257 HydrophobicContact CB-CD1 3.88Å; A226-I257 HydrophobicContact CB-CG1 4.3Å; I232-I257 HydrophobicContact CD1-CG2 3.54Å; I232-I257 HydrophobicContact CG1-CD1 4.17Å; I232-I257 HydrophobicContact CG1-CG2 3.88Å; L235-I257 HydrophobicContact CD1-CD1 4.07Å; A253-I257 VanDerWaalsContact O-CG1 3.31Å; A253-I257 WeakPolarHBondContact O-CG1 3.35Å; A253-I257 PolarHBondContact O-N 3.48Å; L254-I257 PolarHBondContact O-N 3.34Å; I257-T259 PolarHBondContact O-N 3.33Å; I257-T260 PolarHBondContact O-N 3.28Å; I257-T260 PolarHBondContact O-OG1 3.39Å
258	C	98.2	Very high	98	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-1.2	178.1	-69.2	0	0	0	0	114.3	L254 F256 T260 R264 T267 C297	L254-C258 VanDerWaalsContact O-CB 3.24Å; L254-C258 WeakPolarHBondContact O-CB 3.45Å; L254-C258 PolarHBondContact O-N 2.98Å; L254-C258 PolarHBondContact O-SG 3.32Å; F256-C258 PolarHBondContact O-N 3.33Å; C258-T260 PolarHBondContact O-N 3.43Å; C258-R264 HydrophobicContact CB-CG 4.2Å; C258-R264 WeakPolarHBondContact O-CG 3.23Å; C258-R264 PolarHBondContact O-NE 3.02Å; C258-T267 PolarHBondContact SG-OG1 3.47Å; C258-C297 HydrophobicContact CB-CB 3.55Å; C258-C297 WeakPolarHBondContact O-CB 3.44Å
259	T	97.3	Very high	98	Very high	70 Å²	70	34.4 Å²	34.4	43%	0.429	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.1	165.7	62.5	0	0	0	0	112.5	K223 F256 I257	K223-T259 PolarHBondContact NZ-OG1 3.23Å; F256-T259 WeakPolarHBondContact O-CB 3.47Å; F256-T259 WeakPolarHBondContact O-CG2 3.38Å; F256-T259 PolarHBondContact O-N 2.96Å; F256-T259 PolarHBondContact O-OG1 3.5Å; I257-T259 PolarHBondContact O-N 3.33Å
260	T	97.3	Very high	97.9	Very high	29 Å²	29	34.6 Å²	34.6	18%	0.178	18%	0.182	C	C	.	.	S	Bend	trans	-100.7	148.7	174.6	69.6	0	0	0	0	111	L220 K223 I257 C258 H262 G263 R264	L220-T260 HydrophobicContact CD1-CG2 4.29Å; K223-T260 HydrophobicContact CB-CG2 4.42Å; K223-T260 HydrophobicContact CD-CG2 3.96Å; I257-T260 PolarHBondContact O-N 3.28Å; I257-T260 PolarHBondContact O-OG1 3.39Å; C258-T260 PolarHBondContact O-N 3.43Å; T260-H262 PolarHBondContact O-N 3.47Å; T260-G263 PolarHBondContact O-N 3.03Å; T260-G263 WeakPolarHBondContact OG1-CA 3.47Å; T260-G263 PolarHBondContact OG1-N 2.74Å; T260-R264 WeakPolarHBondContact O-CG 3.39Å; T260-R264 PolarHBondContact O-N 3.21Å
261	N	96.8	Very high	97.8	Very high	107 Å²	107	42 Å²	42	57%	0.572	22%	0.217	S	C	*	.	H	α-helix	trans	-60.9	-44.8	176.3	-74.3	-17.6	0	0	0	112	G263 R264 Y265	N261-G263 VanDerWaalsContact C-N 3.34Å; N261-G263 PolarHBondContact O-N 3.08Å; N261-R264 PolarHBondContact O-N 2.65Å; N261-R264 PolarHBondContact OD1-NH1 2.71Å; N261-Y265 VanDerWaalsContact O-CD2 3.3Å; N261-Y265 WeakPolarHBondContact O-CD2 3.38Å; N261-Y265 PolarHBondContact O-N 3Å; N261-Y265 VanDerWaalsContact O-N 3.14Å
262	H	96.9	Very high	97.8	Very high	103 Å²	103	42 Å²	42	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-44.7	177.4	-168.7	-168.6	0	0	0	111	L227 T260 R264 Y265 T266	L227-H262 HydrophobicContact CD1-CB 3.93Å; L227-H262 HydrophobicContact CD2-CB 4.41Å; T260-H262 PolarHBondContact O-N 3.47Å; H262-R264 VanDerWaalsContact C-N 3.34Å; H262-R264 PolarHBondContact O-N 3.22Å; H262-Y265 PolarHBondContact O-N 2.93Å; H262-T266 PolarHBondContact CD2-OG1 3.14Å; H262-T266 VanDerWaalsContact CD2-OG1 3.29Å; H262-T266 WeakPolarHBondContact O-CB 2.85Å; H262-T266 PolarHBondContact O-N 3.1Å; H262-T266 PolarHBondContact O-OG1 2.99Å
263	G	98.2	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.6	-42.4	174	0	0	0	0	0	114.2	T260 N261 T267	T260-G263 PolarHBondContact O-N 3.03Å; T260-G263 WeakPolarHBondContact OG1-CA 3.47Å; T260-G263 PolarHBondContact OG1-N 2.74Å; N261-G263 VanDerWaalsContact C-N 3.34Å; N261-G263 PolarHBondContact O-N 3.08Å; G263-T267 VanDerWaalsContact O-CB 3.27Å; G263-T267 WeakPolarHBondContact O-CB 3.09Å; G263-T267 PolarHBondContact O-N 2.88Å; G263-T267 PolarHBondContact O-OG1 2.58Å
264	R	98	Very high	97.5	Very high	27 Å²	27	45.4 Å²	45.4	10%	0.102	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-52.1	177.8	-67	164.3	-167	176.7	-18.2	111.7	C258 T260 N261 H262 T266 T267 L268 C297 L298 E300 T301	C258-R264 HydrophobicContact CB-CG 4.2Å; C258-R264 WeakPolarHBondContact O-CG 3.23Å; C258-R264 PolarHBondContact O-NE 3.02Å; T260-R264 WeakPolarHBondContact O-CG 3.39Å; T260-R264 PolarHBondContact O-N 3.21Å; N261-R264 PolarHBondContact O-N 2.65Å; N261-R264 PolarHBondContact OD1-NH1 2.71Å; H262-R264 VanDerWaalsContact C-N 3.34Å; H262-R264 PolarHBondContact O-N 3.22Å; R264-T266 PolarHBondContact O-N 2.88Å; R264-T267 PolarHBondContact O-N 3.28Å; R264-L268 WeakPolarHBondContact O-CB 3.26Å; R264-L268 PolarHBondContact O-N 3.42Å; R264-C297 WeakPolarHBondContact CD-O 3.35Å; R264-C297 HydrophobicContact CG-CB 4.42Å; R264-L298 HydrophobicContact CB-CD2 4.33Å; R264-L298 WeakPolarHBondContact O-CD2 3.27Å; R264-E300 IonicContact CZ-OE2 3.02Å; R264-E300 IonicContact NH1-OE2 2.89Å; R264-E300 PolarHBondContact NH1-OE2 3.29Å; R264-E300 IonicContact NH2-OE1 3.27Å; R264-E300 PolarHBondContact NH2-OE1 2.97Å; R264-E300 IonicContact NH2-OE2 2.69Å; R264-E300 PolarHBondContact NH2-OE2 2.96Å; R264-T301 HydrophobicContact CB-CG2 3.77Å
265	Y	98	Very high	97.4	Very high	90 Å²	90	47 Å²	47	35%	0.353	25%	0.246	S	C	.	.	H	α-helix	trans	-64.4	-40.9	-178.9	-78.8	-72.7	0	0	0	111.9	N261 H262 L268 N269 T301 E303	N261-Y265 VanDerWaalsContact O-CD2 3.3Å; N261-Y265 WeakPolarHBondContact O-CD2 3.38Å; N261-Y265 PolarHBondContact O-N 3Å; N261-Y265 VanDerWaalsContact O-N 3.14Å; H262-Y265 PolarHBondContact O-N 2.93Å; Y265-L268 PolarHBondContact O-N 3.28Å; Y265-N269 WeakPolarHBondContact O-CB 3.48Å; Y265-N269 PolarHBondContact O-N 3.27Å; Y265-N269 PolarHBondContact O-ND2 3.5Å; Y265-T301 HydrophobicContact CE1-CG2 4.37Å; Y265-T301 HydrophobicContact CE2-CG2 4.22Å; Y265-E303 WeakPolarHBondContact CE1-OE2 3.45Å
266	T	98	Very high	97.4	Very high	36 Å²	36	46.5 Å²	46.5	22%	0.221	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-38.6	177.1	-53.7	0	0	0	0	112	L227 I232 H262 R264 N269 A270	L227-T266 HydrophobicContact CD2-CG2 4.26Å; I232-T266 HydrophobicContact CB-CG2 4.18Å; I232-T266 HydrophobicContact CD1-CG2 3.67Å; I232-T266 HydrophobicContact CG2-CG2 4.21Å; H262-T266 PolarHBondContact CD2-OG1 3.14Å; H262-T266 VanDerWaalsContact CD2-OG1 3.29Å; H262-T266 WeakPolarHBondContact O-CB 2.85Å; H262-T266 PolarHBondContact O-N 3.1Å; H262-T266 PolarHBondContact O-OG1 2.99Å; R264-T266 PolarHBondContact O-N 2.88Å; T266-N269 PolarHBondContact O-N 3.4Å; T266-A270 WeakPolarHBondContact O-CB 3.22Å; T266-A270 PolarHBondContact O-N 3.29Å
267	T	98.5	Very high	97.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.5	-36.9	175.2	-57.3	0	0	0	0	111.9	I232 L254 C258 G263 R264 A270 A272 V294 L298	I232-T267 WeakPolarHBondContact CG2-OG1 3.27Å; L254-T267 HydrophobicContact CD2-CG2 4.26Å; C258-T267 PolarHBondContact SG-OG1 3.47Å; G263-T267 VanDerWaalsContact O-CB 3.27Å; G263-T267 WeakPolarHBondContact O-CB 3.09Å; G263-T267 PolarHBondContact O-N 2.88Å; G263-T267 PolarHBondContact O-OG1 2.58Å; R264-T267 PolarHBondContact O-N 3.28Å; T267-A270 PolarHBondContact O-N 3.48Å; T267-A272 HydrophobicContact CG2-CB 3.62Å; T267-A272 VanDerWaalsContact O-CB 3.3Å; T267-A272 WeakPolarHBondContact O-CB 3.37Å; T267-A272 PolarHBondContact O-N 3.39Å; T267-V294 HydrophobicContact CG2-CG1 4.41Å; T267-L298 HydrophobicContact CG2-CD1 4.28Å; T267-L298 HydrophobicContact CG2-CD2 4.14Å
268	L	97.1	Very high	97	Very high	20 Å²	20	47.9 Å²	47.9	11%	0.105	25%	0.252	C	S	.	.	H	α-helix	trans	-65.1	-46.7	174.1	-174.8	68	0	0	0	111.6	R264 Y265 A270 E271 I273 E303 I307	R264-L268 WeakPolarHBondContact O-CB 3.26Å; R264-L268 PolarHBondContact O-N 3.42Å; Y265-L268 PolarHBondContact O-N 3.28Å; L268-A270 PolarHBondContact O-N 3.28Å; L268-E271 PolarHBondContact O-N 2.72Å; L268-I273 HydrophobicContact CD1-CD1 3.39Å; L268-I273 HydrophobicContact CD1-CG1 4.12Å; L268-E303 HydrophobicContact CD2-CB 3.54Å; L268-I307 HydrophobicContact CD1-CD1 4.05Å
269	N	97.1	Very high	96.9	Very high	124 Å²	124	48.2 Å²	48.2	66%	0.663	25%	0.254	S	S	*	.	H	α-helix	trans	-66.1	-23.3	178.6	-68.8	-16.3	0	0	0	112.7	Y265 T266 E271	Y265-N269 WeakPolarHBondContact O-CB 3.48Å; Y265-N269 PolarHBondContact O-N 3.27Å; Y265-N269 PolarHBondContact O-ND2 3.5Å; T266-N269 PolarHBondContact O-N 3.4Å; N269-E271 PolarHBondContact O-N 2.86Å
270	A	97.6	Very high	96.7	Very high	28 Å²	28	45 Å²	45	23%	0.231	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	10.3	171.8	0	0	0	0	0	113.6	I232 V236 T266 T267 L268 A272	I232-A270 HydrophobicContact CG2-CB 4.34Å; V236-A270 HydrophobicContact CB-CB 4.42Å; V236-A270 WeakPolarHBondContact CG1-O 3.18Å; V236-A270 HydrophobicContact CG2-CB 4.01Å; T266-A270 WeakPolarHBondContact O-CB 3.22Å; T266-A270 PolarHBondContact O-N 3.29Å; T267-A270 PolarHBondContact O-N 3.48Å; L268-A270 PolarHBondContact O-N 3.28Å; A270-A272 VanDerWaalsContact C-N 3.3Å; A270-A272 PolarHBondContact O-N 3.42Å
271	E	96.4	Very high	96.4	Very high	156 Å²	156	50.4 Å²	50.4	73%	0.729	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	36.8	177.9	-58.6	-173.5	-114.9	0	0	113.8	L268 N269 I273 P274	L268-E271 PolarHBondContact O-N 2.72Å; N269-E271 PolarHBondContact O-N 2.86Å; E271-I273 PolarHBondContact O-N 3.21Å; E271-P274 WeakPolarHBondContact O-CD 3.35Å
272	A	97.8	Very high	96.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-27.1	-176.1	0	0	0	0	0	114.3	V236 T267 A270 L275 L276	V236-A272 HydrophobicContact CG1-CB 4.08Å; V236-A272 HydrophobicContact CG2-CB 3.8Å; T267-A272 HydrophobicContact CG2-CB 3.62Å; T267-A272 VanDerWaalsContact O-CB 3.3Å; T267-A272 WeakPolarHBondContact O-CB 3.37Å; T267-A272 PolarHBondContact O-N 3.39Å; A270-A272 VanDerWaalsContact C-N 3.3Å; A270-A272 PolarHBondContact O-N 3.42Å; A272-L275 PolarHBondContact O-N 3.08Å; A272-L276 HydrophobicContact CB-CD1 3.89Å; A272-L276 HydrophobicContact CB-CG 4.45Å; A272-L276 VanDerWaalsContact O-CG 3.27Å; A272-L276 WeakPolarHBondContact O-CG 3.38Å; A272-L276 PolarHBondContact O-N 2.99Å
273	I	96.1	Very high	96.2	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-57.8	-51.5	-170.5	-69.5	177.2	0	0	0	112.9	L268 E271 L275 L276 L277 L298 I307 L308	L268-I273 HydrophobicContact CD1-CD1 3.39Å; L268-I273 HydrophobicContact CD1-CG1 4.12Å; E271-I273 PolarHBondContact O-N 3.21Å; I273-L275 VanDerWaalsContact C-N 3.25Å; I273-L275 PolarHBondContact O-N 3.01Å; I273-L276 PolarHBondContact O-N 3.3Å; I273-L277 HydrophobicContact CG2-CD1 3.71Å; I273-L277 HydrophobicContact CG2-CG 4.05Å; I273-L277 WeakPolarHBondContact O-CB 3.37Å; I273-L277 VanDerWaalsContact O-CG 3.32Å; I273-L277 WeakPolarHBondContact O-CG 3.48Å; I273-L277 PolarHBondContact O-N 2.99Å; I273-L298 HydrophobicContact CG1-CD1 3.89Å; I273-I307 HydrophobicContact CB-CG2 4.39Å; I273-I307 HydrophobicContact CD1-CB 3.97Å; I273-I307 HydrophobicContact CD1-CD1 4.13Å; I273-I307 HydrophobicContact CD1-CG2 3.87Å; I273-I307 HydrophobicContact CG2-CG2 3.82Å; I273-L308 HydrophobicContact CD1-CD2 4.39Å; I273-L308 HydrophobicContact CD1-CG 4.22Å; I273-L308 HydrophobicContact CG2-CD2 3.75Å
274	P	95	Very high	96.1	Very high	72 Å²	72	49.6 Å²	49.6	47%	0.468	25%	0.253	S	S	.	.	H	α-helix	trans	-56.4	-38.7	178.4	-27.3	35.9	0	0	0	113.5	E271 N278	E271-P274 WeakPolarHBondContact O-CD 3.35Å; P274-N278 PolarHBondContact O-N 3.47Å; P274-N278 PolarHBondContact O-ND2 3.25Å
275	L	96.8	Very high	95.9	Very high	32 Å²	32	51.9 Å²	51.9	17%	0.168	27%	0.273	C	S	.	.	H	α-helix	trans	-69.1	-45.8	178.4	-55.8	-169.8	0	0	0	111.2	V236 L239 N240 A272 I273 L277 N278 L279	V236-L275 HydrophobicContact CG1-CD1 3.87Å; V236-L275 WeakPolarHBondContact O-CD1 3.35Å; L239-L275 HydrophobicContact CB-CB 4.01Å; L239-L275 HydrophobicContact CB-CD1 4.18Å; L239-L275 HydrophobicContact CD1-CB 3.97Å; L239-L275 HydrophobicContact CD1-CD1 4.46Å; N240-L275 WeakPolarHBondContact ND2-CD2 2.77Å; A272-L275 PolarHBondContact O-N 3.08Å; I273-L275 VanDerWaalsContact C-N 3.25Å; I273-L275 PolarHBondContact O-N 3.01Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 3.34Å; L275-N278 WeakPolarHBondContact O-CB 3.2Å; L275-N278 PolarHBondContact O-N 2.91Å; L275-N278 VanDerWaalsContact O-N 3.09Å; L275-L279 WeakPolarHBondContact O-CG 3.47Å; L275-L279 PolarHBondContact O-N 3.29Å
276	L	96.9	Very high	95.8	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-39.1	176.6	-68.3	165.2	0	0	0	111.8	L239 T251 A272 I273 N278 L279 V280 T291 V294 L295 L298	L239-L276 HydrophobicContact CD1-CD2 3.98Å; L239-L276 HydrophobicContact CD1-CG 4.07Å; T251-L276 HydrophobicContact CG2-CD2 4.36Å; A272-L276 HydrophobicContact CB-CD1 3.89Å; A272-L276 HydrophobicContact CB-CG 4.45Å; A272-L276 VanDerWaalsContact O-CG 3.27Å; A272-L276 WeakPolarHBondContact O-CG 3.38Å; A272-L276 PolarHBondContact O-N 2.99Å; I273-L276 PolarHBondContact O-N 3.3Å; L276-N278 PolarHBondContact O-N 3.03Å; L276-L279 PolarHBondContact O-N 2.87Å; L276-V280 PolarHBondContact O-N 2.84Å; L276-T291 HydrophobicContact CB-CG2 4.18Å; L276-T291 HydrophobicContact CD2-CG2 4.21Å; L276-T291 WeakPolarHBondContact O-CG2 3.4Å; L276-V294 HydrophobicContact CD1-CB 4.2Å; L276-V294 HydrophobicContact CD1-CG1 3.47Å; L276-V294 VanDerWaalsContact CD1-CG1 3.47Å; L276-V294 HydrophobicContact CD2-CB 4.15Å; L276-V294 HydrophobicContact CD2-CG1 4.12Å; L276-V294 HydrophobicContact CG-CG1 4.46Å; L276-L295 HydrophobicContact CB-CD2 3.71Å; L276-L295 HydrophobicContact CB-CG 4.11Å; L276-L295 HydrophobicContact CD1-CD2 4.05Å; L276-L298 HydrophobicContact CD1-CD1 3.8Å
277	L	94.9	Very high	95.8	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-23.2	176.1	-72.4	174.8	0	0	0	113.2	I273 L275 L279 V280 L295 L308 H311 V315	I273-L277 HydrophobicContact CG2-CD1 3.71Å; I273-L277 HydrophobicContact CG2-CG 4.05Å; I273-L277 WeakPolarHBondContact O-CB 3.37Å; I273-L277 VanDerWaalsContact O-CG 3.32Å; I273-L277 WeakPolarHBondContact O-CG 3.48Å; I273-L277 PolarHBondContact O-N 2.99Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 3.34Å; L277-L279 VanDerWaalsContact C-N 3.32Å; L277-V280 VanDerWaalsContact O-CG2 3.31Å; L277-V280 WeakPolarHBondContact O-CG2 3.31Å; L277-L295 HydrophobicContact CD2-CD1 4.5Å; L277-L308 HydrophobicContact CD2-CD2 4.29Å; L277-H311 HydrophobicContact CD1-CB 3.75Å; L277-H311 VanDerWaalsContact CD1-CD2 3.48Å; L277-H311 WeakPolarHBondContact CD1-CD2 3.21Å; L277-H311 VanDerWaalsContact CD1-CG 3.43Å; L277-H311 HydrophobicContact CD2-CB 4.23Å; L277-V315 HydrophobicContact CD2-CG1 3.44Å; L277-V315 VanDerWaalsContact CD2-CG1 3.44Å
278	N	94.4	Very high	95.7	Very high	100 Å²	100	54.4 Å²	54.4	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-79.1	-18	172.1	-66.4	-24.4	0	0	0	112.6	P274 L275 L276	P274-N278 PolarHBondContact O-N 3.47Å; P274-N278 PolarHBondContact O-ND2 3.25Å; L275-N278 WeakPolarHBondContact O-CB 3.2Å; L275-N278 PolarHBondContact O-N 2.91Å; L275-N278 VanDerWaalsContact O-N 3.09Å; L276-N278 PolarHBondContact O-N 3.03Å
279	L	95.6	Very high	95.5	Very high	7 Å²	7	57.1 Å²	57.1	4%	0.037	30%	0.295	C	S	.	.	S	Bend	trans	-95.9	-2.4	-177.6	-61.3	-178.8	0	0	0	113.8	L239 K247 T251 L275 L276 L277 D281 D282 V287 T291	L239-L279 HydrophobicContact CB-CD1 4.14Å; L239-L279 HydrophobicContact CD2-CD1 4.15Å; K247-L279 HydrophobicContact CD-CD2 3.83Å; T251-L279 HydrophobicContact CG2-CD1 3.87Å; L275-L279 WeakPolarHBondContact O-CG 3.47Å; L275-L279 PolarHBondContact O-N 3.29Å; L276-L279 PolarHBondContact O-N 2.87Å; L277-L279 VanDerWaalsContact C-N 3.32Å; L279-D281 PolarHBondContact O-N 3Å; L279-D282 WeakPolarHBondContact O-CB 3.46Å; L279-D282 PolarHBondContact O-N 2.87Å; L279-V287 HydrophobicContact CB-CG1 4.08Å; L279-V287 HydrophobicContact CD1-CG1 4.15Å; L279-V287 HydrophobicContact CD2-CG1 4.26Å; L279-V287 HydrophobicContact CG-CG1 4.4Å; L279-T291 HydrophobicContact CB-CG2 3.93Å; L279-T291 WeakPolarHBondContact CB-OG1 3.42Å
280	V	93.3	Very high	95.5	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.018	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-31.2	179.7	-59.5	0	0	0	0	112.3	L276 L277 R288 T291 F292 L295 V315	L276-V280 PolarHBondContact O-N 2.84Å; L277-V280 VanDerWaalsContact O-CG2 3.31Å; L277-V280 WeakPolarHBondContact O-CG2 3.31Å; V280-R288 WeakPolarHBondContact O-CD 3.46Å; V280-R288 WeakPolarHBondContact O-CG 3.4Å; V280-T291 HydrophobicContact CG1-CG2 4.16Å; V280-F292 HydrophobicContact CB-CE1 3.9Å; V280-F292 HydrophobicContact CB-CZ 4.11Å; V280-F292 HydrophobicContact CG1-CD1 4.5Å; V280-F292 HydrophobicContact CG1-CE1 3.88Å; V280-L295 HydrophobicContact CG1-CD1 3.79Å; V280-V315 HydrophobicContact CG1-CG1 4.42Å
281	D	91.2	Very high	95.5	Very high	142 Å²	142	50.9 Å²	50.9	76%	0.759	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	19.3	178	-62.4	-44.3	0	0	0	112.2	L279	L279-D281 PolarHBondContact O-N 3Å
282	D	94.4	Very high	95.4	Very high	16 Å²	16	45.4 Å²	45.4	9%	0.086	23%	0.232	C	C	.	.			trans	-57.2	142.7	177.5	-167.8	-77.9	0	0	0	110.6	K247 L279 S284 V287 R288	K247-D282 IonicContact NZ-OD2 3.77Å; K247-D282 PolarHBondContact NZ-OD2 2.78Å; L279-D282 WeakPolarHBondContact O-CB 3.46Å; L279-D282 PolarHBondContact O-N 2.87Å; D282-S284 PolarHBondContact O-N 3.47Å; D282-S284 VanDerWaalsContact O-N 3.13Å; D282-S284 VanDerWaalsContact OD1-CB 3.28Å; D282-S284 WeakPolarHBondContact OD1-CB 3.05Å; D282-S284 PolarHBondContact OD1-N 2.99Å; D282-V287 HydrophobicContact CB-CB 4.13Å; D282-V287 HydrophobicContact CB-CG1 3.82Å; D282-R288 HydrophobicContact CB-CG 4.18Å; D282-R288 WeakPolarHBondContact O-CD 3.47Å; D282-R288 VanDerWaalsContact O-CG 3.27Å; D282-R288 WeakPolarHBondContact O-CG 3.42Å; D282-R288 PolarHBondContact O-NH1 3.1Å
283	K	94.6	Very high	95.3	Very high	170 Å²	170	50.8 Å²	50.8	74%	0.739	26%	0.256	S	S	*	.	S	Bend	trans	-56.1	-31.8	178.8	64.1	-179.7	-177.2	175.7	0	112.6	E244 R288	E244-K283 VanDerWaalsContact OE2-CE 3.29Å; E244-K283 WeakPolarHBondContact OE2-CE 3.37Å; K283-R288 PolarHBondContact O-NH1 2.94Å
284	S	95.6	Very high	95.3	Very high	7 Å²	7	50.6 Å²	50.6	5%	0.049	25%	0.254	C	S	.	.			trans	-81.5	121.3	-177.8	-170	0	0	0	0	112.3	E244 D282 R286 V287 R288	E244-S284 VanDerWaalsContact CG-CB 3.46Å; E244-S284 WeakPolarHBondContact CG-OG 3.45Å; E244-S284 WeakPolarHBondContact OE1-CB 3.1Å; E244-S284 PolarHBondContact OE1-OG 3.15Å; D282-S284 PolarHBondContact O-N 3.47Å; D282-S284 VanDerWaalsContact O-N 3.13Å; D282-S284 VanDerWaalsContact OD1-CB 3.28Å; D282-S284 WeakPolarHBondContact OD1-CB 3.05Å; D282-S284 PolarHBondContact OD1-N 2.99Å; S284-R286 PolarHBondContact O-N 3.18Å; S284-V287 PolarHBondContact O-N 3.42Å; S284-R288 WeakPolarHBondContact O-CG 3.46Å; S284-R288 PolarHBondContact O-N 3.49Å
285	S	95.4	Very high	95.4	Very high	75 Å²	75	47.2 Å²	47.2	52%	0.524	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-34.8	173.9	57.4	0	0	0	0	112.3	R288 V289	S285-R288 PolarHBondContact O-N 2.89Å; S285-V289 WeakPolarHBondContact O-CB 3.45Å; S285-V289 VanDerWaalsContact O-CG2 3.29Å; S285-V289 WeakPolarHBondContact O-CG2 3.39Å; S285-V289 PolarHBondContact O-N 3.37Å
286	R	96	Very high	95.2	Very high	94 Å²	94	47.6 Å²	47.6	36%	0.355	24%	0.236	S	C	.	.	H	α-helix	trans	-68.7	-41.6	179.7	-164.7	177.9	61.6	-166.6	-7.4	111.7	D245 A248 S284 N290	D245-R286 IonicContact OD1-CZ 2.99Å; D245-R286 IonicContact OD1-NH1 3.2Å; D245-R286 PolarHBondContact OD1-NH1 3.08Å; D245-R286 IonicContact OD1-NH2 3.28Å; D245-R286 PolarHBondContact OD1-NH2 3.11Å; A248-R286 HydrophobicContact CB-CB 4.4Å; A248-R286 HydrophobicContact CB-CG 4.13Å; S284-R286 PolarHBondContact O-N 3.18Å; R286-N290 WeakPolarHBondContact O-CB 3.49Å; R286-N290 PolarHBondContact O-N 3.02Å; R286-N290 VanDerWaalsContact O-N 3.14Å
287	V	97.1	Very high	95.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-52.3	173.1	177.7	0	0	0	0	109.6	E244 K247 A248 L279 D282 S284 V289 N290 T291	E244-V287 HydrophobicContact CG-CG2 4.27Å; K247-V287 HydrophobicContact CB-CG1 4.49Å; K247-V287 HydrophobicContact CB-CG2 4.04Å; A248-V287 HydrophobicContact CB-CG2 3.82Å; L279-V287 HydrophobicContact CB-CG1 4.08Å; L279-V287 HydrophobicContact CD1-CG1 4.15Å; L279-V287 HydrophobicContact CD2-CG1 4.26Å; L279-V287 HydrophobicContact CG-CG1 4.4Å; D282-V287 HydrophobicContact CB-CB 4.13Å; D282-V287 HydrophobicContact CB-CG1 3.82Å; S284-V287 PolarHBondContact O-N 3.42Å; V287-V289 PolarHBondContact O-N 2.84Å; V287-N290 PolarHBondContact O-N 3.27Å; V287-N290 VanDerWaalsContact O-N 3.15Å; V287-T291 WeakPolarHBondContact O-CB 3.22Å; V287-T291 PolarHBondContact O-N 3.24Å; V287-T291 PolarHBondContact O-OG1 3.37Å
288	R	95.4	Very high	95.3	Very high	85 Å²	85	48 Å²	48	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-54.7	-50.2	-180	-66.4	-166.3	-54.2	-86.1	6.1	112.5	V280 D282 K283 S284 S285 N290 T291 F292	V280-R288 WeakPolarHBondContact O-CD 3.46Å; V280-R288 WeakPolarHBondContact O-CG 3.4Å; D282-R288 HydrophobicContact CB-CG 4.18Å; D282-R288 WeakPolarHBondContact O-CD 3.47Å; D282-R288 VanDerWaalsContact O-CG 3.27Å; D282-R288 WeakPolarHBondContact O-CG 3.42Å; D282-R288 PolarHBondContact O-NH1 3.1Å; K283-R288 PolarHBondContact O-NH1 2.94Å; S284-R288 WeakPolarHBondContact O-CG 3.46Å; S284-R288 PolarHBondContact O-N 3.49Å; S285-R288 PolarHBondContact O-N 2.89Å; R288-N290 VanDerWaalsContact C-N 3.32Å; R288-N290 PolarHBondContact O-N 2.98Å; R288-T291 WeakPolarHBondContact O-CB 3.49Å; R288-T291 PolarHBondContact O-N 3.26Å; R288-F292 HydrophobicContact CB-CD2 4.4Å; R288-F292 HydrophobicContact CB-CE2 4.13Å; R288-F292 WeakPolarHBondContact O-CB 3.21Å; R288-F292 WeakPolarHBondContact O-CD2 3.28Å; R288-F292 VanDerWaalsContact O-CG 3.27Å; R288-F292 WeakPolarHBondContact O-CG 3.28Å; R288-F292 PolarHBondContact O-N 2.77Å
289	V	94.7	Very high	95.2	Very high	77 Å²	77	43.4 Å²	43.4	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-59.7	-42.3	179.7	168.7	0	0	0	0	111.7	S285 V287 K293	S285-V289 WeakPolarHBondContact O-CB 3.45Å; S285-V289 VanDerWaalsContact O-CG2 3.29Å; S285-V289 WeakPolarHBondContact O-CG2 3.39Å; S285-V289 PolarHBondContact O-N 3.37Å; V287-V289 PolarHBondContact O-N 2.84Å; V289-K293 WeakPolarHBondContact O-CG 3.36Å; V289-K293 PolarHBondContact O-N 2.91Å; V289-K293 VanDerWaalsContact O-N 3.14Å
290	N	96.7	Very high	95.2	Very high	22 Å²	22	47.3 Å²	47.3	12%	0.118	23%	0.233	C	C	.	.	H	α-helix	trans	-71.3	-41.8	178.8	-72.6	-13.2	0	0	0	112.1	A248 T251 G252 R286 V287 R288 F292 K293 V294	A248-N290 PolarHBondContact O-ND2 3.16Å; T251-N290 VanDerWaalsContact OG1-CB 3.27Å; T251-N290 WeakPolarHBondContact OG1-CB 3.48Å; G252-N290 WeakPolarHBondContact CA-ND2 3.2Å; R286-N290 WeakPolarHBondContact O-CB 3.49Å; R286-N290 PolarHBondContact O-N 3.02Å; R286-N290 VanDerWaalsContact O-N 3.14Å; V287-N290 PolarHBondContact O-N 3.27Å; V287-N290 VanDerWaalsContact O-N 3.15Å; R288-N290 VanDerWaalsContact C-N 3.32Å; R288-N290 PolarHBondContact O-N 2.98Å; N290-F292 VanDerWaalsContact C-N 3.27Å; N290-F292 PolarHBondContact O-N 3.17Å; N290-K293 WeakPolarHBondContact O-CB 3.23Å; N290-K293 PolarHBondContact O-N 3.44Å; N290-V294 WeakPolarHBondContact O-CG2 3.26Å; N290-V294 PolarHBondContact O-N 3.4Å; N290-V294 VanDerWaalsContact O-N 3.08Å
291	T	96.6	Very high	95.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-52.9	-48.1	172	-64.3	0	0	0	0	110.8	L276 L279 V280 V287 R288 K293 V294 L295	L276-T291 HydrophobicContact CB-CG2 4.18Å; L276-T291 HydrophobicContact CD2-CG2 4.21Å; L276-T291 WeakPolarHBondContact O-CG2 3.4Å; L279-T291 HydrophobicContact CB-CG2 3.93Å; L279-T291 WeakPolarHBondContact CB-OG1 3.42Å; V280-T291 HydrophobicContact CG1-CG2 4.16Å; V287-T291 WeakPolarHBondContact O-CB 3.22Å; V287-T291 PolarHBondContact O-N 3.24Å; V287-T291 PolarHBondContact O-OG1 3.37Å; R288-T291 WeakPolarHBondContact O-CB 3.49Å; R288-T291 PolarHBondContact O-N 3.26Å; T291-K293 PolarHBondContact O-N 2.84Å; T291-V294 PolarHBondContact O-N 3.04Å; T291-L295 HydrophobicContact CG2-CD1 3.93Å; T291-L295 HydrophobicContact CG2-CG 4.39Å; T291-L295 WeakPolarHBondContact O-CG 3.48Å; T291-L295 PolarHBondContact O-N 3.41Å
292	F	94.5	Very high	95.4	Very high	41 Å²	41	44.2 Å²	44.2	18%	0.18	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-40.2	179.2	-70.6	-45.3	0	0	0	113.2	V280 R288 N290 V294 L295 T296 I318	V280-F292 HydrophobicContact CB-CE1 3.9Å; V280-F292 HydrophobicContact CB-CZ 4.11Å; V280-F292 HydrophobicContact CG1-CD1 4.5Å; V280-F292 HydrophobicContact CG1-CE1 3.88Å; R288-F292 HydrophobicContact CB-CD2 4.4Å; R288-F292 HydrophobicContact CB-CE2 4.13Å; R288-F292 WeakPolarHBondContact O-CB 3.21Å; R288-F292 WeakPolarHBondContact O-CD2 3.28Å; R288-F292 VanDerWaalsContact O-CG 3.27Å; R288-F292 WeakPolarHBondContact O-CG 3.28Å; R288-F292 PolarHBondContact O-N 2.77Å; N290-F292 VanDerWaalsContact C-N 3.27Å; N290-F292 PolarHBondContact O-N 3.17Å; F292-V294 VanDerWaalsContact C-N 3.32Å; F292-V294 PolarHBondContact O-N 3.36Å; F292-L295 HydrophobicContact CD1-CD1 4.39Å; F292-L295 PolarHBondContact O-N 3.34Å; F292-T296 WeakPolarHBondContact O-CB 3.47Å; F292-T296 PolarHBondContact O-N 3.13Å; F292-T296 PolarHBondContact O-OG1 3.09Å; F292-T296 VanDerWaalsContact O-OG1 3.05Å; F292-I318 HydrophobicContact CB-CD1 3.49Å; F292-I318 VanDerWaalsContact CB-CD1 3.49Å; F292-I318 HydrophobicContact CD1-CD1 2.99Å; F292-I318 HydrophobicContact CD1-CG1 4.4Å; F292-I318 HydrophobicContact CD2-CD1 3.37Å; F292-I318 HydrophobicContact CE1-CD1 3.37Å; F292-I318 HydrophobicContact CE2-CD1 3.72Å; F292-I318 HydrophobicContact CG-CD1 2.98Å; F292-I318 HydrophobicContact CG-CG1 4.45Å; F292-I318 HydrophobicContact CZ-CD1 3.72Å
293	K	95	Very high	95.4	Very high	113 Å²	113	47.5 Å²	47.5	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-58.2	-43.6	173.1	-70.8	170.3	-176.1	171.8	0	112.2	V289 N290 T291 C297	V289-K293 WeakPolarHBondContact O-CG 3.36Å; V289-K293 PolarHBondContact O-N 2.91Å; V289-K293 VanDerWaalsContact O-N 3.14Å; N290-K293 WeakPolarHBondContact O-CB 3.23Å; N290-K293 PolarHBondContact O-N 3.44Å; T291-K293 PolarHBondContact O-N 2.84Å; K293-C297 PolarHBondContact O-N 3.22Å; K293-C297 VanDerWaalsContact O-N 3.08Å; K293-C297 PolarHBondContact O-SG 2.92Å
294	V	97.4	Very high	95.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-50	178.2	-178.7	0	0	0	0	110.1	T251 L254 T267 L276 N290 T291 F292 T296 C297 L298	T251-V294 WeakPolarHBondContact O-CG2 3.46Å; L254-V294 HydrophobicContact CB-CG2 3.89Å; T267-V294 HydrophobicContact CG2-CG1 4.41Å; L276-V294 HydrophobicContact CD1-CB 4.2Å; L276-V294 HydrophobicContact CD1-CG1 3.47Å; L276-V294 VanDerWaalsContact CD1-CG1 3.47Å; L276-V294 HydrophobicContact CD2-CB 4.15Å; L276-V294 HydrophobicContact CD2-CG1 4.12Å; L276-V294 HydrophobicContact CG-CG1 4.46Å; N290-V294 WeakPolarHBondContact O-CG2 3.26Å; N290-V294 PolarHBondContact O-N 3.4Å; N290-V294 VanDerWaalsContact O-N 3.08Å; T291-V294 PolarHBondContact O-N 3.04Å; F292-V294 VanDerWaalsContact C-N 3.32Å; F292-V294 PolarHBondContact O-N 3.36Å; V294-T296 VanDerWaalsContact C-N 3.32Å; V294-T296 PolarHBondContact O-N 3.04Å; V294-C297 WeakPolarHBondContact O-CB 3.28Å; V294-C297 PolarHBondContact O-N 3.34Å; V294-C297 VanDerWaalsContact O-N 3.1Å; V294-L298 HydrophobicContact CG1-CD1 4Å; V294-L298 HydrophobicContact CG1-CG 4.21Å; V294-L298 WeakPolarHBondContact O-CG 3.45Å; V294-L298 PolarHBondContact O-N 2.9Å
295	L	96.1	Very high	95.3	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-41.8	178.7	-69.7	175.2	0	0	0	112.3	L276 L277 V280 T291 F292 L298 S299 L308 V315	L276-L295 HydrophobicContact CB-CD2 3.71Å; L276-L295 HydrophobicContact CB-CG 4.11Å; L276-L295 HydrophobicContact CD1-CD2 4.05Å; L277-L295 HydrophobicContact CD2-CD1 4.5Å; V280-L295 HydrophobicContact CG1-CD1 3.79Å; T291-L295 HydrophobicContact CG2-CD1 3.93Å; T291-L295 HydrophobicContact CG2-CG 4.39Å; T291-L295 WeakPolarHBondContact O-CG 3.48Å; T291-L295 PolarHBondContact O-N 3.41Å; F292-L295 HydrophobicContact CD1-CD1 4.39Å; F292-L295 PolarHBondContact O-N 3.34Å; L295-L298 PolarHBondContact O-N 2.95Å; L295-S299 WeakPolarHBondContact O-CB 3.31Å; L295-S299 PolarHBondContact O-N 3.23Å; L295-L308 HydrophobicContact CD2-CD2 3.73Å; L295-V315 HydrophobicContact CD1-CG1 4.28Å
296	T	94	Very high	95.2	Very high	40 Å²	40	46.3 Å²	46.3	25%	0.245	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-49.5	173	-65	0	0	0	0	110.9	F292 V294 L298 S299 V322	F292-T296 WeakPolarHBondContact O-CB 3.47Å; F292-T296 PolarHBondContact O-N 3.13Å; F292-T296 PolarHBondContact O-OG1 3.09Å; F292-T296 VanDerWaalsContact O-OG1 3.05Å; V294-T296 VanDerWaalsContact C-N 3.32Å; V294-T296 PolarHBondContact O-N 3.04Å; T296-L298 VanDerWaalsContact C-N 3.34Å; T296-L298 PolarHBondContact O-N 2.9Å; T296-S299 PolarHBondContact O-N 3.33Å; T296-S299 PolarHBondContact O-OG 3.31Å; T296-V322 HydrophobicContact CG2-CG2 4.14Å
297	C	95.9	Very high	95.1	Very high	15 Å²	15	44.1 Å²	44.1	10%	0.101	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-40.2	178.8	-66.4	0	0	0	0	112.6	C258 R264 K293 V294 S299 E300	C258-C297 HydrophobicContact CB-CB 3.55Å; C258-C297 WeakPolarHBondContact O-CB 3.44Å; R264-C297 WeakPolarHBondContact CD-O 3.35Å; R264-C297 HydrophobicContact CG-CB 4.42Å; K293-C297 PolarHBondContact O-N 3.22Å; K293-C297 VanDerWaalsContact O-N 3.08Å; K293-C297 PolarHBondContact O-SG 2.92Å; V294-C297 WeakPolarHBondContact O-CB 3.28Å; V294-C297 PolarHBondContact O-N 3.34Å; V294-C297 VanDerWaalsContact O-N 3.1Å; C297-S299 VanDerWaalsContact C-N 3.32Å; C297-S299 PolarHBondContact O-N 3.43Å; C297-E300 WeakPolarHBondContact O-CB 3.38Å; C297-E300 PolarHBondContact O-N 3.26Å
298	L	96.5	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-33	178.4	-65	-179.2	0	0	0	111.9	R264 T267 I273 L276 V294 L295 T296 E300 T301 L308	R264-L298 HydrophobicContact CB-CD2 4.33Å; R264-L298 WeakPolarHBondContact O-CD2 3.27Å; T267-L298 HydrophobicContact CG2-CD1 4.28Å; T267-L298 HydrophobicContact CG2-CD2 4.14Å; I273-L298 HydrophobicContact CG1-CD1 3.89Å; L276-L298 HydrophobicContact CD1-CD1 3.8Å; V294-L298 HydrophobicContact CG1-CD1 4Å; V294-L298 HydrophobicContact CG1-CG 4.21Å; V294-L298 WeakPolarHBondContact O-CG 3.45Å; V294-L298 PolarHBondContact O-N 2.9Å; L295-L298 PolarHBondContact O-N 2.95Å; T296-L298 VanDerWaalsContact C-N 3.34Å; T296-L298 PolarHBondContact O-N 2.9Å; L298-E300 PolarHBondContact O-N 3.5Å; L298-T301 PolarHBondContact O-N 3.14Å; L298-T301 VanDerWaalsContact O-N 3.11Å; L298-T301 PolarHBondContact O-OG1 3.26Å; L298-L308 HydrophobicContact CB-CD1 4.46Å
299	S	94.1	Very high	94.7	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-14.8	177	78	0	0	0	0	114.5	L295 T296 C297 T301 R305 V322	L295-S299 WeakPolarHBondContact O-CB 3.31Å; L295-S299 PolarHBondContact O-N 3.23Å; T296-S299 PolarHBondContact O-N 3.33Å; T296-S299 PolarHBondContact O-OG 3.31Å; C297-S299 VanDerWaalsContact C-N 3.32Å; C297-S299 PolarHBondContact O-N 3.43Å; S299-T301 VanDerWaalsContact C-N 3.28Å; S299-R305 PolarHBondContact O-NE 2.89Å; S299-R305 PolarHBondContact O-NH2 3.33Å; S299-V322 WeakPolarHBondContact OG-CG1 3.4Å
300	E	93.6	Very high	94.5	Very high	89 Å²	89	45.4 Å²	45.4	42%	0.416	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.8	173	-66.3	179.4	-143.6	0	0	111.7	R264 C297 L298 R305	R264-E300 IonicContact CZ-OE2 3.02Å; R264-E300 IonicContact NH1-OE2 2.89Å; R264-E300 PolarHBondContact NH1-OE2 3.29Å; R264-E300 IonicContact NH2-OE1 3.27Å; R264-E300 PolarHBondContact NH2-OE1 2.97Å; R264-E300 IonicContact NH2-OE2 2.69Å; R264-E300 PolarHBondContact NH2-OE2 2.96Å; C297-E300 WeakPolarHBondContact O-CB 3.38Å; C297-E300 PolarHBondContact O-N 3.26Å; L298-E300 PolarHBondContact O-N 3.5Å; E300-R305 PolarHBondContact O-NH2 3.1Å; E300-R305 VanDerWaalsContact O-NH2 3.1Å
301	T	94.2	Very high	94.1	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.031	23%	0.227	C	C	.	.	S	Bend	trans	-78.8	142.2	175.5	68.7	0	0	0	0	111.2	R264 Y265 L298 S299 E303 G304 R305	R264-T301 HydrophobicContact CB-CG2 3.77Å; Y265-T301 HydrophobicContact CE1-CG2 4.37Å; Y265-T301 HydrophobicContact CE2-CG2 4.22Å; L298-T301 PolarHBondContact O-N 3.14Å; L298-T301 VanDerWaalsContact O-N 3.11Å; L298-T301 PolarHBondContact O-OG1 3.26Å; S299-T301 VanDerWaalsContact C-N 3.28Å; T301-E303 VanDerWaalsContact C-N 3.3Å; T301-E303 PolarHBondContact O-N 2.86Å; T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 WeakPolarHBondContact OG1-CA 3.44Å; T301-G304 PolarHBondContact OG1-N 3.32Å; T301-R305 VanDerWaalsContact O-CB 3.29Å; T301-R305 WeakPolarHBondContact O-CB 3.49Å; T301-R305 PolarHBondContact O-N 3.11Å
302	P	94.6	Very high	93.5	Very high	75 Å²	75	50.4 Å²	50.4	49%	0.487	24%	0.243	S	C	.	.	H	α-helix	trans	-55.1	-43.2	176.6	-26	34.7	0	0	0	113.5	R306	P302-R306 WeakPolarHBondContact O-CB 3.49Å; P302-R306 PolarHBondContact O-N 2.83Å
303	E	94.7	Very high	93	Very high	84 Å²	84	54.6 Å²	54.6	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-70.1	-45.6	-178.5	-63.1	77.7	-171.7	0	0	111.6	Y265 L268 T301 R306 I307	Y265-E303 WeakPolarHBondContact CE1-OE2 3.45Å; L268-E303 HydrophobicContact CD2-CB 3.54Å; T301-E303 VanDerWaalsContact C-N 3.3Å; T301-E303 PolarHBondContact O-N 2.86Å; E303-R306 PolarHBondContact O-N 3.43Å; E303-I307 WeakPolarHBondContact O-CG1 3.42Å; E303-I307 PolarHBondContact O-N 3.1Å; E303-I307 VanDerWaalsContact O-N 3.08Å
304	G	95	Very high	92.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-43	175.3	0	0	0	0	0	111.7	T301 R306 I307 L308	T301-G304 PolarHBondContact O-N 3.19Å; T301-G304 WeakPolarHBondContact OG1-CA 3.44Å; T301-G304 PolarHBondContact OG1-N 3.32Å; G304-R306 PolarHBondContact O-N 2.92Å; G304-I307 PolarHBondContact O-N 2.74Å; G304-L308 WeakPolarHBondContact O-CB 3.35Å; G304-L308 WeakPolarHBondContact O-CD1 3.31Å; G304-L308 WeakPolarHBondContact O-CG 3.23Å; G304-L308 PolarHBondContact O-N 3.02Å
305	R	93.8	Very high	91.3	Very high	81 Å²	81	53.8 Å²	53.8	31%	0.306	26%	0.264	S	S	.	.	H	α-helix	trans	-56.4	-49	173.3	-172.2	-179.7	-60.7	106.1	11.7	111.4	S299 E300 T301 I307 L308 L309 L323	S299-R305 PolarHBondContact O-NE 2.89Å; S299-R305 PolarHBondContact O-NH2 3.33Å; E300-R305 PolarHBondContact O-NH2 3.1Å; E300-R305 VanDerWaalsContact O-NH2 3.1Å; T301-R305 VanDerWaalsContact O-CB 3.29Å; T301-R305 WeakPolarHBondContact O-CB 3.49Å; T301-R305 PolarHBondContact O-N 3.11Å; R305-I307 PolarHBondContact O-N 3.35Å; R305-L308 PolarHBondContact O-N 3.15Å; R305-L309 HydrophobicContact CG-CD1 4.15Å; R305-L309 HydrophobicContact CG-CG 4.42Å; R305-L309 WeakPolarHBondContact O-CB 3.19Å; R305-L309 VanDerWaalsContact O-CG 3.29Å; R305-L309 WeakPolarHBondContact O-CG 3.47Å; R305-L309 PolarHBondContact O-N 3.41Å; R305-L323 HydrophobicContact CG-CD2 3.98Å
306	R	93.8	Very high	89.8	Confident	147 Å²	147	57.4 Å²	57.4	56%	0.555	29%	0.289	S	S	*	.	H	α-helix	trans	-57	-48.1	179.4	-173	-174.6	62.7	72.7	-0.3	111.6	P302 E303 G304 L309	P302-R306 WeakPolarHBondContact O-CB 3.49Å; P302-R306 PolarHBondContact O-N 2.83Å; E303-R306 PolarHBondContact O-N 3.43Å; G304-R306 PolarHBondContact O-N 2.92Å; R306-L309 PolarHBondContact O-N 3.14Å
307	I	93.5	Very high	88.1	Confident	47 Å²	47	60.6 Å²	60.6	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-66.7	-39.1	-179.2	-63.2	163.1	0	0	0	111.4	L268 I273 E303 G304 R305 D310 H311	L268-I307 HydrophobicContact CD1-CD1 4.05Å; I273-I307 HydrophobicContact CB-CG2 4.39Å; I273-I307 HydrophobicContact CD1-CB 3.97Å; I273-I307 HydrophobicContact CD1-CD1 4.13Å; I273-I307 HydrophobicContact CD1-CG2 3.87Å; I273-I307 HydrophobicContact CG2-CG2 3.82Å; E303-I307 WeakPolarHBondContact O-CG1 3.42Å; E303-I307 PolarHBondContact O-N 3.1Å; E303-I307 VanDerWaalsContact O-N 3.08Å; G304-I307 PolarHBondContact O-N 2.74Å; R305-I307 PolarHBondContact O-N 3.35Å; I307-D310 PolarHBondContact O-N 2.93Å; I307-H311 PolarHBondContact O-ND1 2.86Å
308	L	92.8	Very high	86.2	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-73.7	-28.7	-178.4	-66.1	166.1	0	0	0	112.5	I273 L277 L295 L298 G304 R305 D310 H311 L312 F319	I273-L308 HydrophobicContact CD1-CD2 4.39Å; I273-L308 HydrophobicContact CD1-CG 4.22Å; I273-L308 HydrophobicContact CG2-CD2 3.75Å; L277-L308 HydrophobicContact CD2-CD2 4.29Å; L295-L308 HydrophobicContact CD2-CD2 3.73Å; L298-L308 HydrophobicContact CB-CD1 4.46Å; G304-L308 WeakPolarHBondContact O-CB 3.35Å; G304-L308 WeakPolarHBondContact O-CD1 3.31Å; G304-L308 WeakPolarHBondContact O-CG 3.23Å; G304-L308 PolarHBondContact O-N 3.02Å; R305-L308 PolarHBondContact O-N 3.15Å; L308-D310 VanDerWaalsContact C-N 3.27Å; L308-D310 PolarHBondContact O-N 2.8Å; L308-H311 CarbonylContact O-C 3.43Å; L308-H311 PolarHBondContact O-N 2.87Å; L308-L312 PolarHBondContact O-N 3.03Å; L308-F319 HydrophobicContact CB-CE1 4.11Å; L308-F319 HydrophobicContact CB-CZ 3.69Å; L308-F319 HydrophobicContact CD1-CE1 4.48Å; L308-F319 HydrophobicContact CD1-CZ 3.77Å; L308-F319 HydrophobicContact CG-CZ 4.17Å
309	L	90.7	Very high	84.1	Confident	74 Å²	74	62.6 Å²	62.6	39%	0.387	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-35.6	171.4	-76.9	171.2	0	0	0	112.2	R305 R306 H311 L312 L323	R305-L309 HydrophobicContact CG-CD1 4.15Å; R305-L309 HydrophobicContact CG-CG 4.42Å; R305-L309 WeakPolarHBondContact O-CB 3.19Å; R305-L309 VanDerWaalsContact O-CG 3.29Å; R305-L309 WeakPolarHBondContact O-CG 3.47Å; R305-L309 PolarHBondContact O-N 3.41Å; R306-L309 PolarHBondContact O-N 3.14Å; L309-H311 PolarHBondContact O-N 3.06Å; L309-H311 VanDerWaalsContact O-N 3.16Å; L309-L312 HydrophobicContact CD2-CD1 3.93Å; L309-L312 HydrophobicContact CD2-CD2 4.3Å; L309-L312 HydrophobicContact CD2-CG 4.27Å; L309-L312 WeakPolarHBondContact O-CG 3.24Å; L309-L312 PolarHBondContact O-N 3.13Å; L309-L323 HydrophobicContact CD2-CD1 3.83Å
310	D	91.2	Very high	82.2	Confident	115 Å²	115	69.6 Å²	69.6	62%	0.615	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-11.3	175.3	-62.4	-27.3	0	0	0	112.8	I307 L308	I307-D310 PolarHBondContact O-N 2.93Å; L308-D310 VanDerWaalsContact C-N 3.27Å; L308-D310 PolarHBondContact O-N 2.8Å
311	H	89.2	Confident	80.1	Confident	61 Å²	61	73.2 Å²	73.2	28%	0.282	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	19.6	-176.1	-62.2	86.4	0	0	0	113.2	L277 I307 L308 L309 N313 K314	L277-H311 HydrophobicContact CD1-CB 3.75Å; L277-H311 VanDerWaalsContact CD1-CD2 3.48Å; L277-H311 WeakPolarHBondContact CD1-CD2 3.21Å; L277-H311 VanDerWaalsContact CD1-CG 3.43Å; L277-H311 HydrophobicContact CD2-CB 4.23Å; I307-H311 PolarHBondContact O-ND1 2.86Å; L308-H311 CarbonylContact O-C 3.43Å; L308-H311 PolarHBondContact O-N 2.87Å; L309-H311 PolarHBondContact O-N 3.06Å; L309-H311 VanDerWaalsContact O-N 3.16Å; H311-N313 PolarHBondContact O-N 3.06Å; H311-N313 VanDerWaalsContact O-N 3.08Å; H311-N313 PolarHBondContact O-OD1 2.64Å; H311-K314 PolarHBondContact O-N 3.18Å
312	L	83.1	Confident	78.1	Confident	66 Å²	66	75.6 Å²	75.6	35%	0.346	39%	0.393	S	S	.	.	H	α-helix	trans	-50.2	-39.5	-176.8	-80.3	173	0	0	0	112.9	L308 L309 K314 V315 C316 F319	L308-L312 PolarHBondContact O-N 3.03Å; L309-L312 HydrophobicContact CD2-CD1 3.93Å; L309-L312 HydrophobicContact CD2-CD2 4.3Å; L309-L312 HydrophobicContact CD2-CG 4.27Å; L309-L312 WeakPolarHBondContact O-CG 3.24Å; L309-L312 PolarHBondContact O-N 3.13Å; L312-K314 PolarHBondContact O-N 2.82Å; L312-K314 VanDerWaalsContact O-N 3.08Å; L312-V315 HydrophobicContact CD2-CG2 4.44Å; L312-V315 CarbonylContact O-C 3.57Å; L312-V315 PolarHBondContact O-N 2.96Å; L312-C316 PolarHBondContact O-N 3.36Å; L312-C316 PolarHBondContact O-SG 3.33Å; L312-F319 HydrophobicContact CD2-CB 4.1Å; L312-F319 HydrophobicContact CD2-CG 4.24Å
313	N	83.5	Confident	75.7	Confident	130 Å²	130	78.5 Å²	78.5	70%	0.695	40%	0.403	S	S	*	.	H	α-helix	trans	-54.6	-27.7	177.7	63.7	-26.2	0	0	0	114.4	H311	H311-N313 PolarHBondContact O-N 3.06Å; H311-N313 VanDerWaalsContact O-N 3.08Å; H311-N313 PolarHBondContact O-OD1 2.64Å
314	K	80.8	Confident	74.7	Confident	94 Å²	94	78.2 Å²	78.2	41%	0.409	40%	0.404	S	S	.	.	H	α-helix	trans	-90	-21.8	176.9	-67	-172	174.7	-173.5	0	113.8	H311 L312	H311-K314 PolarHBondContact O-N 3.18Å; L312-K314 PolarHBondContact O-N 2.82Å; L312-K314 VanDerWaalsContact O-N 3.08Å
315	V	75.5	Confident	73.7	Confident	2 Å²	2	82.3 Å²	82.3	1%	0.012	43%	0.425	C	S	.	.	H	α-helix	trans	-118.3	6.4	-170.5	-63	0	0	0	0	113.8	L277 V280 L295 L312 S317 I318 F319	L277-V315 HydrophobicContact CD2-CG1 3.44Å; L277-V315 VanDerWaalsContact CD2-CG1 3.44Å; V280-V315 HydrophobicContact CG1-CG1 4.42Å; L295-V315 HydrophobicContact CD1-CG1 4.28Å; L312-V315 HydrophobicContact CD2-CG2 4.44Å; L312-V315 CarbonylContact O-C 3.57Å; L312-V315 PolarHBondContact O-N 2.96Å; V315-S317 PolarHBondContact O-N 3Å; V315-I318 PolarHBondContact O-N 3.43Å; V315-F319 HydrophobicContact CB-CD2 3.57Å; V315-F319 HydrophobicContact CB-CE2 3.6Å; V315-F319 HydrophobicContact CG1-CE2 4.19Å; V315-F319 HydrophobicContact CG2-CD2 3.25Å; V315-F319 HydrophobicContact CG2-CE2 3.38Å; V315-F319 HydrophobicContact CG2-CG 4.18Å; V315-F319 HydrophobicContact CG2-CZ 4.38Å
316	C	65.5	Low	72.6	Confident	78 Å²	78	82.4 Å²	82.4	53%	0.527	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-25.9	-177.1	-86.1	0	0	0	0	114.6	L312 I318	L312-C316 PolarHBondContact O-N 3.36Å; L312-C316 PolarHBondContact O-SG 3.33Å; C316-I318 VanDerWaalsContact C-N 3.26Å; C316-I318 PolarHBondContact O-N 3.37Å
317	S	58.2	Low	71.3	Confident	106 Å²	106	78.6 Å²	78.6	74%	0.741	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.8	178.6	-41.9	0	0	0	0	114.6	V315	V315-S317 PolarHBondContact O-N 3Å
318	I	55.3	Low	69.9	Low	46 Å²	46	80.6 Å²	80.6	24%	0.236	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-25.8	-168.4	-82.2	150.2	0	0	0	115.1	F292 V315 C316 I320	F292-I318 HydrophobicContact CB-CD1 3.49Å; F292-I318 VanDerWaalsContact CB-CD1 3.49Å; F292-I318 HydrophobicContact CD1-CD1 2.99Å; F292-I318 HydrophobicContact CD1-CG1 4.4Å; F292-I318 HydrophobicContact CD2-CD1 3.37Å; F292-I318 HydrophobicContact CE1-CD1 3.37Å; F292-I318 HydrophobicContact CE2-CD1 3.72Å; F292-I318 HydrophobicContact CG-CD1 2.98Å; F292-I318 HydrophobicContact CG-CG1 4.45Å; F292-I318 HydrophobicContact CZ-CD1 3.72Å; V315-I318 PolarHBondContact O-N 3.43Å; C316-I318 VanDerWaalsContact C-N 3.26Å; C316-I318 PolarHBondContact O-N 3.37Å; I318-I320 PolarHBondContact O-N 3.11Å
319	F	54.2	Low	68.4	Low	12 Å²	12	85.9 Å²	85.9	5%	0.053	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-73.9	-9.1	-172	-87.6	-93.2	0	0	0	115.5	L308 L312 V315 L321 L323	L308-F319 HydrophobicContact CB-CE1 4.11Å; L308-F319 HydrophobicContact CB-CZ 3.69Å; L308-F319 HydrophobicContact CD1-CE1 4.48Å; L308-F319 HydrophobicContact CD1-CZ 3.77Å; L308-F319 HydrophobicContact CG-CZ 4.17Å; L312-F319 HydrophobicContact CD2-CB 4.1Å; L312-F319 HydrophobicContact CD2-CG 4.24Å; V315-F319 HydrophobicContact CB-CD2 3.57Å; V315-F319 HydrophobicContact CB-CE2 3.6Å; V315-F319 HydrophobicContact CG1-CE2 4.19Å; V315-F319 HydrophobicContact CG2-CD2 3.25Å; V315-F319 HydrophobicContact CG2-CE2 3.38Å; V315-F319 HydrophobicContact CG2-CG 4.18Å; V315-F319 HydrophobicContact CG2-CZ 4.38Å; F319-L321 PolarHBondContact O-N 3.39Å; F319-L323 HydrophobicContact CD1-CD1 4.22Å; F319-L323 HydrophobicContact CD1-CG 4.28Å
320	I	52.2	Low	66.8	Low	150 Å²	150	86.8 Å²	86.8	77%	0.769	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-66.9	-16.7	179.8	-63.6	176	0	0	0	112.5	I318	I318-I320 PolarHBondContact O-N 3.11Å
321	L	49.5	Very low	64.9	Low	164 Å²	164	84.6 Å²	84.6	86%	0.859	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-108.6	-5	-177.1	-77.5	164	0	0	0	115.5	F319	F319-L321 PolarHBondContact O-N 3.39Å
322	V	53	Low	62.9	Low	56 Å²	56	86.6 Å²	86.6	34%	0.339	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-5.9	-171.7	-173.3	0	0	0	0	113.2	T296 S299	T296-V322 HydrophobicContact CG2-CG2 4.14Å; S299-V322 WeakPolarHBondContact OG-CG1 3.4Å
323	L	44.2	Very low	61.1	Low	135 Å²	135	88.5 Å²	88.5	71%	0.707	49%	0.486	S	S	*	.			trans	-98.7	0	166.7	-69.7	172.2	0	0	0	110.4	R305 L309 F319	R305-L323 HydrophobicContact CG-CD2 3.98Å; L309-L323 HydrophobicContact CD2-CD1 3.83Å; F319-L323 HydrophobicContact CD1-CD1 4.22Å; F319-L323 HydrophobicContact CD1-CG 4.28Å

Retrieved 323 of 323 residues in 490.7 ms (Link to these results)

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