C4QCA2_SCHMA Loading...

Ribonucleoside-diphosphate reductase

AlphaFold DB , UniProt , Accession C4QCA2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 365 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	51.2	Low	64.8	Low	221 Å²	221	119.7 Å²	119.7	100%	1.089	63%	0.63	S	S	*	*				0	-26.7	0	-73.2	-175.8	173.5	0	0	113.4
2	T	53.6	Low	65.8	Low	124 Å²	124	113.9 Å²	113.9	76%	0.761	61%	0.607	S	S	*	*	H	α-helix	trans	-82	-19.6	178.8	39.7	0	0	0	0	115.1	S5	T2-S5 PolarHBondContact O-OG 3.19Å
3	S	57.6	Low	66.5	Low	72 Å²	72	116.4 Å²	116.4	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-73	-33.9	-177.6	58.3	0	0	0	0	114.5
4	D	57.3	Low	67.4	Low	99 Å²	99	118.9 Å²	118.9	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-76.2	-36.8	-173.9	-64.3	-29	0	0	0	111.8	N6 K7 E8	D4-N6 VanDerWaalsContact C-N 3.26Å; D4-N6 PolarHBondContact O-N 2.65Å; D4-K7 PolarHBondContact O-N 3.38Å; D4-K7 VanDerWaalsContact O-N 3.12Å; D4-E8 PolarHBondContact O-N 3.23Å; D4-E8 VanDerWaalsContact O-N 3.14Å
5	S	60.2	Low	67.8	Low	61 Å²	61	117.1 Å²	117.1	43%	0.427	60%	0.598	S	S	.	*	H	α-helix	trans	-62.1	-31.8	176.2	70.3	0	0	0	0	113.6	T2 N9	T2-S5 PolarHBondContact O-OG 3.19Å; S5-N9 PolarHBondContact O-N 3.09Å
6	N	63.5	Low	68	Low	109 Å²	109	120.2 Å²	120.2	58%	0.583	61%	0.606	S	S	*	*	H	α-helix	trans	-71.6	-36.7	176.1	-97.5	-2.6	0	0	0	111.7	D4 N9 E10	D4-N6 VanDerWaalsContact C-N 3.26Å; D4-N6 PolarHBondContact O-N 2.65Å; N6-N9 PolarHBondContact O-N 3.46Å; N6-E10 PolarHBondContact O-N 2.99Å
7	K	70	Confident	68.5	Low	140 Å²	140	121.3 Å²	121.3	61%	0.609	61%	0.609	S	S	*	*	H	α-helix	trans	-68.4	-41.3	178.3	-70.9	-178.2	177.3	179.2	0	112.3	D4 E10 L11	D4-K7 PolarHBondContact O-N 3.38Å; D4-K7 VanDerWaalsContact O-N 3.12Å; K7-E10 PolarHBondContact O-N 2.77Å; K7-L11 WeakPolarHBondContact O-CB 3.08Å; K7-L11 PolarHBondContact O-N 2.88Å
8	E	71.5	Confident	68.8	Low	144 Å²	144	122.3 Å²	122.3	67%	0.673	61%	0.609	S	S	*	*	H	α-helix	trans	-63.6	-41.5	176.2	-73.4	-175.5	164.3	0	0	111.8	D4 L11 S12	D4-E8 PolarHBondContact O-N 3.23Å; D4-E8 VanDerWaalsContact O-N 3.14Å; E8-L11 PolarHBondContact O-N 3.29Å; E8-S12 PolarHBondContact O-N 3.38Å
9	N	73.1	Confident	68.6	Low	107 Å²	107	120.3 Å²	120.3	57%	0.572	60%	0.604	S	S	*	*	H	α-helix	trans	-65.6	-42.8	177.1	-86.8	-22.9	0	0	0	112.4	S5 N6 S12 K13	S5-N9 PolarHBondContact O-N 3.09Å; N6-N9 PolarHBondContact O-N 3.46Å; N9-S12 PolarHBondContact O-N 3.41Å; N9-S12 PolarHBondContact O-OG 3.37Å; N9-K13 PolarHBondContact O-N 3.28Å; N9-K13 VanDerWaalsContact O-N 3.13Å
10	E	77.8	Confident	67.9	Low	130 Å²	130	120 Å²	120	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-59.9	-45.6	173.9	-80.8	-171.6	159.9	0	0	111.8	N6 K7 S12 K13 Y14	N6-E10 PolarHBondContact O-N 2.99Å; K7-E10 PolarHBondContact O-N 2.77Å; E10-S12 PolarHBondContact O-N 3.37Å; E10-K13 PolarHBondContact O-N 2.84Å; E10-Y14 PolarHBondContact O-N 3.27Å
11	L	77.3	Confident	67.6	Low	110 Å²	110	117.5 Å²	117.5	58%	0.576	62%	0.616	S	S	*	*	H	α-helix	trans	-60.4	-45.5	178.1	-176.1	65.3	0	0	0	111.6	K7 E8 K13 Y14 I15	K7-L11 WeakPolarHBondContact O-CB 3.08Å; K7-L11 PolarHBondContact O-N 2.88Å; E8-L11 PolarHBondContact O-N 3.29Å; L11-K13 VanDerWaalsContact C-N 3.26Å; L11-K13 PolarHBondContact O-N 2.88Å; L11-Y14 PolarHBondContact O-N 3.38Å; L11-I15 HydrophobicContact CD1-CD1 4.41Å; L11-I15 HydrophobicContact CG-CD1 4.01Å; L11-I15 WeakPolarHBondContact O-CG1 3.4Å; L11-I15 PolarHBondContact O-N 2.76Å
12	S	76.5	Confident	68	Low	50 Å²	50	114.1 Å²	114.1	35%	0.35	60%	0.6	S	S	.	*	H	α-helix	trans	-61.4	-35.8	179.4	78.7	0	0	0	0	112.7	E8 N9 E10 K16	E8-S12 PolarHBondContact O-N 3.38Å; N9-S12 PolarHBondContact O-N 3.41Å; N9-S12 PolarHBondContact O-OG 3.37Å; E10-S12 PolarHBondContact O-N 3.37Å; S12-K16 WeakPolarHBondContact O-CG 3.28Å; S12-K16 PolarHBondContact O-N 3.13Å; S12-K16 VanDerWaalsContact O-N 3.14Å
13	K	74.9	Confident	68.2	Low	146 Å²	146	113.6 Å²	113.6	64%	0.635	60%	0.596	S	S	*	*	H	α-helix	trans	-72.2	-44.3	179.4	-162.2	-178.9	179.9	-172.1	0	110.7	N9 E10 L11 K16 E17	N9-K13 PolarHBondContact O-N 3.28Å; N9-K13 VanDerWaalsContact O-N 3.13Å; E10-K13 PolarHBondContact O-N 2.84Å; L11-K13 VanDerWaalsContact C-N 3.26Å; L11-K13 PolarHBondContact O-N 2.88Å; K13-K16 PolarHBondContact O-N 3.42Å; K13-E17 WeakPolarHBondContact O-CB 3.47Å; K13-E17 PolarHBondContact O-N 2.77Å
14	Y	78.8	Confident	68.1	Low	152 Å²	152	118.8 Å²	118.8	60%	0.596	61%	0.613	S	S	*	*	H	α-helix	trans	-57.6	-47.3	171.7	-99.5	-87.3	0	0	0	111.7	E10 L11 K16 E17 F18	E10-Y14 PolarHBondContact O-N 3.27Å; L11-Y14 PolarHBondContact O-N 3.38Å; Y14-K16 VanDerWaalsContact C-N 3.33Å; Y14-K16 PolarHBondContact O-N 3.13Å; Y14-E17 PolarHBondContact O-N 3.19Å; Y14-F18 AromaticContact CD1-CD2 3.61Å; Y14-F18 HydrophobicContact CD1-CD2 3.61Å; Y14-F18 AromaticContact CD1-CE2 3.39Å; Y14-F18 HydrophobicContact CD1-CE2 3.39Å; Y14-F18 HydrophobicContact CE1-CD2 4.24Å; Y14-F18 AromaticContact CE1-CE2 3.56Å; Y14-F18 HydrophobicContact CE1-CE2 3.56Å; Y14-F18 HydrophobicContact CE1-CZ 4.37Å; Y14-F18 HydrophobicContact CG-CD2 4.49Å; Y14-F18 HydrophobicContact CG-CE2 4.42Å; Y14-F18 VanDerWaalsContact O-CD2 3.27Å; Y14-F18 WeakPolarHBondContact O-CD2 3.03Å; Y14-F18 PolarHBondContact O-N 3.19Å
15	I	74.2	Confident	68	Low	91 Å²	91	122.4 Å²	122.4	47%	0.467	62%	0.624	S	S	.	*	H	α-helix	trans	-57.4	-49.5	178.7	-69.4	167.5	0	0	0	109.7	L11 E17 F18 T19	L11-I15 HydrophobicContact CD1-CD1 4.41Å; L11-I15 HydrophobicContact CG-CD1 4.01Å; L11-I15 WeakPolarHBondContact O-CG1 3.4Å; L11-I15 PolarHBondContact O-N 2.76Å; I15-E17 VanDerWaalsContact C-N 3.31Å; I15-E17 PolarHBondContact O-N 3.21Å; I15-F18 PolarHBondContact O-N 2.9Å; I15-T19 HydrophobicContact CG2-CG2 4.29Å; I15-T19 WeakPolarHBondContact O-CB 3.36Å; I15-T19 PolarHBondContact O-N 2.67Å; I15-T19 PolarHBondContact O-OG1 2.7Å
16	K	71.1	Confident	67.8	Low	167 Å²	167	127.1 Å²	127.1	73%	0.726	64%	0.639	S	S	*	*	H	α-helix	trans	-62.4	-34.8	-180	-74.7	177.3	-179.8	176.6	0	113.8	S12 K13 Y14	S12-K16 WeakPolarHBondContact O-CG 3.28Å; S12-K16 PolarHBondContact O-N 3.13Å; S12-K16 VanDerWaalsContact O-N 3.14Å; K13-K16 PolarHBondContact O-N 3.42Å; Y14-K16 VanDerWaalsContact C-N 3.33Å; Y14-K16 PolarHBondContact O-N 3.13Å
17	E	76.3	Confident	67.6	Low	139 Å²	139	127.3 Å²	127.3	65%	0.65	64%	0.644	S	S	*	*	H	α-helix	trans	-75.1	-34.4	-179.9	-168.2	168.3	-174.8	0	0	112.2	K13 Y14 I15	K13-E17 WeakPolarHBondContact O-CB 3.47Å; K13-E17 PolarHBondContact O-N 2.77Å; Y14-E17 PolarHBondContact O-N 3.19Å; I15-E17 VanDerWaalsContact C-N 3.31Å; I15-E17 PolarHBondContact O-N 3.21Å
18	F	73.8	Confident	67.2	Low	140 Å²	140	125.3 Å²	125.3	61%	0.614	65%	0.648	S	S	*	*	H	α-helix	trans	-107.2	4.2	-175.4	-65.7	-79.3	0	0	0	115	Y14 I15 P20	Y14-F18 AromaticContact CD1-CD2 3.61Å; Y14-F18 HydrophobicContact CD1-CD2 3.61Å; Y14-F18 AromaticContact CD1-CE2 3.39Å; Y14-F18 HydrophobicContact CD1-CE2 3.39Å; Y14-F18 HydrophobicContact CE1-CD2 4.24Å; Y14-F18 AromaticContact CE1-CE2 3.56Å; Y14-F18 HydrophobicContact CE1-CE2 3.56Å; Y14-F18 HydrophobicContact CE1-CZ 4.37Å; Y14-F18 HydrophobicContact CG-CD2 4.49Å; Y14-F18 HydrophobicContact CG-CE2 4.42Å; Y14-F18 VanDerWaalsContact O-CD2 3.27Å; Y14-F18 WeakPolarHBondContact O-CD2 3.03Å; Y14-F18 PolarHBondContact O-N 3.19Å; I15-F18 PolarHBondContact O-N 2.9Å; F18-P20 WeakPolarHBondContact O-CD 3.29Å
19	T	65.3	Low	66.6	Low	83 Å²	83	124.9 Å²	124.9	51%	0.509	64%	0.641	S	S	.	*			trans	-94	93.3	166.5	32.3	0	0	0	0	109.8	I15	I15-T19 HydrophobicContact CG2-CG2 4.29Å; I15-T19 WeakPolarHBondContact O-CB 3.36Å; I15-T19 PolarHBondContact O-N 2.67Å; I15-T19 PolarHBondContact O-OG1 2.7Å
20	P	55	Low	65.7	Low	114 Å²	114	123.8 Å²	123.8	74%	0.74	66%	0.655	S	S	*	*			trans	-57.8	149.2	169.3	24.7	-32.4	0	0	0	109.8	F18 I22	F18-P20 WeakPolarHBondContact O-CD 3.29Å; P20-I22 PolarHBondContact O-N 2.88Å
21	G	61.3	Low	64.9	Low	69 Å²	69	120.8 Å²	120.8	71%	0.711	64%	0.64	S	S	*	*			trans	-41.1	121.5	-173.5	0	0	0	0	0	112.4	V23	G21-V23 PolarHBondContact O-N 3.44Å
22	I	58.8	Low	64.1	Low	150 Å²	150	124.7 Å²	124.7	77%	0.769	66%	0.655	S	S	*	*			trans	-59.4	102.1	-176.6	-59.7	171.3	0	0	0	107.9	P20 E24	P20-I22 PolarHBondContact O-N 2.88Å; I22-E24 HydrophobicContact CG2-CG 4.22Å
23	V	57.8	Low	63.6	Low	112 Å²	112	125.2 Å²	125.2	68%	0.679	65%	0.651	S	S	*	*			trans	-87.8	107.3	163.7	-175.5	0	0	0	0	105.4	G21 K25	G21-V23 PolarHBondContact O-N 3.44Å; V23-K25 HydrophobicContact CG1-CG 4.03Å; V23-K25 PolarHBondContact O-N 2.99Å
24	E	56.8	Low	63.6	Low	181 Å²	181	120.5 Å²	120.5	85%	0.846	64%	0.637	S	S	*	*			trans	-65.5	81.6	169.9	-71.3	-178.4	169.9	0	0	108.8	I22	I22-E24 HydrophobicContact CG2-CG 4.22Å
25	K	55.3	Low	63.6	Low	176 Å²	176	113.8 Å²	113.8	77%	0.765	61%	0.612	S	S	*	*			trans	-83.9	111	164	-81.2	-173.4	176.9	179.6	0	107.5	V23 V27	V23-K25 HydrophobicContact CG1-CG 4.03Å; V23-K25 PolarHBondContact O-N 2.99Å; K25-V27 PolarHBondContact O-N 3.01Å; K25-V27 VanDerWaalsContact O-N 3.13Å
26	E	55	Low	64	Low	159 Å²	159	112.6 Å²	112.6	74%	0.743	61%	0.609	S	S	*	*			trans	-65.3	111	167.4	-75.8	-172.5	158.5	0	0	109.4	S28	E26-S28 PolarHBondContact O-N 3.36Å
27	V	58.4	Low	64.5	Low	113 Å²	113	112 Å²	112	69%	0.685	61%	0.606	S	S	*	*			trans	-79.3	110.1	169.9	-178.8	0	0	0	0	107.1	K25	K25-V27 PolarHBondContact O-N 3.01Å; K25-V27 VanDerWaalsContact O-N 3.13Å
28	S	61.5	Low	64.8	Low	98 Å²	98	109.1 Å²	109.1	69%	0.685	60%	0.601	S	S	*	*			trans	-130.1	151.6	172.1	66.5	0	0	0	0	110.1	E26	E26-S28 PolarHBondContact O-N 3.36Å
29	Y	60.6	Low	65.4	Low	135 Å²	135	103.5 Å²	103.5	53%	0.529	58%	0.577	S	S	.	*			trans	-131.9	144.9	169.9	68.8	-78.8	0	0	0	108.6	K31 F53	Y29-K31 HydrophobicContact CD2-CG 4.1Å; Y29-K31 HydrophobicContact CE2-CD 3.84Å; Y29-K31 HydrophobicContact CE2-CG 3.41Å; Y29-K31 VanDerWaalsContact CE2-CG 3.41Å; Y29-K31 PolarHBondContact O-N 3.37Å; Y29-K31 WeakPolarHBondContact OH-CE 3.45Å; Y29-K31 PolarHBondContact OH-NZ 3.33Å; Y29-K31 VanDerWaalsContact OH-NZ 3.14Å; Y29-F53 HydrophobicContact CE1-CZ 4.32Å
30	G	54.1	Low	66.4	Low	84 Å²	84	100.8 Å²	100.8	87%	0.866	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-71.2	117.4	178.2	0	0	0	0	0	110.6
31	K	59.5	Low	67.8	Low	67 Å²	67	101.2 Å²	101.2	29%	0.291	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-99.4	131.9	163.1	-88.6	-177.1	157.3	174.2	0	109.4	Y29 F33	Y29-K31 HydrophobicContact CD2-CG 4.1Å; Y29-K31 HydrophobicContact CE2-CD 3.84Å; Y29-K31 HydrophobicContact CE2-CG 3.41Å; Y29-K31 VanDerWaalsContact CE2-CG 3.41Å; Y29-K31 PolarHBondContact O-N 3.37Å; Y29-K31 WeakPolarHBondContact OH-CE 3.45Å; Y29-K31 PolarHBondContact OH-NZ 3.33Å; Y29-K31 VanDerWaalsContact OH-NZ 3.14Å; K31-F33 HydrophobicContact CB-CD2 4.33Å; K31-F33 HydrophobicContact CB-CE1 4.02Å; K31-F33 HydrophobicContact CB-CE2 3.72Å; K31-F33 HydrophobicContact CB-CZ 3.55Å; K31-F33 HydrophobicContact CD-CE1 4.09Å; K31-F33 HydrophobicContact CD-CZ 4.03Å; K31-F33 HydrophobicContact CG-CZ 4.42Å
32	Q	61	Low	69.2	Low	192 Å²	192	101.2 Å²	101.2	90%	0.897	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-78.8	128.5	159.9	-80.5	-179.5	-21.5	0	0	107.7
33	F	66.3	Low	70.8	Confident	61 Å²	61	94.4 Å²	94.4	27%	0.268	50%	0.499	S	S	.	.			trans	-109.1	137.8	175.8	-64.3	-75.8	0	0	0	108.7	K31 V35 I40	K31-F33 HydrophobicContact CB-CD2 4.33Å; K31-F33 HydrophobicContact CB-CE1 4.02Å; K31-F33 HydrophobicContact CB-CE2 3.72Å; K31-F33 HydrophobicContact CB-CZ 3.55Å; K31-F33 HydrophobicContact CD-CE1 4.09Å; K31-F33 HydrophobicContact CD-CZ 4.03Å; K31-F33 HydrophobicContact CG-CZ 4.42Å; F33-V35 VanDerWaalsContact C-N 3.25Å; F33-V35 HydrophobicContact CB-CG2 3.89Å; F33-I40 HydrophobicContact CB-CD1 3.85Å; F33-I40 HydrophobicContact CD2-CD1 3.84Å; F33-I40 HydrophobicContact CG-CD1 3.92Å
34	S	73.8	Confident	72.4	Confident	48 Å²	48	90.9 Å²	90.9	34%	0.336	48%	0.479	S	S	.	.	S	Bend	trans	-77.2	-10.8	171.8	28	0	0	0	0	113.7	R121 E125	S34-R121 PolarHBondContact OG-NH1 3.16Å; S34-E125 WeakPolarHBondContact CB-OE1 3.43Å; S34-E125 PolarHBondContact OG-OE1 3.18Å
35	V	80.3	Confident	74	Confident	11 Å²	11	82.3 Å²	82.3	7%	0.067	44%	0.439	C	S	.	.	S	Bend	trans	-90.7	151.6	177.3	-72	0	0	0	0	111.6	F33 I40 L46 E125 F194	F33-V35 VanDerWaalsContact C-N 3.25Å; F33-V35 HydrophobicContact CB-CG2 3.89Å; V35-I40 HydrophobicContact CG2-CD1 3.96Å; V35-I40 HydrophobicContact CG2-CG1 3.56Å; V35-L46 HydrophobicContact CB-CD1 4.36Å; V35-L46 HydrophobicContact CG1-CD1 4.18Å; V35-L46 HydrophobicContact CG2-CD1 4.26Å; V35-E125 HydrophobicContact CG1-CG 4.23Å; V35-F194 HydrophobicContact CG1-CB 4.16Å; V35-F194 HydrophobicContact CG1-CD2 4.43Å
36	T	81.7	Confident	75.7	Confident	66 Å²	66	74 Å²	74	41%	0.405	40%	0.403	S	S	.	.			trans	-68.5	151.6	-179.7	66.1	0	0	0	0	111.7	S38 E39 I40	T36-S38 PolarHBondContact O-N 2.95Å; T36-S38 PolarHBondContact OG1-OG 2.69Å; T36-E39 WeakPolarHBondContact CB-OE2 3.46Å; T36-E39 PolarHBondContact N-OE2 3.36Å; T36-E39 PolarHBondContact O-N 2.92Å; T36-E39 VanDerWaalsContact OG1-CG 3.31Å; T36-E39 WeakPolarHBondContact OG1-CG 3.29Å; T36-E39 PolarHBondContact OG1-N 2.92Å; T36-E39 PolarHBondContact OG1-OE2 2.88Å; T36-I40 PolarHBondContact O-N 3.38Å; T36-I40 VanDerWaalsContact O-N 3.13Å
37	K	81.1	Confident	77.3	Confident	153 Å²	153	70.9 Å²	70.9	67%	0.665	39%	0.387	S	S	*	.	H	α-helix	trans	-55.5	-37	177	-176	174.2	172.8	178.6	0	112.7	E39 I40 E41	K37-E39 VanDerWaalsContact C-N 3.33Å; K37-E39 PolarHBondContact O-N 3.47Å; K37-I40 PolarHBondContact O-N 3.46Å; K37-E41 WeakPolarHBondContact CE-OE1 3.49Å; K37-E41 IonicContact NZ-OE1 3.95Å; K37-E41 WeakPolarHBondContact O-CG 3.49Å; K37-E41 PolarHBondContact O-N 3.37Å; K37-E41 VanDerWaalsContact O-N 3.12Å
38	S	84.4	Confident	78.5	Confident	80 Å²	80	69.1 Å²	69.1	56%	0.559	38%	0.378	S	S	*	.	H	α-helix	trans	-63.7	-35.5	176.4	44.9	0	0	0	0	113.4	T36 L42	T36-S38 PolarHBondContact O-N 2.95Å; T36-S38 PolarHBondContact OG1-OG 2.69Å; S38-L42 VanDerWaalsContact O-CB 3.28Å; S38-L42 WeakPolarHBondContact O-CB 3.24Å; S38-L42 PolarHBondContact O-N 2.89Å; S38-L42 VanDerWaalsContact O-N 3.17Å
39	E	86.3	Confident	79.5	Confident	22 Å²	22	66.2 Å²	66.2	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-72	-42.1	176.7	-73.6	170.3	92.9	0	0	111.2	T36 K37 E41 L42 E43 L46 T193 F194	T36-E39 WeakPolarHBondContact CB-OE2 3.46Å; T36-E39 PolarHBondContact N-OE2 3.36Å; T36-E39 PolarHBondContact O-N 2.92Å; T36-E39 VanDerWaalsContact OG1-CG 3.31Å; T36-E39 WeakPolarHBondContact OG1-CG 3.29Å; T36-E39 PolarHBondContact OG1-N 2.92Å; T36-E39 PolarHBondContact OG1-OE2 2.88Å; K37-E39 VanDerWaalsContact C-N 3.33Å; K37-E39 PolarHBondContact O-N 3.47Å; E39-E41 VanDerWaalsContact C-N 3.25Å; E39-E41 PolarHBondContact O-N 2.96Å; E39-L42 PolarHBondContact O-N 3.33Å; E39-E43 WeakPolarHBondContact O-CB 3.49Å; E39-E43 PolarHBondContact O-N 3.25Å; E39-L46 HydrophobicContact CB-CD1 4.12Å; E39-T193 WeakPolarHBondContact OE1-CA 3.43Å; E39-T193 VanDerWaalsContact OE1-CB 3.31Å; E39-T193 WeakPolarHBondContact OE1-CB 3.44Å; E39-F194 PolarHBondContact OE1-N 3.08Å
40	I	84.5	Confident	80.2	Confident	26 Å²	26	62.6 Å²	62.6	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-57	-41.1	176.3	-63.3	172.3	0	0	0	111.1	F33 V35 T36 K37 K47 P48	F33-I40 HydrophobicContact CB-CD1 3.85Å; F33-I40 HydrophobicContact CD2-CD1 3.84Å; F33-I40 HydrophobicContact CG-CD1 3.92Å; V35-I40 HydrophobicContact CG2-CD1 3.96Å; V35-I40 HydrophobicContact CG2-CG1 3.56Å; T36-I40 PolarHBondContact O-N 3.38Å; T36-I40 VanDerWaalsContact O-N 3.13Å; K37-I40 PolarHBondContact O-N 3.46Å; I40-K47 WeakPolarHBondContact O-CG 3.41Å; I40-P48 HydrophobicContact CG2-CG 4.28Å
41	E	84.4	Confident	81.3	Confident	122 Å²	122	65.4 Å²	65.4	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-76.5	-27	-179.5	-71.6	174.8	-176.4	0	0	113.3	K37 E39 K47	K37-E41 WeakPolarHBondContact CE-OE1 3.49Å; K37-E41 IonicContact NZ-OE1 3.95Å; K37-E41 WeakPolarHBondContact O-CG 3.49Å; K37-E41 PolarHBondContact O-N 3.37Å; K37-E41 VanDerWaalsContact O-N 3.12Å; E39-E41 VanDerWaalsContact C-N 3.25Å; E39-E41 PolarHBondContact O-N 2.96Å; E41-K47 WeakPolarHBondContact O-CE 3.26Å; E41-K47 PolarHBondContact O-NZ 3.1Å
42	L	91.2	Very high	82.4	Confident	69 Å²	69	63.9 Å²	63.9	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-88.2	-54.3	-177.3	-174	58.1	0	0	0	111.6	S38 E39 K47 I254 K255	S38-L42 VanDerWaalsContact O-CB 3.28Å; S38-L42 WeakPolarHBondContact O-CB 3.24Å; S38-L42 PolarHBondContact O-N 2.89Å; S38-L42 VanDerWaalsContact O-N 3.17Å; E39-L42 PolarHBondContact O-N 3.33Å; L42-K47 PolarHBondContact O-NZ 3.25Å; L42-I254 HydrophobicContact CD1-CG2 4.26Å; L42-I254 WeakPolarHBondContact O-CD1 3.22Å; L42-K255 HydrophobicContact CD2-CB 3.6Å; L42-K255 HydrophobicContact CD2-CD 4.01Å; L42-K255 HydrophobicContact CD2-CG 4.36Å
43	E	92.9	Very high	83.3	Confident	7 Å²	7	61.7 Å²	61.7	3%	0.033	32%	0.318	C	S	.	.			trans	-81.9	120.7	-167.1	-60.5	-56.3	153.7	0	0	112.1	E39 L45 L46 K47 I253 I254 K255	E39-E43 WeakPolarHBondContact O-CB 3.49Å; E39-E43 PolarHBondContact O-N 3.25Å; E43-L45 PolarHBondContact O-N 2.84Å; E43-L45 VanDerWaalsContact O-N 3.16Å; E43-L46 HydrophobicContact CB-CB 4.4Å; E43-L46 HydrophobicContact CB-CD1 3.99Å; E43-L46 HydrophobicContact CB-CG 4.03Å; E43-L46 HydrophobicContact CG-CD1 4.35Å; E43-L46 PolarHBondContact O-N 3.42Å; E43-K47 PolarHBondContact O-N 3.24Å; E43-I253 HydrophobicContact CG-CD1 4.37Å; E43-I253 WeakPolarHBondContact OE2-CA 3.46Å; E43-I254 PolarHBondContact OE2-N 2.94Å; E43-K255 WeakPolarHBondContact OE1-CB 3.15Å; E43-K255 PolarHBondContact OE1-N 3.38Å
44	P	90.9	Very high	84.2	Confident	39 Å²	39	63.5 Å²	63.5	25%	0.253	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-56.8	-34.1	-178.9	-25.5	34.5	0	0	0	113.7	L46 I254	P44-L46 PolarHBondContact O-N 3.48Å; P44-I254 HydrophobicContact CG-CD1 3.96Å; P44-I254 HydrophobicContact CG-CG1 4.34Å
45	L	91	Very high	84.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.3	-27.3	-180	-54.9	-178.1	0	0	0	113.1	E43 V126 Q127 I128 F194 L249 H252 I253	E43-L45 PolarHBondContact O-N 2.84Å; E43-L45 VanDerWaalsContact O-N 3.16Å; L45-V126 WeakPolarHBondContact O-CA 3.35Å; L45-Q127 PolarHBondContact O-N 2.87Å; L45-I128 HydrophobicContact CB-CD1 4.46Å; L45-I128 HydrophobicContact CD2-CD1 3.4Å; L45-I128 HydrophobicContact CG-CD1 4.46Å; L45-F194 HydrophobicContact CD1-CE1 4.06Å; L45-L249 HydrophobicContact CD1-CB 4.22Å; L45-L249 HydrophobicContact CD1-CD2 4.42Å; L45-L249 HydrophobicContact CD2-CD2 4.36Å; L45-H252 HydrophobicContact CD1-CB 4.37Å; L45-H252 HydrophobicContact CD2-CB 3.86Å; L45-H252 HydrophobicContact CG-CB 4.27Å; L45-I253 HydrophobicContact CD1-CD1 3.77Å; L45-I253 HydrophobicContact CD1-CG1 4.44Å
46	L	91.1	Very high	85.1	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-103.8	-11	-170.2	-54.9	-178.2	0	0	0	113.2	V35 E39 E43 P44 P48 E125 Q127 F194	V35-L46 HydrophobicContact CB-CD1 4.36Å; V35-L46 HydrophobicContact CG1-CD1 4.18Å; V35-L46 HydrophobicContact CG2-CD1 4.26Å; E39-L46 HydrophobicContact CB-CD1 4.12Å; E43-L46 HydrophobicContact CB-CB 4.4Å; E43-L46 HydrophobicContact CB-CD1 3.99Å; E43-L46 HydrophobicContact CB-CG 4.03Å; E43-L46 HydrophobicContact CG-CD1 4.35Å; E43-L46 PolarHBondContact O-N 3.42Å; P44-L46 PolarHBondContact O-N 3.48Å; L46-P48 WeakPolarHBondContact O-CD 3.41Å; L46-E125 HydrophobicContact CD2-CB 4.17Å; L46-Q127 WeakPolarHBondContact O-CG 3.48Å; L46-F194 HydrophobicContact CD1-CB 4.03Å; L46-F194 HydrophobicContact CD1-CD2 4.46Å; L46-F194 HydrophobicContact CD1-CG 4.15Å; L46-F194 HydrophobicContact CD2-CD2 3.82Å; L46-F194 HydrophobicContact CD2-CE2 3.9Å; L46-F194 HydrophobicContact CD2-CG 4.17Å; L46-F194 HydrophobicContact CD2-CZ 4.34Å
47	K	87.6	Confident	85.6	Confident	94 Å²	94	71.1 Å²	71.1	41%	0.409	37%	0.366	S	S	.	.	S	Bend	trans	-65.6	124.7	-177.2	-76.6	176.2	-175.7	-179.4	0	111.3	I40 E41 L42 E43 N49 Q127	I40-K47 WeakPolarHBondContact O-CG 3.41Å; E41-K47 WeakPolarHBondContact O-CE 3.26Å; E41-K47 PolarHBondContact O-NZ 3.1Å; L42-K47 PolarHBondContact O-NZ 3.25Å; E43-K47 PolarHBondContact O-N 3.24Å; K47-N49 PolarHBondContact O-N 2.7Å; K47-Q127 WeakPolarHBondContact O-CB 3.42Å; K47-Q127 WeakPolarHBondContact O-CG 3.49Å
48	P	84.9	Confident	86.1	Confident	77 Å²	77	64.8 Å²	64.8	50%	0.5	34%	0.339	S	S	.	.			trans	-55.2	134	174.2	-26.3	35.2	0	0	0	111.5	I40 L46	I40-P48 HydrophobicContact CG2-CG 4.28Å; L46-P48 WeakPolarHBondContact O-CD 3.41Å
49	N	81.1	Confident	86.5	Confident	37 Å²	37	66.3 Å²	66.3	20%	0.198	34%	0.338	C	S	.	.			trans	-126.8	68.4	-178.9	61.4	-10.1	0	0	0	110.9	K47 H51 R52 Q127	K47-N49 PolarHBondContact O-N 2.7Å; N49-H51 PolarHBondContact O-N 3.14Å; N49-R52 HydrophobicContact CB-CB 4.31Å; N49-R52 HydrophobicContact CB-CG 4.49Å; N49-R52 PolarHBondContact O-N 3.21Å; N49-Q127 PolarHBondContact ND2-O 2.9Å; N49-Q127 PolarHBondContact OD1-O 3.44Å
50	P	76.9	Confident	86.9	Confident	58 Å²	58	67.5 Å²	67.5	38%	0.377	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-14.1	-171.2	25.7	-35.5	0	0	0	114.6	F53	P50-F53 VanDerWaalsContact O-CD2 3.23Å; P50-F53 WeakPolarHBondContact O-CD2 3.33Å; P50-F53 WeakPolarHBondContact O-CE2 3.32Å
51	H	77.2	Confident	87.3	Confident	143 Å²	143	72.4 Å²	72.4	66%	0.662	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-10.7	-179.4	-50.8	-60.3	0	0	0	114	N49 F53	N49-H51 PolarHBondContact O-N 3.14Å; H51-F53 PolarHBondContact O-N 3.16Å
52	R	82.1	Confident	87.9	Confident	35 Å²	35	69.5 Å²	69.5	13%	0.132	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	45.2	-176.7	-66.8	-163.7	67.7	-150.2	-5.1	113	N49 P57 E59 P129 E130	N49-R52 HydrophobicContact CB-CB 4.31Å; N49-R52 HydrophobicContact CB-CG 4.49Å; N49-R52 PolarHBondContact O-N 3.21Å; R52-P57 PolarHBondContact NH2-O 3.06Å; R52-E59 VanDerWaalsContact CZ-CD 3.5Å; R52-E59 IonicContact CZ-OE1 3.59Å; R52-E59 IonicContact CZ-OE2 3.47Å; R52-E59 VanDerWaalsContact CZ-OE2 3.29Å; R52-E59 IonicContact NE-OE1 3.56Å; R52-E59 IonicContact NE-OE2 3.8Å; R52-E59 IonicContact NH1-OE2 3.88Å; R52-E59 PolarHBondContact NH1-OE2 2.79Å; R52-P129 HydrophobicContact CB-CG 4.03Å; R52-P129 WeakPolarHBondContact O-CG 3.5Å; R52-E130 IonicContact CZ-OE1 3.45Å; R52-E130 IonicContact CZ-OE2 3.42Å; R52-E130 IonicContact NH1-OE1 2.81Å; R52-E130 IonicContact NH1-OE2 3.33Å; R52-E130 PolarHBondContact NH1-OE2 2.96Å; R52-E130 IonicContact NH2-OE1 3.88Å; R52-E130 PolarHBondContact NH2-OE1 2.85Å; R52-E130 IonicContact NH2-OE2 2.79Å; R52-E130 PolarHBondContact NH2-OE2 3.2Å
53	F	79.4	Confident	88.1	Confident	146 Å²	146	66.2 Å²	66.2	64%	0.64	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-20.3	165	-70.1	-73.6	0	0	0	112.3	Y29 P50 H51	Y29-F53 HydrophobicContact CE1-CZ 4.32Å; P50-F53 VanDerWaalsContact O-CD2 3.23Å; P50-F53 WeakPolarHBondContact O-CD2 3.33Å; P50-F53 WeakPolarHBondContact O-CE2 3.32Å; H51-F53 PolarHBondContact O-N 3.16Å
54	V	84.6	Confident	88.2	Confident	99 Å²	99	67.9 Å²	67.9	60%	0.6	34%	0.341	S	S	*	.	S	Bend	trans	-92.4	136.5	169.7	-66	0	0	0	0	109.5	F56	V54-F56 VanDerWaalsContact C-N 3.35Å
55	L	86.3	Confident	88.4	Confident	46 Å²	46	68.5 Å²	68.5	24%	0.241	34%	0.34	C	S	.	.			trans	-67.6	-36.3	-178.1	175.6	64.3	0	0	0	112.4	P57 I58 W64 P129 E130	L55-P57 CarbonylContact O-C 3.51Å; L55-P57 VanDerWaalsContact O-O 3.12Å; L55-I58 HydrophobicContact CD1-CD1 3.78Å; L55-I58 HydrophobicContact CD2-CD1 4.29Å; L55-I58 HydrophobicContact CG-CD1 3.76Å; L55-W64 HydrophobicContact CD1-CE3 4.46Å; L55-W64 HydrophobicContact CD1-CH2 4.28Å; L55-W64 HydrophobicContact CD1-CZ3 3.84Å; L55-W64 HydrophobicContact CD2-CH2 3.39Å; L55-W64 HydrophobicContact CD2-CZ2 4.13Å; L55-W64 HydrophobicContact CD2-CZ3 3.82Å; L55-W64 HydrophobicContact CG-CH2 4.33Å; L55-W64 HydrophobicContact CG-CZ3 4.37Å; L55-P129 HydrophobicContact CD1-CB 4.21Å; L55-E130 HydrophobicContact CD1-CG 4.47Å
56	F	87.9	Confident	88.6	Confident	146 Å²	146	69.8 Å²	69.8	64%	0.64	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-90.4	147.5	-177.1	-67.3	-75.8	0	0	0	112.2	V54 I58	V54-F56 VanDerWaalsContact C-N 3.35Å; F56-I58 HydrophobicContact CD1-CD1 4.48Å; F56-I58 HydrophobicContact CD1-CG1 4.16Å; F56-I58 HydrophobicContact CE1-CD1 4.44Å; F56-I58 HydrophobicContact CE1-CG1 4.12Å
57	P	91.7	Very high	88.8	Confident	93 Å²	93	71.9 Å²	71.9	60%	0.604	35%	0.354	S	S	*	.	S	Bend	cis	-70.4	153.1	-6	31	-35.2	0	0	0	112.4	R52 L55 E59	R52-P57 PolarHBondContact NH2-O 3.06Å; L55-P57 CarbonylContact O-C 3.51Å; L55-P57 VanDerWaalsContact O-O 3.12Å; P57-E59 PolarHBondContact O-N 3.18Å
58	I	92.7	Very high	89.2	Confident	21 Å²	21	69.9 Å²	69.9	11%	0.108	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-71.5	126	170.7	-59.4	-60.1	0	0	0	107.8	L55 F56 W64 E130	L55-I58 HydrophobicContact CD1-CD1 3.78Å; L55-I58 HydrophobicContact CD2-CD1 4.29Å; L55-I58 HydrophobicContact CG-CD1 3.76Å; F56-I58 HydrophobicContact CD1-CD1 4.48Å; F56-I58 HydrophobicContact CD1-CG1 4.16Å; F56-I58 HydrophobicContact CE1-CD1 4.44Å; F56-I58 HydrophobicContact CE1-CG1 4.12Å; I58-W64 HydrophobicContact CD1-CD2 3.76Å; I58-W64 HydrophobicContact CD1-CE3 3.9Å; I58-W64 HydrophobicContact CD1-CG 4.22Å; I58-W64 HydrophobicContact CD1-CH2 4.4Å; I58-W64 HydrophobicContact CD1-CZ2 4.24Å; I58-W64 HydrophobicContact CD1-CZ3 4.23Å; I58-W64 HydrophobicContact CG1-CD2 4.31Å; I58-W64 HydrophobicContact CG1-CG 4.34Å; I58-W64 HydrophobicContact CG2-CB 3.76Å; I58-W64 HydrophobicContact CG2-CG 3.93Å; I58-E130 HydrophobicContact CD1-CG 4.16Å; I58-E130 HydrophobicContact CG2-CG 4.18Å
59	E	91.8	Very high	89.5	Confident	111 Å²	111	68.2 Å²	68.2	52%	0.519	33%	0.33	S	S	.	.			trans	-103.3	-35.2	179.9	-67.6	174.6	177.4	0	0	111.1	R52 P57 E130	R52-E59 VanDerWaalsContact CZ-CD 3.5Å; R52-E59 IonicContact CZ-OE1 3.59Å; R52-E59 IonicContact CZ-OE2 3.47Å; R52-E59 VanDerWaalsContact CZ-OE2 3.29Å; R52-E59 IonicContact NE-OE1 3.56Å; R52-E59 IonicContact NE-OE2 3.8Å; R52-E59 IonicContact NH1-OE2 3.88Å; R52-E59 PolarHBondContact NH1-OE2 2.79Å; P57-E59 PolarHBondContact O-N 3.18Å; E59-E130 PolarHBondContact N-OE1 3.1Å
60	Y	94.1	Very high	90.1	Very high	48 Å²	48	67.1 Å²	67.1	19%	0.188	33%	0.326	C	S	.	.			trans	-106.9	82.4	-179.1	-69.2	-96.5	0	0	0	110.8	D62 V63 W64 I128 E130 H252	Y60-D62 VanDerWaalsContact C-N 3.35Å; Y60-D62 PolarHBondContact O-N 2.86Å; Y60-V63 HydrophobicContact CD1-CG2 4.36Å; Y60-V63 HydrophobicContact CG-CG2 4.46Å; Y60-V63 PolarHBondContact O-N 2.92Å; Y60-W64 WeakPolarHBondContact O-CB 3.3Å; Y60-W64 PolarHBondContact O-N 2.89Å; Y60-I128 HydrophobicContact CD1-CD1 4.36Å; Y60-I128 HydrophobicContact CD2-CD1 4.04Å; Y60-I128 HydrophobicContact CD2-CG2 3.69Å; Y60-I128 HydrophobicContact CE1-CD1 3.91Å; Y60-I128 HydrophobicContact CE2-CD1 3.56Å; Y60-I128 HydrophobicContact CE2-CG1 4.07Å; Y60-I128 HydrophobicContact CE2-CG2 4.1Å; Y60-I128 HydrophobicContact CG-CD1 4.42Å; Y60-I128 HydrophobicContact CG-CG2 4.22Å; Y60-I128 VanDerWaalsContact CZ-CD1 3.48Å; Y60-E130 PolarHBondContact N-OE1 3.31Å; Y60-H252 AromaticContact CD1-CE1 3.76Å; Y60-H252 AromaticContact CE1-CE1 3.83Å; Y60-H252 AromaticContact CE1-ND1 3.79Å
61	H	94.7	Very high	90.9	Very high	129 Å²	129	66.2 Å²	66.2	60%	0.597	32%	0.319	S	S	*	.	H	α-helix	trans	-66.4	-33.3	-175.6	-72.6	-74	0	0	0	114	W64 H65	H61-W64 PolarHBondContact O-N 2.9Å; H61-H65 VanDerWaalsContact O-CB 3.32Å; H61-H65 WeakPolarHBondContact O-CB 3.49Å; H61-H65 PolarHBondContact O-N 3.13Å
62	D	95.1	Very high	91.5	Very high	61 Å²	61	59.4 Å²	59.4	33%	0.326	29%	0.288	S	S	.	.	H	α-helix	trans	-64.9	-46.7	174.2	57.5	-21.8	0	0	0	111.6	Y60 H65 F66 L248 H252	Y60-D62 VanDerWaalsContact C-N 3.35Å; Y60-D62 PolarHBondContact O-N 2.86Å; D62-H65 VanDerWaalsContact O-CB 3.31Å; D62-H65 WeakPolarHBondContact O-CB 3.45Å; D62-H65 PolarHBondContact O-N 3.26Å; D62-F66 WeakPolarHBondContact O-CD2 3.5Å; D62-F66 PolarHBondContact O-N 3.35Å; D62-L248 HydrophobicContact CB-CD1 4.39Å; D62-L248 HydrophobicContact CB-CD2 4.48Å; D62-H252 IonicContact OD1-NE2 3.57Å; D62-H252 IonicContact OD2-CD2 2.77Å; D62-H252 IonicContact OD2-CE1 3.87Å; D62-H252 PolarHBondContact OD2-CE1 3.39Å; D62-H252 IonicContact OD2-NE2 3.05Å; D62-H252 PolarHBondContact OD2-NE2 2.97Å
63	V	95.6	Very high	91.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-45.7	173.3	175.5	0	0	0	0	110.5	Y60 H65 F66 Y67 E130 V131 F245 L248	Y60-V63 HydrophobicContact CD1-CG2 4.36Å; Y60-V63 HydrophobicContact CG-CG2 4.46Å; Y60-V63 PolarHBondContact O-N 2.92Å; V63-H65 PolarHBondContact O-N 3.46Å; V63-F66 WeakPolarHBondContact O-CB 3.49Å; V63-F66 PolarHBondContact O-N 3.04Å; V63-F66 VanDerWaalsContact O-N 3.11Å; V63-Y67 PolarHBondContact O-N 3.44Å; V63-E130 HydrophobicContact CB-CB 4.24Å; V63-E130 HydrophobicContact CG1-CB 3.68Å; V63-V131 HydrophobicContact CG1-CB 4.27Å; V63-V131 HydrophobicContact CG1-CG2 3.57Å; V63-V131 HydrophobicContact CG2-CG2 4.27Å; V63-F245 HydrophobicContact CG1-CE2 3.9Å; V63-F245 HydrophobicContact CG1-CZ 4.08Å; V63-L248 HydrophobicContact CG2-CD2 4.13Å
64	W	95.6	Very high	92.5	Very high	41 Å²	41	53.8 Å²	53.8	16%	0.155	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-34.8	178.4	-171.4	-115.2	0	0	0	112.3	L55 I58 Y60 H61 Y67 K68 E130 C133	L55-W64 HydrophobicContact CD1-CE3 4.46Å; L55-W64 HydrophobicContact CD1-CH2 4.28Å; L55-W64 HydrophobicContact CD1-CZ3 3.84Å; L55-W64 HydrophobicContact CD2-CH2 3.39Å; L55-W64 HydrophobicContact CD2-CZ2 4.13Å; L55-W64 HydrophobicContact CD2-CZ3 3.82Å; L55-W64 HydrophobicContact CG-CH2 4.33Å; L55-W64 HydrophobicContact CG-CZ3 4.37Å; I58-W64 HydrophobicContact CD1-CD2 3.76Å; I58-W64 HydrophobicContact CD1-CE3 3.9Å; I58-W64 HydrophobicContact CD1-CG 4.22Å; I58-W64 HydrophobicContact CD1-CH2 4.4Å; I58-W64 HydrophobicContact CD1-CZ2 4.24Å; I58-W64 HydrophobicContact CD1-CZ3 4.23Å; I58-W64 HydrophobicContact CG1-CD2 4.31Å; I58-W64 HydrophobicContact CG1-CG 4.34Å; I58-W64 HydrophobicContact CG2-CB 3.76Å; I58-W64 HydrophobicContact CG2-CG 3.93Å; Y60-W64 WeakPolarHBondContact O-CB 3.3Å; Y60-W64 PolarHBondContact O-N 2.89Å; H61-W64 PolarHBondContact O-N 2.9Å; W64-Y67 AromaticContact CD2-CD1 3.98Å; W64-Y67 HydrophobicContact CD2-CD1 3.98Å; W64-Y67 AromaticContact CE3-CD1 3.57Å; W64-Y67 HydrophobicContact CE3-CD1 3.57Å; W64-Y67 HydrophobicContact CE3-CE1 4.26Å; W64-Y67 HydrophobicContact CE3-CG 4.23Å; W64-Y67 AromaticContact CH2-CD1 3.44Å; W64-Y67 HydrophobicContact CH2-CD1 3.44Å; W64-Y67 VanDerWaalsContact CH2-CD1 3.44Å; W64-Y67 AromaticContact CH2-CE1 3.24Å; W64-Y67 HydrophobicContact CH2-CE1 3.24Å; W64-Y67 AromaticContact CZ2-CD1 3.9Å; W64-Y67 HydrophobicContact CZ2-CD1 3.9Å; W64-Y67 AromaticContact CZ2-CE1 3.8Å; W64-Y67 HydrophobicContact CZ2-CE1 3.8Å; W64-Y67 AromaticContact CZ3-CD1 3.28Å; W64-Y67 HydrophobicContact CZ3-CD1 3.28Å; W64-Y67 AromaticContact CZ3-CE1 3.53Å; W64-Y67 HydrophobicContact CZ3-CE1 3.53Å; W64-Y67 HydrophobicContact CZ3-CG 4.08Å; W64-Y67 WeakPolarHBondContact O-CB 3.06Å; W64-Y67 PolarHBondContact O-N 3.36Å; W64-K68 VanDerWaalsContact CZ2-CE 3.43Å; W64-K68 WeakPolarHBondContact O-CG 3.27Å; W64-K68 PolarHBondContact O-N 2.92Å; W64-E130 HydrophobicContact CB-CG 4.47Å; W64-E130 HydrophobicContact CE3-CB 4.29Å; W64-E130 HydrophobicContact CE3-CG 4.05Å; W64-C133 HydrophobicContact CZ3-CB 4.05Å
65	H	95.1	Very high	93	Very high	52 Å²	52	49.1 Å²	49.1	24%	0.241	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-43.1	174.9	-171.2	82.5	0	0	0	112.2	H61 D62 V63 Y67 K68 K69 F335 M348	H61-H65 VanDerWaalsContact O-CB 3.32Å; H61-H65 WeakPolarHBondContact O-CB 3.49Å; H61-H65 PolarHBondContact O-N 3.13Å; D62-H65 VanDerWaalsContact O-CB 3.31Å; D62-H65 WeakPolarHBondContact O-CB 3.45Å; D62-H65 PolarHBondContact O-N 3.26Å; V63-H65 PolarHBondContact O-N 3.46Å; H65-Y67 VanDerWaalsContact C-N 3.35Å; H65-K68 PolarHBondContact O-N 2.87Å; H65-K69 VanDerWaalsContact NE2-CE 3.33Å; H65-K69 WeakPolarHBondContact NE2-CE 3.47Å; H65-K69 PolarHBondContact O-N 2.99Å; H65-F335 AromaticContact CE1-CE1 3.84Å; H65-F335 AromaticContact CE1-CZ 3.24Å; H65-F335 WeakPolarHBondContact CE1-CZ 3.18Å; H65-F335 AromaticContact NE2-CE2 3.83Å; H65-F335 AromaticContact NE2-CZ 3.31Å; H65-F335 VanDerWaalsContact NE2-CZ 3.31Å; H65-F335 WeakPolarHBondContact NE2-CZ 3.3Å; H65-M348 VanDerWaalsContact CE1-CE 3.46Å; H65-M348 WeakPolarHBondContact CE1-CE 3.46Å
66	F	95.1	Very high	93.4	Very high	27 Å²	27	49 Å²	49	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-42.8	173	-92.1	-101.7	0	0	0	111.9	D62 V63 K68 K69 A70 F134 L241 D244 F245 L248	D62-F66 WeakPolarHBondContact O-CD2 3.5Å; D62-F66 PolarHBondContact O-N 3.35Å; V63-F66 WeakPolarHBondContact O-CB 3.49Å; V63-F66 PolarHBondContact O-N 3.04Å; V63-F66 VanDerWaalsContact O-N 3.11Å; F66-K68 VanDerWaalsContact C-N 3.29Å; F66-K68 PolarHBondContact O-N 3.45Å; F66-K69 WeakPolarHBondContact O-CB 3.46Å; F66-K69 PolarHBondContact O-N 3.33Å; F66-K69 VanDerWaalsContact O-N 3.13Å; F66-A70 PolarHBondContact O-N 3.21Å; F66-F134 HydrophobicContact CB-CD2 3.84Å; F66-F134 HydrophobicContact CB-CE2 3.89Å; F66-F134 HydrophobicContact CD1-CE2 4.18Å; F66-L241 HydrophobicContact CD1-CD1 3.58Å; F66-L241 HydrophobicContact CD1-CG 4.43Å; F66-L241 HydrophobicContact CE1-CD1 3.79Å; F66-D244 HydrophobicContact CE1-CB 3.71Å; F66-D244 HydrophobicContact CZ-CB 4.04Å; F66-F245 HydrophobicContact CB-CD2 3.67Å; F66-F245 HydrophobicContact CB-CE2 4.04Å; F66-F245 HydrophobicContact CD1-CB 3.89Å; F66-F245 AromaticContact CD1-CD2 3.82Å; F66-F245 HydrophobicContact CD1-CD2 3.82Å; F66-F245 HydrophobicContact CD1-CG 4.35Å; F66-F245 HydrophobicContact CE1-CB 4.2Å; F66-F245 AromaticContact CG-CD2 3.83Å; F66-F245 HydrophobicContact CG-CD2 3.83Å; F66-L248 HydrophobicContact CD2-CD2 3.54Å; F66-L248 HydrophobicContact CE2-CB 4.49Å; F66-L248 HydrophobicContact CE2-CD2 3.76Å; F66-L248 HydrophobicContact CG-CD2 4.18Å
67	Y	95.9	Very high	93.8	Very high	46 Å²	46	42.3 Å²	42.3	18%	0.18	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-43.3	174	164.7	-108	0	0	0	111.6	V63 W64 H65 K69 A70 V71 C133 M137	V63-Y67 PolarHBondContact O-N 3.44Å; W64-Y67 AromaticContact CD2-CD1 3.98Å; W64-Y67 HydrophobicContact CD2-CD1 3.98Å; W64-Y67 AromaticContact CE3-CD1 3.57Å; W64-Y67 HydrophobicContact CE3-CD1 3.57Å; W64-Y67 HydrophobicContact CE3-CE1 4.26Å; W64-Y67 HydrophobicContact CE3-CG 4.23Å; W64-Y67 AromaticContact CH2-CD1 3.44Å; W64-Y67 HydrophobicContact CH2-CD1 3.44Å; W64-Y67 VanDerWaalsContact CH2-CD1 3.44Å; W64-Y67 AromaticContact CH2-CE1 3.24Å; W64-Y67 HydrophobicContact CH2-CE1 3.24Å; W64-Y67 AromaticContact CZ2-CD1 3.9Å; W64-Y67 HydrophobicContact CZ2-CD1 3.9Å; W64-Y67 AromaticContact CZ2-CE1 3.8Å; W64-Y67 HydrophobicContact CZ2-CE1 3.8Å; W64-Y67 AromaticContact CZ3-CD1 3.28Å; W64-Y67 HydrophobicContact CZ3-CD1 3.28Å; W64-Y67 AromaticContact CZ3-CE1 3.53Å; W64-Y67 HydrophobicContact CZ3-CE1 3.53Å; W64-Y67 HydrophobicContact CZ3-CG 4.08Å; W64-Y67 WeakPolarHBondContact O-CB 3.06Å; W64-Y67 PolarHBondContact O-N 3.36Å; H65-Y67 VanDerWaalsContact C-N 3.35Å; Y67-K69 VanDerWaalsContact C-N 3.35Å; Y67-K69 PolarHBondContact O-N 2.96Å; Y67-A70 PolarHBondContact O-N 2.8Å; Y67-V71 HydrophobicContact CD2-CG2 4.13Å; Y67-V71 HydrophobicContact CE1-CG2 4.17Å; Y67-V71 HydrophobicContact CE2-CG2 3.6Å; Y67-V71 WeakPolarHBondContact O-CG2 3.42Å; Y67-V71 PolarHBondContact O-N 2.87Å; Y67-C133 HydrophobicContact CD1-CB 4.4Å; Y67-C133 VanDerWaalsContact CD2-C 3.46Å; Y67-C133 HydrophobicContact CD2-CB 3.69Å; Y67-C133 VanDerWaalsContact CD2-O 3.27Å; Y67-C133 WeakPolarHBondContact CD2-O 3.45Å; Y67-C133 HydrophobicContact CE2-CB 3.86Å; Y67-C133 WeakPolarHBondContact CE2-O 3.38Å; Y67-C133 HydrophobicContact CG-CB 3.97Å; Y67-M137 HydrophobicContact CD2-CG 3.82Å; Y67-M137 HydrophobicContact CE2-CG 3.54Å; Y67-M137 HydrophobicContact CE2-SD 4.36Å
68	K	95.4	Very high	93.9	Very high	52 Å²	52	45.1 Å²	45.1	23%	0.226	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-33.7	176.4	-66.9	-56.4	-177.7	-172.1	0	113.6	W64 H65 F66 A72 M348	W64-K68 VanDerWaalsContact CZ2-CE 3.43Å; W64-K68 WeakPolarHBondContact O-CG 3.27Å; W64-K68 PolarHBondContact O-N 2.92Å; H65-K68 PolarHBondContact O-N 2.87Å; F66-K68 VanDerWaalsContact C-N 3.29Å; F66-K68 PolarHBondContact O-N 3.45Å; K68-A72 WeakPolarHBondContact O-CB 3.21Å; K68-A72 PolarHBondContact O-N 3.25Å; K68-M348 HydrophobicContact CB-SD 4.02Å
69	K	92	Very high	93.9	Very high	42 Å²	42	46.7 Å²	46.7	18%	0.183	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-49.7	170.4	-72.9	-179	174.5	177.1	0	110.8	H65 F66 Y67 V71 A72 S73 L241 F334 M348	H65-K69 VanDerWaalsContact NE2-CE 3.33Å; H65-K69 WeakPolarHBondContact NE2-CE 3.47Å; H65-K69 PolarHBondContact O-N 2.99Å; F66-K69 WeakPolarHBondContact O-CB 3.46Å; F66-K69 PolarHBondContact O-N 3.33Å; F66-K69 VanDerWaalsContact O-N 3.13Å; Y67-K69 VanDerWaalsContact C-N 3.35Å; Y67-K69 PolarHBondContact O-N 2.96Å; K69-V71 VanDerWaalsContact C-N 3.33Å; K69-V71 PolarHBondContact O-N 3.45Å; K69-A72 PolarHBondContact O-N 3.41Å; K69-S73 PolarHBondContact O-N 3.11Å; K69-S73 PolarHBondContact O-OG 2.96Å; K69-L241 HydrophobicContact CB-CD1 4.13Å; K69-L241 HydrophobicContact CB-CD2 4.3Å; K69-L241 HydrophobicContact CD-CD1 4.11Å; K69-F334 HydrophobicContact CD-CE1 4.3Å; K69-F334 HydrophobicContact CG-CE1 3.89Å; K69-F334 HydrophobicContact CG-CZ 4.33Å; K69-M348 HydrophobicContact CG-CE 4.18Å; K69-M348 HydrophobicContact CG-SD 4.48Å
70	A	92.8	Very high	93.9	Very high	14 Å²	14	41.9 Å²	41.9	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-44.7	178.1	0	0	0	0	0	112	F66 Y67 A72 S73 F74 F134 M137 L241	F66-A70 PolarHBondContact O-N 3.21Å; Y67-A70 PolarHBondContact O-N 2.8Å; A70-A72 VanDerWaalsContact C-N 3.32Å; A70-A72 PolarHBondContact O-N 3Å; A70-S73 PolarHBondContact O-N 2.93Å; A70-F74 PolarHBondContact O-N 3.5Å; A70-F134 HydrophobicContact CB-CD2 4.28Å; A70-F134 HydrophobicContact CB-CE2 4.01Å; A70-M137 HydrophobicContact CB-CB 3.98Å; A70-M137 HydrophobicContact CB-CG 4.46Å; A70-L241 HydrophobicContact CB-CD2 3.93Å
71	V	93.6	Very high	93.8	Very high	38 Å²	38	44 Å²	44	23%	0.23	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-38.1	175.4	173.8	0	0	0	0	112.4	Y67 K69 S73 M137 V347	Y67-V71 HydrophobicContact CD2-CG2 4.13Å; Y67-V71 HydrophobicContact CE1-CG2 4.17Å; Y67-V71 HydrophobicContact CE2-CG2 3.6Å; Y67-V71 WeakPolarHBondContact O-CG2 3.42Å; Y67-V71 PolarHBondContact O-N 2.87Å; K69-V71 VanDerWaalsContact C-N 3.33Å; K69-V71 PolarHBondContact O-N 3.45Å; V71-S73 VanDerWaalsContact C-N 3.31Å; V71-M137 HydrophobicContact CG2-CE 4.28Å; V71-M137 HydrophobicContact CG2-CG 4.07Å; V71-M137 HydrophobicContact CG2-SD 4Å; V71-V347 HydrophobicContact CB-CG1 4.44Å; V71-V347 HydrophobicContact CG1-CG1 4.1Å
72	A	89.9	Confident	93.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-72.3	-26.8	-178.4	0	0	0	0	0	113.1	K68 K69 A70 Q343 R344 V347 M348	K68-A72 WeakPolarHBondContact O-CB 3.21Å; K68-A72 PolarHBondContact O-N 3.25Å; K69-A72 PolarHBondContact O-N 3.41Å; A70-A72 VanDerWaalsContact C-N 3.32Å; A70-A72 PolarHBondContact O-N 3Å; A72-Q343 HydrophobicContact CB-CG 3.93Å; A72-R344 PolarHBondContact O-N 3.21Å; A72-V347 HydrophobicContact CB-CB 4.03Å; A72-V347 HydrophobicContact CB-CG1 3.94Å; A72-M348 HydrophobicContact CB-CG 4.12Å
73	S	89.8	Confident	93.6	Very high	11 Å²	11	39.7 Å²	39.7	8%	0.077	20%	0.202	C	C	.	.	H	α-helix	trans	-91.7	-6.9	-177.6	-62.1	0	0	0	0	114.2	K69 A70 V71 W75 R237	K69-S73 PolarHBondContact O-N 3.11Å; K69-S73 PolarHBondContact O-OG 2.96Å; A70-S73 PolarHBondContact O-N 2.93Å; V71-S73 VanDerWaalsContact C-N 3.31Å; S73-W75 PolarHBondContact O-N 3.18Å; S73-R237 PolarHBondContact O-NH2 2.98Å
74	F	92.5	Very high	93.4	Very high	53 Å²	53	45.5 Å²	45.5	23%	0.232	23%	0.227	C	C	.	.			trans	-56.9	132.3	-175.4	-172.3	-91.4	0	0	0	113.2	A70 T76 M137 I141 I144	A70-F74 PolarHBondContact O-N 3.5Å; F74-T76 HydrophobicContact CE1-CG2 3.92Å; F74-T76 HydrophobicContact CZ-CG2 4.45Å; F74-M137 HydrophobicContact CB-CE 4.4Å; F74-M137 HydrophobicContact CD2-CE 3.64Å; F74-M137 HydrophobicContact CE2-CE 4.33Å; F74-M137 HydrophobicContact CG-CE 4.33Å; F74-I141 HydrophobicContact CD2-CD1 4.2Å; F74-I141 HydrophobicContact CE2-CD1 4.4Å; F74-I144 HydrophobicContact CE1-CD1 4.42Å; F74-I144 HydrophobicContact CE2-CD1 3.69Å; F74-I144 HydrophobicContact CZ-CD1 3.55Å
75	W	95.3	Very high	93.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.			trans	-137.2	173.9	-179.5	62.3	-79.1	0	0	0	110	S73 E79 V80 I141 I144 H145 M148 L234 I235 R237 D238 Y342	S73-W75 PolarHBondContact O-N 3.18Å; W75-E79 WeakPolarHBondContact CB-OE2 3.46Å; W75-V80 HydrophobicContact CE3-CG2 4.4Å; W75-V80 HydrophobicContact CZ3-CG2 4.01Å; W75-I141 HydrophobicContact CG-CD1 4.48Å; W75-I144 HydrophobicContact CD2-CG2 4.34Å; W75-I144 HydrophobicContact CE3-CG2 4.14Å; W75-I144 HydrophobicContact CH2-CG2 3.83Å; W75-I144 HydrophobicContact CZ2-CG2 4.06Å; W75-I144 HydrophobicContact CZ3-CG2 3.87Å; W75-I144 VanDerWaalsContact O-CD1 3.28Å; W75-I144 WeakPolarHBondContact O-CD1 3.36Å; W75-H145 AromaticContact CZ2-CD2 3.78Å; W75-M148 HydrophobicContact CH2-CB 4.16Å; W75-M148 HydrophobicContact CH2-CG 4.07Å; W75-M148 HydrophobicContact CH2-SD 4.47Å; W75-M148 HydrophobicContact CZ3-CG 4.4Å; W75-M148 HydrophobicContact CZ3-SD 4.21Å; W75-L234 HydrophobicContact CB-CD1 4.49Å; W75-L234 HydrophobicContact CD2-CB 4.07Å; W75-L234 HydrophobicContact CD2-CD1 3.67Å; W75-L234 HydrophobicContact CD2-CG 4.42Å; W75-L234 HydrophobicContact CE3-CD1 3.66Å; W75-L234 HydrophobicContact CG-CB 4.44Å; W75-L234 HydrophobicContact CG-CD1 4.05Å; W75-L234 HydrophobicContact CZ2-CB 3.96Å; W75-L234 HydrophobicContact CZ3-CD1 4.18Å; W75-I235 HydrophobicContact CH2-CD1 4.41Å; W75-I235 HydrophobicContact CH2-CG1 4.02Å; W75-I235 HydrophobicContact CZ2-CG1 3.67Å; W75-R237 VanDerWaalsContact CD1-NH2 3.29Å; W75-D238 PolarHBondContact NE1-OD2 3.01Å; W75-Y342 HydrophobicContact CB-CD1 4.34Å; W75-Y342 HydrophobicContact CB-CE1 3.98Å
76	T	95.4	Very high	93.1	Very high	43 Å²	43	45.5 Å²	45.5	26%	0.264	23%	0.228	S	C	.	.			trans	-136.8	155.9	179.6	51.2	0	0	0	0	110.8	F74 E78 E79	F74-T76 HydrophobicContact CE1-CG2 3.92Å; F74-T76 HydrophobicContact CZ-CG2 4.45Å; T76-E78 PolarHBondContact O-N 3.4Å; T76-E79 PolarHBondContact N-OE1 3.19Å; T76-E79 WeakPolarHBondContact O-CB 3.39Å; T76-E79 WeakPolarHBondContact O-CG 3.32Å; T76-E79 PolarHBondContact O-N 3.26Å; T76-E79 PolarHBondContact OG1-OE1 2.91Å; T76-E79 VanDerWaalsContact OG1-OE1 3.14Å
77	V	95.6	Very high	92.9	Very high	7 Å²	7	50 Å²	50	4%	0.042	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-61	-28.6	-174.9	-61	0	0	0	0	113.2	E79 V80 I144 E147 M148	V77-E79 PolarHBondContact O-N 2.81Å; V77-E79 VanDerWaalsContact O-N 3.16Å; V77-V80 PolarHBondContact O-N 2.98Å; V77-V80 VanDerWaalsContact O-N 3.1Å; V77-I144 HydrophobicContact CG1-CG2 3.96Å; V77-E147 HydrophobicContact CG1-CB 4.04Å; V77-E147 HydrophobicContact CG1-CG 3.87Å; V77-E147 HydrophobicContact CG2-CG 4.18Å; V77-M148 HydrophobicContact CB-SD 4.16Å; V77-M148 HydrophobicContact CG1-CB 3.96Å; V77-M148 HydrophobicContact CG1-SD 4.09Å
78	E	95	Very high	92.8	Very high	151 Å²	151	50.4 Å²	50.4	71%	0.706	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-64.9	-16.3	177.5	-67.8	78	-171.7	0	0	113.7	T76 V80	T76-E78 PolarHBondContact O-N 3.4Å; E78-V80 VanDerWaalsContact C-N 3.27Å
79	E	91.4	Very high	92.8	Very high	54 Å²	54	48.5 Å²	48.5	25%	0.252	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-79	-13.6	177	-59	172.7	-161.7	0	0	112.4	W75 T76 V77 Y342	W75-E79 WeakPolarHBondContact CB-OE2 3.46Å; T76-E79 PolarHBondContact N-OE1 3.19Å; T76-E79 WeakPolarHBondContact O-CB 3.39Å; T76-E79 WeakPolarHBondContact O-CG 3.32Å; T76-E79 PolarHBondContact O-N 3.26Å; T76-E79 PolarHBondContact OG1-OE1 2.91Å; T76-E79 VanDerWaalsContact OG1-OE1 3.14Å; V77-E79 PolarHBondContact O-N 2.81Å; V77-E79 VanDerWaalsContact O-N 3.16Å; E79-Y342 VanDerWaalsContact CD-CZ 3.49Å; E79-Y342 PolarHBondContact OE1-OH 2.78Å; E79-Y342 WeakPolarHBondContact OE2-CE1 3.43Å; E79-Y342 PolarHBondContact OE2-OH 2.87Å
80	V	92.5	Very high	92.8	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.067	26%	0.261	C	S	.	.	S	Bend	trans	-96	113.3	-178.5	-176.6	0	0	0	0	110.4	W75 V77 E78 L82 M148 F230 L234	W75-V80 HydrophobicContact CE3-CG2 4.4Å; W75-V80 HydrophobicContact CZ3-CG2 4.01Å; V77-V80 PolarHBondContact O-N 2.98Å; V77-V80 VanDerWaalsContact O-N 3.1Å; E78-V80 VanDerWaalsContact C-N 3.27Å; V80-L82 HydrophobicContact CG1-CD2 3.79Å; V80-L82 HydrophobicContact CG1-CG 4.44Å; V80-L82 PolarHBondContact O-N 3.36Å; V80-M148 HydrophobicContact CB-CE 4.29Å; V80-M148 HydrophobicContact CB-SD 3.95Å; V80-M148 HydrophobicContact CG1-CE 4.09Å; V80-M148 HydrophobicContact CG1-SD 4.21Å; V80-M148 HydrophobicContact CG2-SD 3.82Å; V80-F230 HydrophobicContact CG1-CD1 4.36Å; V80-F230 HydrophobicContact CG2-CD1 4.11Å; V80-F230 HydrophobicContact CG2-CE1 4.31Å; V80-L234 HydrophobicContact CG2-CD1 4.22Å
81	D	92.4	Very high	92.8	Very high	91 Å²	91	54.7 Å²	54.7	49%	0.487	28%	0.283	S	S	.	.			trans	-83.6	108.4	175.7	178.3	18.5	0	0	0	111.9	S83 G227	D81-S83 VanDerWaalsContact CG-OG 3.25Å; D81-S83 WeakPolarHBondContact OD1-CB 3.33Å; D81-S83 PolarHBondContact OD1-N 3.39Å; D81-S83 PolarHBondContact OD1-OG 3.47Å; D81-S83 PolarHBondContact OD2-OG 3.24Å; D81-S83 VanDerWaalsContact OD2-OG 3.09Å; D81-G227 WeakPolarHBondContact O-CA 3.38Å
82	L	93.7	Very high	92.8	Very high	21 Å²	21	53.4 Å²	53.4	11%	0.11	28%	0.275	C	S	.	.			trans	-92.9	2.3	176.1	-57.2	-176.1	0	0	0	113.9	V80 K84 D85 M148 L151 L152 T155	V80-L82 HydrophobicContact CG1-CD2 3.79Å; V80-L82 HydrophobicContact CG1-CG 4.44Å; V80-L82 PolarHBondContact O-N 3.36Å; L82-K84 VanDerWaalsContact C-N 3.25Å; L82-K84 PolarHBondContact O-N 2.6Å; L82-D85 PolarHBondContact O-N 2.93Å; L82-D85 VanDerWaalsContact O-N 3.13Å; L82-M148 HydrophobicContact CD1-CE 3.94Å; L82-M148 HydrophobicContact CD2-CE 4.15Å; L82-M148 HydrophobicContact CG-CE 4.36Å; L82-L151 HydrophobicContact CD1-CD2 4.03Å; L82-L151 HydrophobicContact CD1-CG 3.88Å; L82-L152 HydrophobicContact CD1-CD2 4.14Å; L82-L152 HydrophobicContact CD2-CD2 3.65Å; L82-T155 HydrophobicContact CB-CG2 4.38Å; L82-T155 HydrophobicContact CD1-CG2 4.36Å
83	S	91.2	Very high	93	Very high	79 Å²	79	60.5 Å²	60.5	55%	0.552	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.8	-171.9	64.7	0	0	0	0	113.8	D81	D81-S83 VanDerWaalsContact CG-OG 3.25Å; D81-S83 WeakPolarHBondContact OD1-CB 3.33Å; D81-S83 PolarHBondContact OD1-N 3.39Å; D81-S83 PolarHBondContact OD1-OG 3.47Å; D81-S83 PolarHBondContact OD2-OG 3.24Å; D81-S83 VanDerWaalsContact OD2-OG 3.09Å
84	K	91.6	Very high	93.1	Very high	123 Å²	123	65.2 Å²	65.2	54%	0.535	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-23.9	-179.3	-63.9	175.4	-172.5	165.5	0	112.8	L82 F86 I87 H88 P226	L82-K84 VanDerWaalsContact C-N 3.25Å; L82-K84 PolarHBondContact O-N 2.6Å; K84-F86 VanDerWaalsContact C-N 3.29Å; K84-F86 PolarHBondContact O-N 3.15Å; K84-I87 PolarHBondContact O-N 3.03Å; K84-H88 PolarHBondContact O-N 3.36Å; K84-P226 HydrophobicContact CB-CG 3.92Å; K84-P226 HydrophobicContact CD-CG 4.42Å
85	D	94.2	Very high	93.1	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-69.3	-30.1	-172.3	-81.9	33.5	0	0	0	112.1	L82 I87 H88 W89 Y156 M225 P226 G227 L228	L82-D85 PolarHBondContact O-N 2.93Å; L82-D85 VanDerWaalsContact O-N 3.13Å; D85-I87 VanDerWaalsContact C-N 3.33Å; D85-I87 PolarHBondContact O-N 2.72Å; D85-H88 PolarHBondContact O-N 3.37Å; D85-W89 VanDerWaalsContact O-CB 3.29Å; D85-W89 WeakPolarHBondContact O-CB 3.34Å; D85-W89 PolarHBondContact O-N 3.42Å; D85-Y156 HydrophobicContact CB-CE1 3.65Å; D85-Y156 PolarHBondContact OD2-OH 2.91Å; D85-M225 HydrophobicContact CB-CE 3.76Å; D85-M225 HydrophobicContact CB-SD 4.41Å; D85-M225 WeakPolarHBondContact OD2-CA 3.39Å; D85-P226 WeakPolarHBondContact OD1-CD 3.27Å; D85-P226 VanDerWaalsContact OD1-CG 3.29Å; D85-P226 WeakPolarHBondContact OD1-CG 3.46Å; D85-P226 VanDerWaalsContact OD1-N 3.11Å; D85-G227 VanDerWaalsContact CG-N 3.33Å; D85-G227 PolarHBondContact OD1-N 3.44Å; D85-G227 WeakPolarHBondContact OD2-CA 3.46Å; D85-G227 PolarHBondContact OD2-N 3.36Å; D85-L228 WeakPolarHBondContact OD2-CB 3.3Å; D85-L228 PolarHBondContact OD2-N 2.87Å
86	F	89.4	Confident	93	Very high	92 Å²	92	64.1 Å²	64.1	40%	0.404	34%	0.336	S	S	.	.	H	α-helix	trans	-58.2	-43.7	175	-179.5	-100.9	0	0	0	112.6	K84 H88 W89 E90	K84-F86 VanDerWaalsContact C-N 3.29Å; K84-F86 PolarHBondContact O-N 3.15Å; F86-H88 VanDerWaalsContact C-N 3.33Å; F86-W89 PolarHBondContact O-N 2.83Å; F86-E90 HydrophobicContact CE1-CG 4.38Å; F86-E90 HydrophobicContact CE2-CG 4.42Å; F86-E90 HydrophobicContact CZ-CG 4.13Å; F86-E90 PolarHBondContact O-N 3.39Å
87	I	91.6	Very high	92.9	Very high	123 Å²	123	65.6 Å²	65.6	63%	0.631	34%	0.336	S	S	*	.	H	α-helix	trans	-65.9	-41.9	178.8	-60.5	171.9	0	0	0	110	K84 D85 S91	K84-I87 PolarHBondContact O-N 3.03Å; D85-I87 VanDerWaalsContact C-N 3.33Å; D85-I87 PolarHBondContact O-N 2.72Å; I87-S91 PolarHBondContact O-N 3.12Å
88	H	93.9	Very high	92.8	Very high	53 Å²	53	68.9 Å²	68.9	25%	0.245	35%	0.351	C	S	.	.	H	α-helix	trans	-65.8	-44.3	179.1	-73.8	-150.9	0	0	0	110.3	K84 D85 F86 E90 S91 L92 G223 M225 P226	K84-H88 PolarHBondContact O-N 3.36Å; D85-H88 PolarHBondContact O-N 3.37Å; F86-H88 VanDerWaalsContact C-N 3.33Å; H88-E90 PolarHBondContact O-N 3.27Å; H88-S91 WeakPolarHBondContact O-CA 3.4Å; H88-S91 WeakPolarHBondContact O-CB 3.46Å; H88-S91 PolarHBondContact O-N 3.01Å; H88-S91 PolarHBondContact O-OG 3.23Å; H88-L92 WeakPolarHBondContact O-CG 3.11Å; H88-L92 PolarHBondContact O-N 3.14Å; H88-G223 PolarHBondContact CE1-O 2.91Å; H88-M225 HydrophobicContact CB-CG 4.5Å; H88-M225 HydrophobicContact CB-SD 3.57Å; H88-M225 VanDerWaalsContact CB-SD 3.57Å; H88-M225 PolarHBondContact ND1-N 3.23Å; H88-M225 VanDerWaalsContact ND1-N 3.13Å; H88-P226 WeakPolarHBondContact ND1-CD 3.49Å
89	W	94.7	Very high	92.7	Very high	13 Å²	13	61.8 Å²	61.8	5%	0.049	32%	0.318	C	S	.	.	H	α-helix	trans	-54.7	-47.6	179.4	-176.8	-105.6	0	0	0	112.8	D85 F86 S91 L92 R97 I100 S101 Y156 M225	D85-W89 VanDerWaalsContact O-CB 3.29Å; D85-W89 WeakPolarHBondContact O-CB 3.34Å; D85-W89 PolarHBondContact O-N 3.42Å; F86-W89 PolarHBondContact O-N 2.83Å; W89-S91 PolarHBondContact O-N 2.91Å; W89-L92 HydrophobicContact CE3-CD1 3.88Å; W89-L92 HydrophobicContact CZ3-CD1 4.31Å; W89-L92 WeakPolarHBondContact O-CB 3.45Å; W89-L92 PolarHBondContact O-N 3.1Å; W89-R97 HydrophobicContact CD2-CG 4.22Å; W89-R97 HydrophobicContact CE3-CG 4.34Å; W89-R97 HydrophobicContact CH2-CB 3.95Å; W89-R97 HydrophobicContact CH2-CG 4.17Å; W89-R97 HydrophobicContact CZ2-CB 3.96Å; W89-R97 HydrophobicContact CZ2-CG 4.03Å; W89-R97 HydrophobicContact CZ3-CB 4.45Å; W89-R97 HydrophobicContact CZ3-CG 4.32Å; W89-R97 WeakPolarHBondContact O-CD 3.45Å; W89-I100 HydrophobicContact CH2-CB 4.33Å; W89-I100 HydrophobicContact CH2-CG2 4.36Å; W89-I100 HydrophobicContact CZ3-CB 3.87Å; W89-I100 HydrophobicContact CZ3-CD1 4.14Å; W89-I100 HydrophobicContact CZ3-CG2 3.73Å; W89-S101 WeakPolarHBondContact CH2-OG 3.46Å; W89-Y156 HydrophobicContact CD2-CG 4.15Å; W89-Y156 HydrophobicContact CE3-CD2 4.24Å; W89-Y156 HydrophobicContact CE3-CG 4.07Å; W89-Y156 HydrophobicContact CZ3-CD2 4.23Å; W89-Y156 HydrophobicContact CZ3-CG 4.38Å; W89-Y156 PolarHBondContact NE1-O 3.44Å; W89-M225 HydrophobicContact CB-CE 4.2Å; W89-M225 HydrophobicContact CB-SD 4.23Å; W89-M225 HydrophobicContact CE3-CE 3.83Å; W89-M225 HydrophobicContact CE3-SD 4.4Å
90	E	91.9	Very high	92.9	Very high	103 Å²	103	59.3 Å²	59.3	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-24.7	178.2	-69.6	-57.7	142	0	0	113.2	F86 H88 R97	F86-E90 HydrophobicContact CE1-CG 4.38Å; F86-E90 HydrophobicContact CE2-CG 4.42Å; F86-E90 HydrophobicContact CZ-CG 4.13Å; F86-E90 PolarHBondContact O-N 3.39Å; H88-E90 PolarHBondContact O-N 3.27Å; E90-R97 IonicContact OE2-NH1 2.59Å
91	S	92.6	Very high	92.9	Very high	83 Å²	83	58.9 Å²	58.9	58%	0.58	30%	0.304	S	S	*	.	H	α-helix	trans	-86	-12.8	177.9	77.8	0	0	0	0	114.3	I87 H88 W89	I87-S91 PolarHBondContact O-N 3.12Å; H88-S91 WeakPolarHBondContact O-CA 3.4Å; H88-S91 WeakPolarHBondContact O-CB 3.46Å; H88-S91 PolarHBondContact O-N 3.01Å; H88-S91 PolarHBondContact O-OG 3.23Å; W89-S91 PolarHBondContact O-N 2.91Å
92	L	94	Very high	92.9	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.052	29%	0.289	C	S	.	.	S	Bend	trans	-69.5	148.7	-178.1	-70.4	-179.4	0	0	0	111.9	H88 W89 E96 R97 I100 L224 M225	H88-L92 WeakPolarHBondContact O-CG 3.11Å; H88-L92 PolarHBondContact O-N 3.14Å; W89-L92 HydrophobicContact CE3-CD1 3.88Å; W89-L92 HydrophobicContact CZ3-CD1 4.31Å; W89-L92 WeakPolarHBondContact O-CB 3.45Å; W89-L92 PolarHBondContact O-N 3.1Å; L92-E96 HydrophobicContact CB-CB 4.22Å; L92-E96 HydrophobicContact CD2-CB 4.39Å; L92-R97 HydrophobicContact CB-CG 3.68Å; L92-R97 HydrophobicContact CD1-CG 4.29Å; L92-I100 HydrophobicContact CD1-CD1 3.53Å; L92-L224 HydrophobicContact CD2-CD1 3.86Å; L92-L224 HydrophobicContact CD2-CD2 4.36Å; L92-L224 HydrophobicContact CD2-CG 4.5Å; L92-M225 HydrophobicContact CD1-CG 4.18Å; L92-M225 HydrophobicContact CD1-SD 4Å
93	K	93.4	Very high	92.8	Very high	149 Å²	149	55.9 Å²	55.9	65%	0.648	28%	0.284	S	S	*	.			trans	-65.6	153.5	171.7	-63.5	175.3	-176.5	172.2	0	109.9	G95 E96 R97	K93-G95 PolarHBondContact O-N 3.5Å; K93-E96 HydrophobicContact CB-CG 4.15Å; K93-E96 WeakPolarHBondContact CB-OE2 3.48Å; K93-E96 PolarHBondContact N-OE2 3.47Å; K93-E96 WeakPolarHBondContact O-CB 3.36Å; K93-E96 PolarHBondContact O-N 3.18Å; K93-R97 PolarHBondContact O-N 2.96Å
94	V	92.5	Very high	92.9	Very high	110 Å²	110	52.1 Å²	52.1	67%	0.667	26%	0.258	S	S	*	.	H	α-helix	trans	-53.7	-42.5	177.9	178.8	0	0	0	0	111.9	E96 R97 H98	V94-E96 VanDerWaalsContact C-N 3.34Å; V94-E96 PolarHBondContact O-N 2.92Å; V94-R97 PolarHBondContact O-N 2.94Å; V94-H98 WeakPolarHBondContact O-CB 3.4Å; V94-H98 PolarHBondContact O-N 3.41Å
95	G	92.1	Very high	92.8	Very high	23 Å²	23	46.3 Å²	46.3	24%	0.237	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-34.6	176.8	0	0	0	0	0	113.9	K93 F99	K93-G95 PolarHBondContact O-N 3.5Å; G95-F99 WeakPolarHBondContact O-CB 3.39Å; G95-F99 PolarHBondContact O-N 3.25Å
96	E	93.9	Very high	92.5	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-72.6	-43.9	178.1	-64	171	146.6	0	0	110.9	L92 K93 V94 H98 F99 I100 R222 I286	L92-E96 HydrophobicContact CB-CB 4.22Å; L92-E96 HydrophobicContact CD2-CB 4.39Å; K93-E96 HydrophobicContact CB-CG 4.15Å; K93-E96 WeakPolarHBondContact CB-OE2 3.48Å; K93-E96 PolarHBondContact N-OE2 3.47Å; K93-E96 WeakPolarHBondContact O-CB 3.36Å; K93-E96 PolarHBondContact O-N 3.18Å; V94-E96 VanDerWaalsContact C-N 3.34Å; V94-E96 PolarHBondContact O-N 2.92Å; E96-H98 VanDerWaalsContact C-N 3.35Å; E96-F99 PolarHBondContact O-N 2.7Å; E96-I100 VanDerWaalsContact O-CG1 3.27Å; E96-I100 WeakPolarHBondContact O-CG1 3.15Å; E96-I100 PolarHBondContact O-N 2.93Å; E96-R222 IonicContact OE1-CZ 3.55Å; E96-R222 IonicContact OE1-NH1 3.94Å; E96-R222 PolarHBondContact OE1-NH1 3.02Å; E96-R222 IonicContact OE1-NH2 3.98Å; E96-R222 PolarHBondContact OE1-NH2 3.13Å; E96-I286 HydrophobicContact CB-CG2 4.42Å; E96-I286 HydrophobicContact CG-CG2 4.23Å
97	R	94.1	Very high	92.6	Very high	73 Å²	73	42 Å²	42	28%	0.275	21%	0.214	S	C	.	.	H	α-helix	trans	-59.9	-46.3	173.3	-68.8	-167.3	-69.9	-166.7	-1.2	111.3	W89 E90 L92 K93 V94 F99 I100 S101	W89-R97 HydrophobicContact CD2-CG 4.22Å; W89-R97 HydrophobicContact CE3-CG 4.34Å; W89-R97 HydrophobicContact CH2-CB 3.95Å; W89-R97 HydrophobicContact CH2-CG 4.17Å; W89-R97 HydrophobicContact CZ2-CB 3.96Å; W89-R97 HydrophobicContact CZ2-CG 4.03Å; W89-R97 HydrophobicContact CZ3-CB 4.45Å; W89-R97 HydrophobicContact CZ3-CG 4.32Å; W89-R97 WeakPolarHBondContact O-CD 3.45Å; E90-R97 IonicContact OE2-NH1 2.59Å; L92-R97 HydrophobicContact CB-CG 3.68Å; L92-R97 HydrophobicContact CD1-CG 4.29Å; K93-R97 PolarHBondContact O-N 2.96Å; V94-R97 PolarHBondContact O-N 2.94Å; R97-F99 PolarHBondContact O-N 3.16Å; R97-I100 PolarHBondContact O-N 3.33Å; R97-S101 WeakPolarHBondContact O-CB 3.36Å; R97-S101 PolarHBondContact O-N 3.4Å; R97-S101 PolarHBondContact O-OG 3.05Å; R97-S101 VanDerWaalsContact O-OG 3.04Å
98	H	91.9	Very high	92.5	Very high	77 Å²	77	37.2 Å²	37.2	36%	0.356	19%	0.194	S	C	.	.	H	α-helix	trans	-57.8	-47.4	176.9	-179.7	68.2	0	0	0	111.9	V94 E96 Y102	V94-H98 WeakPolarHBondContact O-CB 3.4Å; V94-H98 PolarHBondContact O-N 3.41Å; E96-H98 VanDerWaalsContact C-N 3.35Å; H98-Y102 AromaticContact CE1-CD2 3.87Å; H98-Y102 AromaticContact CE1-CE1 3.68Å; H98-Y102 AromaticContact CE1-CE2 3.44Å; H98-Y102 VanDerWaalsContact CE1-CE2 3.44Å; H98-Y102 WeakPolarHBondContact CE1-CE2 3.26Å; H98-Y102 AromaticContact CE1-CZ 3.35Å; H98-Y102 AromaticContact ND1-CD2 3.91Å; H98-Y102 AromaticContact ND1-CE2 3.61Å; H98-Y102 AromaticContact ND1-CZ 3.99Å; H98-Y102 WeakPolarHBondContact O-CB 3.32Å; H98-Y102 WeakPolarHBondContact O-CD2 3.5Å; H98-Y102 PolarHBondContact O-N 3.48Å; H98-Y102 VanDerWaalsContact O-N 3.15Å
99	F	94	Very high	92.1	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-51.6	177.2	-176	-86.4	0	0	0	111.8	G95 E96 R97 Y102 V103 A215 L277 L281 V283 L285 I286	G95-F99 WeakPolarHBondContact O-CB 3.39Å; G95-F99 PolarHBondContact O-N 3.25Å; E96-F99 PolarHBondContact O-N 2.7Å; R97-F99 PolarHBondContact O-N 3.16Å; F99-Y102 PolarHBondContact O-N 2.99Å; F99-V103 HydrophobicContact CD1-CG2 4.02Å; F99-V103 HydrophobicContact CE1-CG2 3.55Å; F99-V103 HydrophobicContact CE2-CG2 4.44Å; F99-V103 HydrophobicContact CZ-CG2 3.78Å; F99-V103 WeakPolarHBondContact O-CG2 3.28Å; F99-V103 PolarHBondContact O-N 3.37Å; F99-A215 HydrophobicContact CE1-CB 3.55Å; F99-A215 HydrophobicContact CZ-CB 3.5Å; F99-L277 HydrophobicContact CZ-CD2 4.4Å; F99-L281 HydrophobicContact CD2-CD1 4.29Å; F99-L281 HydrophobicContact CD2-CD2 4.12Å; F99-L281 HydrophobicContact CD2-CG 3.69Å; F99-L281 HydrophobicContact CE2-CD2 4.16Å; F99-L281 HydrophobicContact CE2-CG 3.92Å; F99-L281 WeakPolarHBondContact CE2-O 3.47Å; F99-L281 HydrophobicContact CG-CG 4.48Å; F99-V283 HydrophobicContact CE2-CB 4.39Å; F99-V283 HydrophobicContact CE2-CG1 3.84Å; F99-V283 HydrophobicContact CZ-CG1 3.92Å; F99-L285 HydrophobicContact CB-CB 4.26Å; F99-L285 HydrophobicContact CB-CD1 4.45Å; F99-L285 HydrophobicContact CD2-CB 4.42Å; F99-L285 HydrophobicContact CD2-CD1 4.48Å; F99-I286 HydrophobicContact CB-CG2 3.8Å; F99-I286 HydrophobicContact CD1-CD1 4.21Å; F99-I286 HydrophobicContact CD1-CG2 3.6Å; F99-I286 HydrophobicContact CD2-CG2 4.43Å; F99-I286 HydrophobicContact CE1-CD1 3.85Å; F99-I286 HydrophobicContact CE1-CG2 4.34Å; F99-I286 HydrophobicContact CG-CG2 3.67Å; F99-I286 HydrophobicContact CZ-CD1 4.17Å
100	I	94.7	Very high	91.9	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-45.5	-177.6	-63.6	163.4	0	0	0	111.1	W89 L92 E96 R97 Y102 V103 L104 L219 L228	W89-I100 HydrophobicContact CH2-CB 4.33Å; W89-I100 HydrophobicContact CH2-CG2 4.36Å; W89-I100 HydrophobicContact CZ3-CB 3.87Å; W89-I100 HydrophobicContact CZ3-CD1 4.14Å; W89-I100 HydrophobicContact CZ3-CG2 3.73Å; L92-I100 HydrophobicContact CD1-CD1 3.53Å; E96-I100 VanDerWaalsContact O-CG1 3.27Å; E96-I100 WeakPolarHBondContact O-CG1 3.15Å; E96-I100 PolarHBondContact O-N 2.93Å; R97-I100 PolarHBondContact O-N 3.33Å; I100-Y102 VanDerWaalsContact C-N 3.25Å; I100-Y102 PolarHBondContact O-N 2.88Å; I100-V103 PolarHBondContact O-N 3.36Å; I100-L104 HydrophobicContact CG2-CD1 3.87Å; I100-L104 HydrophobicContact CG2-CG 4.19Å; I100-L104 VanDerWaalsContact O-CG 3.31Å; I100-L104 WeakPolarHBondContact O-CG 3.39Å; I100-L104 PolarHBondContact O-N 2.81Å; I100-L219 HydrophobicContact CD1-CD1 3.5Å; I100-L219 HydrophobicContact CG1-CD1 3.66Å; I100-L228 HydrophobicContact CG2-CD2 3.75Å
101	S	93	Very high	91.8	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.014	17%	0.166	C	C	.	.	H	α-helix	trans	-55.1	-43.5	177.9	-68	0	0	0	0	111.7	W89 R97 A105	W89-S101 WeakPolarHBondContact CH2-OG 3.46Å; R97-S101 WeakPolarHBondContact O-CB 3.36Å; R97-S101 PolarHBondContact O-N 3.4Å; R97-S101 PolarHBondContact O-OG 3.05Å; R97-S101 VanDerWaalsContact O-OG 3.04Å; S101-A105 WeakPolarHBondContact O-CB 3.24Å; S101-A105 PolarHBondContact O-N 2.92Å
102	Y	91.4	Very high	91.6	Very high	48 Å²	48	27.9 Å²	27.9	19%	0.188	15%	0.153	C	C	.	.	H	α-helix	trans	-76.1	-34.5	-177.4	-84.4	-134.9	0	0	0	112.5	H98 F99 I100 F106 F165 L166 L173 L281	H98-Y102 AromaticContact CE1-CD2 3.87Å; H98-Y102 AromaticContact CE1-CE1 3.68Å; H98-Y102 AromaticContact CE1-CE2 3.44Å; H98-Y102 VanDerWaalsContact CE1-CE2 3.44Å; H98-Y102 WeakPolarHBondContact CE1-CE2 3.26Å; H98-Y102 AromaticContact CE1-CZ 3.35Å; H98-Y102 AromaticContact ND1-CD2 3.91Å; H98-Y102 AromaticContact ND1-CE2 3.61Å; H98-Y102 AromaticContact ND1-CZ 3.99Å; H98-Y102 WeakPolarHBondContact O-CB 3.32Å; H98-Y102 WeakPolarHBondContact O-CD2 3.5Å; H98-Y102 PolarHBondContact O-N 3.48Å; H98-Y102 VanDerWaalsContact O-N 3.15Å; F99-Y102 PolarHBondContact O-N 2.99Å; I100-Y102 VanDerWaalsContact C-N 3.25Å; I100-Y102 PolarHBondContact O-N 2.88Å; Y102-F106 WeakPolarHBondContact O-CB 3.07Å; Y102-F106 PolarHBondContact O-N 2.98Å; Y102-F165 HydrophobicContact CE2-CE1 4.46Å; Y102-L166 HydrophobicContact CD2-CD2 3.76Å; Y102-L166 HydrophobicContact CE2-CD2 3.86Å; Y102-L173 HydrophobicContact CD1-CD1 3.5Å; Y102-L173 VanDerWaalsContact CD1-CD1 3.5Å; Y102-L173 HydrophobicContact CD1-CD2 4.21Å; Y102-L173 HydrophobicContact CE1-CD1 3.52Å; Y102-L173 HydrophobicContact CE1-CD2 3.39Å; Y102-L173 HydrophobicContact CE1-CG 4.11Å; Y102-L173 HydrophobicContact CG-CD1 4.13Å; Y102-L281 HydrophobicContact CD1-CD1 4.07Å; Y102-L281 HydrophobicContact CG-CD1 4.13Å
103	V	92.8	Very high	91.5	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-44.8	171.6	167.4	0	0	0	0	111.1	F99 I100 A105 F106 F107 I216 L281	F99-V103 HydrophobicContact CD1-CG2 4.02Å; F99-V103 HydrophobicContact CE1-CG2 3.55Å; F99-V103 HydrophobicContact CE2-CG2 4.44Å; F99-V103 HydrophobicContact CZ-CG2 3.78Å; F99-V103 WeakPolarHBondContact O-CG2 3.28Å; F99-V103 PolarHBondContact O-N 3.37Å; I100-V103 PolarHBondContact O-N 3.36Å; V103-A105 VanDerWaalsContact C-N 3.35Å; V103-A105 PolarHBondContact O-N 2.97Å; V103-F106 WeakPolarHBondContact O-CB 3.35Å; V103-F106 PolarHBondContact O-N 3.49Å; V103-F107 HydrophobicContact CG1-CD2 3.78Å; V103-F107 HydrophobicContact CG1-CE1 4.4Å; V103-F107 HydrophobicContact CG1-CE2 3.4Å; V103-F107 VanDerWaalsContact CG1-CE2 3.4Å; V103-F107 HydrophobicContact CG1-CG 4.48Å; V103-F107 HydrophobicContact CG1-CZ 3.77Å; V103-F107 WeakPolarHBondContact O-CG 3.13Å; V103-F107 PolarHBondContact O-N 3.26Å; V103-I216 HydrophobicContact CG1-CD1 4.03Å; V103-L281 HydrophobicContact CG2-CD2 3.69Å
104	L	93.4	Very high	91.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.3	-41.8	177.5	-69	175.2	0	0	0	111.9	I100 F106 F107 A108 Y149 L152 I153 Y156 L228	I100-L104 HydrophobicContact CG2-CD1 3.87Å; I100-L104 HydrophobicContact CG2-CG 4.19Å; I100-L104 VanDerWaalsContact O-CG 3.31Å; I100-L104 WeakPolarHBondContact O-CG 3.39Å; I100-L104 PolarHBondContact O-N 2.81Å; L104-F106 VanDerWaalsContact C-N 3.29Å; L104-F106 PolarHBondContact O-N 2.96Å; L104-F107 PolarHBondContact O-N 3.28Å; L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3.22Å; L104-Y149 HydrophobicContact CD2-CD1 3.83Å; L104-Y149 HydrophobicContact CD2-CE1 4.29Å; L104-L152 HydrophobicContact CD1-CB 4.05Å; L104-L152 HydrophobicContact CD2-CB 4.11Å; L104-L152 HydrophobicContact CD2-CD1 3.83Å; L104-I153 HydrophobicContact CB-CD1 4.2Å; L104-I153 HydrophobicContact CB-CG1 3.8Å; L104-I153 HydrophobicContact CD1-CG1 4.42Å; L104-Y156 HydrophobicContact CD1-CD2 3.77Å; L104-Y156 HydrophobicContact CD1-CE2 4.02Å; L104-L228 HydrophobicContact CD2-CD1 3.88Å
105	A	89.4	Confident	91.6	Very high	2 Å²	2	17 Å²	17	2%	0.017	10%	0.098	C	C	.	.	H	α-helix	trans	-61.9	-38.2	175.4	0	0	0	0	0	112.4	S101 V103 A109 L166 A169	S101-A105 WeakPolarHBondContact O-CB 3.24Å; S101-A105 PolarHBondContact O-N 2.92Å; V103-A105 VanDerWaalsContact C-N 3.35Å; V103-A105 PolarHBondContact O-N 2.97Å; A105-A109 WeakPolarHBondContact O-CB 3.47Å; A105-A109 PolarHBondContact O-N 3.33Å; A105-L166 HydrophobicContact CB-CB 3.88Å; A105-L166 HydrophobicContact CB-CD2 3.75Å; A105-L166 HydrophobicContact CB-CG 4.38Å; A105-L166 WeakPolarHBondContact CB-O 3.46Å; A105-A169 HydrophobicContact CB-CB 3.81Å
106	F	88.3	Confident	91.6	Very high	1 Å²	1	20.2 Å²	20.2	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-63.1	-51.2	173	163.3	-104.8	0	0	0	111.5	Y102 V103 L104 A109 S110 V176 K179 F209 F276	Y102-F106 WeakPolarHBondContact O-CB 3.07Å; Y102-F106 PolarHBondContact O-N 2.98Å; V103-F106 WeakPolarHBondContact O-CB 3.35Å; V103-F106 PolarHBondContact O-N 3.49Å; L104-F106 VanDerWaalsContact C-N 3.29Å; L104-F106 PolarHBondContact O-N 2.96Å; F106-A109 WeakPolarHBondContact O-CB 3.29Å; F106-A109 PolarHBondContact O-N 3.45Å; F106-S110 WeakPolarHBondContact CE2-OG 3.38Å; F106-S110 WeakPolarHBondContact CZ-OG 3.26Å; F106-S110 WeakPolarHBondContact O-CB 3.41Å; F106-S110 PolarHBondContact O-N 2.97Å; F106-S110 PolarHBondContact O-OG 2.92Å; F106-V176 HydrophobicContact CB-CG2 4.25Å; F106-V176 HydrophobicContact CD2-CG1 4.29Å; F106-K179 HydrophobicContact CD2-CD 4.05Å; F106-K179 HydrophobicContact CE2-CB 4.1Å; F106-K179 HydrophobicContact CE2-CD 3.31Å; F106-K179 HydrophobicContact CE2-CG 4.36Å; F106-K179 HydrophobicContact CZ-CD 3.75Å; F106-F209 HydrophobicContact CE1-CD1 4.29Å; F106-F209 HydrophobicContact CE1-CE1 4.5Å; F106-F276 HydrophobicContact CB-CZ 4.23Å; F106-F276 HydrophobicContact CG-CZ 4.16Å
107	F	91.2	Very high	91.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-49	-179.5	-68.1	-31.2	0	0	0	112.8	V103 L104 A109 S110 D111 Y149 F209 S212 F213 I216	V103-F107 HydrophobicContact CG1-CD2 3.78Å; V103-F107 HydrophobicContact CG1-CE1 4.4Å; V103-F107 HydrophobicContact CG1-CE2 3.4Å; V103-F107 VanDerWaalsContact CG1-CE2 3.4Å; V103-F107 HydrophobicContact CG1-CG 4.48Å; V103-F107 HydrophobicContact CG1-CZ 3.77Å; V103-F107 WeakPolarHBondContact O-CG 3.13Å; V103-F107 PolarHBondContact O-N 3.26Å; L104-F107 PolarHBondContact O-N 3.28Å; F107-A109 PolarHBondContact O-N 2.96Å; F107-A109 VanDerWaalsContact O-N 3.11Å; F107-S110 PolarHBondContact O-N 3.45Å; F107-D111 PolarHBondContact O-N 2.98Å; F107-Y149 HydrophobicContact CB-CD1 3.88Å; F107-Y149 HydrophobicContact CB-CD2 3.7Å; F107-Y149 HydrophobicContact CB-CE1 3.72Å; F107-Y149 HydrophobicContact CB-CE2 3.52Å; F107-Y149 HydrophobicContact CB-CG 3.87Å; F107-Y149 HydrophobicContact CD2-CD1 4Å; F107-Y149 AromaticContact CD2-CE1 3.26Å; F107-Y149 HydrophobicContact CD2-CE1 3.26Å; F107-Y149 HydrophobicContact CD2-CE2 4.34Å; F107-Y149 AromaticContact CD2-CZ 3.44Å; F107-Y149 VanDerWaalsContact CD2-CZ 3.44Å; F107-Y149 WeakPolarHBondContact CD2-OH 3.38Å; F107-Y149 HydrophobicContact CE2-CE1 4.04Å; F107-Y149 HydrophobicContact CG-CD1 4.44Å; F107-Y149 AromaticContact CG-CE1 3.86Å; F107-Y149 HydrophobicContact CG-CE1 3.86Å; F107-Y149 HydrophobicContact CG-CE2 4.14Å; F107-Y149 AromaticContact CG-CZ 3.65Å; F107-F209 AromaticContact CD1-CD1 3.6Å; F107-F209 HydrophobicContact CD1-CD1 3.6Å; F107-F209 AromaticContact CD1-CE1 3.97Å; F107-F209 HydrophobicContact CD1-CE1 3.97Å; F107-F209 HydrophobicContact CE1-CB 4.47Å; F107-F209 AromaticContact CE1-CD1 3.64Å; F107-F209 HydrophobicContact CE1-CD1 3.64Å; F107-F209 HydrophobicContact CE1-CE1 4.45Å; F107-S212 VanDerWaalsContact CE1-CB 3.43Å; F107-F213 HydrophobicContact CE1-CD1 4.33Å; F107-F213 HydrophobicContact CE1-CE1 4.07Å; F107-F213 HydrophobicContact CE2-CD1 4.17Å; F107-F213 HydrophobicContact CE2-CE1 4.09Å; F107-F213 AromaticContact CZ-CD1 3.57Å; F107-F213 HydrophobicContact CZ-CD1 3.57Å; F107-F213 AromaticContact CZ-CE1 3.59Å; F107-F213 HydrophobicContact CZ-CE1 3.59Å; F107-I216 HydrophobicContact CE2-CD1 3.69Å; F107-I216 HydrophobicContact CZ-CD1 4.44Å
108	A	89	Confident	91.6	Very high	23 Å²	23	17 Å²	17	19%	0.19	10%	0.095	C	C	.	.	H	α-helix	trans	-56.4	-33.4	178.2	0	0	0	0	0	112.9	L104 I153	L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3.22Å; A108-I153 HydrophobicContact CB-CD1 4.07Å
109	A	86.9	Confident	91.6	Very high	16 Å²	16	16.9 Å²	16.9	13%	0.132	10%	0.097	C	C	.	.	H	α-helix	trans	-78.4	-39.3	176.5	0	0	0	0	0	113.2	A105 F106 F107 I170	A105-A109 WeakPolarHBondContact O-CB 3.47Å; A105-A109 PolarHBondContact O-N 3.33Å; F106-A109 WeakPolarHBondContact O-CB 3.29Å; F106-A109 PolarHBondContact O-N 3.45Å; F107-A109 PolarHBondContact O-N 2.96Å; F107-A109 VanDerWaalsContact O-N 3.11Å; A109-I170 HydrophobicContact CB-CD1 3.76Å; A109-I170 HydrophobicContact CB-CG1 3.55Å
110	S	88.5	Confident	91.3	Very high	10 Å²	10	21.8 Å²	21.8	7%	0.07	12%	0.12	C	C	.	.	H	α-helix	trans	-75.2	-39.6	-174.6	-71.4	0	0	0	0	113.6	F106 F107 G112 I113 V114	F106-S110 WeakPolarHBondContact CE2-OG 3.38Å; F106-S110 WeakPolarHBondContact CZ-OG 3.26Å; F106-S110 WeakPolarHBondContact O-CB 3.41Å; F106-S110 PolarHBondContact O-N 2.97Å; F106-S110 PolarHBondContact O-OG 2.92Å; F107-S110 PolarHBondContact O-N 3.45Å; S110-G112 VanDerWaalsContact C-N 3.25Å; S110-G112 PolarHBondContact O-N 3.32Å; S110-I113 WeakPolarHBondContact O-CA 3.32Å; S110-I113 WeakPolarHBondContact O-CB 3.45Å; S110-I113 PolarHBondContact O-N 3.15Å; S110-V114 PolarHBondContact O-N 3.23Å
111	D	90.3	Very high	91	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-35.4	179.1	-64.5	11.6	0	0	0	111.5	F107 I113 V114 L115 H145 Y149 F209	F107-D111 PolarHBondContact O-N 2.98Å; D111-I113 VanDerWaalsContact C-N 3.25Å; D111-I113 PolarHBondContact O-N 3.02Å; D111-V114 WeakPolarHBondContact O-CB 3.43Å; D111-V114 PolarHBondContact O-N 3.48Å; D111-L115 WeakPolarHBondContact O-CB 3.35Å; D111-L115 PolarHBondContact O-N 3.03Å; D111-H145 WeakPolarHBondContact OD2-CB 3.33Å; D111-Y149 WeakPolarHBondContact OD2-CD2 3.47Å; D111-Y149 WeakPolarHBondContact OD2-CE2 3.25Å; D111-F209 WeakPolarHBondContact OD1-CE1 3.29Å
112	G	89.7	Confident	91	Very high	29 Å²	29	22.8 Å²	22.8	30%	0.299	12%	0.123	S	C	.	.	H	α-helix	trans	-59	-37.2	171.9	0	0	0	0	0	112.6	S110 E116	S110-G112 VanDerWaalsContact C-N 3.25Å; S110-G112 PolarHBondContact O-N 3.32Å; G112-E116 WeakPolarHBondContact O-CG 3.43Å; G112-E116 PolarHBondContact O-N 2.94Å; G112-E116 VanDerWaalsContact O-N 3.15Å
113	I	91.8	Very high	91	Very high	16 Å²	16	21.8 Å²	21.8	8%	0.082	12%	0.123	C	C	.	.	H	α-helix	trans	-71.9	-39.9	177.5	-61.6	169.4	0	0	0	110.9	S110 D111 L115 E116 N117 I170 A180 A183 L184 I187	S110-I113 WeakPolarHBondContact O-CA 3.32Å; S110-I113 WeakPolarHBondContact O-CB 3.45Å; S110-I113 PolarHBondContact O-N 3.15Å; D111-I113 VanDerWaalsContact C-N 3.25Å; D111-I113 PolarHBondContact O-N 3.02Å; I113-L115 VanDerWaalsContact C-N 3.34Å; I113-E116 PolarHBondContact O-N 3.31Å; I113-N117 PolarHBondContact O-N 3.27Å; I113-N117 VanDerWaalsContact O-N 3.08Å; I113-I170 HydrophobicContact CD1-CD1 4.26Å; I113-A180 HydrophobicContact CD1-CB 3.58Å; I113-A183 HydrophobicContact CG2-CB 3.75Å; I113-L184 HydrophobicContact CD1-CG 4.36Å; I113-L184 HydrophobicContact CG1-CD2 4.43Å; I113-L184 HydrophobicContact CG2-CD2 4.15Å; I113-L184 HydrophobicContact CG2-CG 4.3Å; I113-I187 HydrophobicContact CG2-CD1 3.44Å; I113-I187 VanDerWaalsContact CG2-CD1 3.44Å; I113-I187 WeakPolarHBondContact O-CD1 3.39Å
114	V	94	Very high	90.7	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.012	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-46.8	174.1	168.1	0	0	0	0	110.5	S110 D111 E116 N117 L118 E142 F201 V204 E205 F209	S110-V114 PolarHBondContact O-N 3.23Å; D111-V114 WeakPolarHBondContact O-CB 3.43Å; D111-V114 PolarHBondContact O-N 3.48Å; V114-E116 PolarHBondContact O-N 3.07Å; V114-N117 WeakPolarHBondContact O-CB 3.43Å; V114-N117 PolarHBondContact O-N 3.32Å; V114-L118 HydrophobicContact CG1-CD1 4.08Å; V114-L118 WeakPolarHBondContact O-CG 3.4Å; V114-L118 PolarHBondContact O-N 3.33Å; V114-E142 HydrophobicContact CG1-CG 4.17Å; V114-F201 HydrophobicContact CG1-CE2 3.98Å; V114-F201 HydrophobicContact CG1-CZ 4.18Å; V114-V204 HydrophobicContact CG2-CG1 3.78Å; V114-E205 VanDerWaalsContact CG1-OE1 3.24Å; V114-E205 WeakPolarHBondContact CG1-OE1 3.49Å; V114-F209 HydrophobicContact CG2-CE2 4.3Å; V114-F209 HydrophobicContact CG2-CZ 4.28Å
115	L	93.9	Very high	90.5	Very high	22 Å²	22	26.3 Å²	26.3	12%	0.115	14%	0.144	C	C	.	.	H	α-helix	trans	-58.8	-47.4	178.5	-177	65.4	0	0	0	112.4	D111 I113 N117 L118 L119 I139 E142 N143	D111-L115 WeakPolarHBondContact O-CB 3.35Å; D111-L115 PolarHBondContact O-N 3.03Å; I113-L115 VanDerWaalsContact C-N 3.34Å; L115-N117 VanDerWaalsContact C-N 3.32Å; L115-N117 PolarHBondContact O-N 2.99Å; L115-L118 PolarHBondContact O-N 3.2Å; L115-L119 HydrophobicContact CD1-CD1 4.11Å; L115-L119 HydrophobicContact CD1-CG 4.48Å; L115-L119 HydrophobicContact CG-CD1 4.01Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 2.96Å; L115-I139 HydrophobicContact CD1-CB 4.24Å; L115-I139 HydrophobicContact CD1-CG1 4.23Å; L115-I139 HydrophobicContact CD1-CG2 3.81Å; L115-E142 HydrophobicContact CD1-CB 4.27Å; L115-N143 WeakPolarHBondContact CD2-OD1 3.48Å
116	E	92.7	Very high	90.7	Very high	92 Å²	92	26.2 Å²	26.2	43%	0.43	14%	0.143	S	C	.	.	H	α-helix	trans	-60.7	-41.8	176.3	-70	-59.7	160.9	0	0	111.5	G112 I113 V114 L118 L119 E120	G112-E116 WeakPolarHBondContact O-CG 3.43Å; G112-E116 PolarHBondContact O-N 2.94Å; G112-E116 VanDerWaalsContact O-N 3.15Å; I113-E116 PolarHBondContact O-N 3.31Å; V114-E116 PolarHBondContact O-N 3.07Å; E116-L118 VanDerWaalsContact C-N 3.35Å; E116-L118 PolarHBondContact O-N 3.07Å; E116-L119 PolarHBondContact O-N 3.46Å; E116-E120 VanDerWaalsContact O-CB 3.3Å; E116-E120 WeakPolarHBondContact O-CB 3.44Å; E116-E120 WeakPolarHBondContact O-CG 3.16Å; E116-E120 PolarHBondContact O-N 3.21Å
117	N	92.8	Very high	90.8	Very high	12 Å²	12	26.7 Å²	26.7	6%	0.064	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-43.4	176.2	-162.5	10.3	0	0	0	112.3	I113 V114 L115 R121 F122 I187 F201	I113-N117 PolarHBondContact O-N 3.27Å; I113-N117 VanDerWaalsContact O-N 3.08Å; V114-N117 WeakPolarHBondContact O-CB 3.43Å; V114-N117 PolarHBondContact O-N 3.32Å; L115-N117 VanDerWaalsContact C-N 3.32Å; L115-N117 PolarHBondContact O-N 2.99Å; N117-R121 WeakPolarHBondContact O-CA 3.47Å; N117-R121 WeakPolarHBondContact O-CB 3.11Å; N117-R121 PolarHBondContact O-N 3.02Å; N117-R121 WeakPolarHBondContact OD1-CG 3.38Å; N117-F122 WeakPolarHBondContact ND2-CE2 3.45Å; N117-F122 PolarHBondContact O-N 3.18Å; N117-I187 HydrophobicContact CB-CD1 3.77Å; N117-I187 HydrophobicContact CB-CG1 3.66Å; N117-F201 VanDerWaalsContact ND2-CD2 3.27Å; N117-F201 WeakPolarHBondContact ND2-CD2 3.05Å
118	L	94.4	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-63.8	-42.1	178.5	-72.1	168.8	0	0	0	111.9	V114 L115 E116 S123 Y135 Q138 I139 E142 F201	V114-L118 HydrophobicContact CG1-CD1 4.08Å; V114-L118 WeakPolarHBondContact O-CG 3.4Å; V114-L118 PolarHBondContact O-N 3.33Å; L115-L118 PolarHBondContact O-N 3.2Å; E116-L118 VanDerWaalsContact C-N 3.35Å; E116-L118 PolarHBondContact O-N 3.07Å; L118-S123 WeakPolarHBondContact O-CB 3.4Å; L118-S123 PolarHBondContact O-N 2.95Å; L118-S123 PolarHBondContact O-OG 2.96Å; L118-Y135 HydrophobicContact CD2-CD1 3.74Å; L118-Y135 HydrophobicContact CD2-CE1 3.83Å; L118-Y135 HydrophobicContact CD2-CG 4.38Å; L118-Q138 HydrophobicContact CD1-CB 4.45Å; L118-Q138 HydrophobicContact CD1-CG 3.65Å; L118-I139 HydrophobicContact CB-CD1 4.31Å; L118-I139 HydrophobicContact CB-CG1 3.96Å; L118-I139 HydrophobicContact CD1-CG1 4.16Å; L118-E142 HydrophobicContact CD1-CG 4.16Å; L118-F201 HydrophobicContact CD1-CZ 4.47Å; L118-F201 HydrophobicContact CD2-CE1 4.1Å; L118-F201 HydrophobicContact CD2-CZ 3.68Å; L118-F201 HydrophobicContact CG-CZ 3.99Å
119	L	91.5	Very high	91	Very high	76 Å²	76	26.7 Å²	26.7	40%	0.398	14%	0.143	S	C	.	.	I	π-helix	trans	-78	-44.8	-176.5	-73.1	171.8	0	0	0	113.3	L115 E116 Q124 I139	L115-L119 HydrophobicContact CD1-CD1 4.11Å; L115-L119 HydrophobicContact CD1-CG 4.48Å; L115-L119 HydrophobicContact CG-CD1 4.01Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 2.96Å; E116-L119 PolarHBondContact O-N 3.46Å; L119-Q124 VanDerWaalsContact O-CG 3.31Å; L119-Q124 WeakPolarHBondContact O-CG 3.39Å; L119-Q124 PolarHBondContact O-NE2 2.79Å; L119-I139 HydrophobicContact CD2-CD1 3.68Å; L119-I139 HydrophobicContact CD2-CG1 4.37Å; L119-I139 HydrophobicContact CD2-CG2 4.39Å; L119-I139 HydrophobicContact CG-CD1 4.24Å
120	E	88.3	Confident	91.4	Very high	104 Å²	104	26 Å²	26	49%	0.486	14%	0.137	S	C	.	.	I	π-helix	trans	-81.4	-29.9	-175.9	-65.2	-163.1	156.1	0	0	112.7	E116	E116-E120 VanDerWaalsContact O-CB 3.3Å; E116-E120 WeakPolarHBondContact O-CB 3.44Å; E116-E120 WeakPolarHBondContact O-CG 3.16Å; E116-E120 PolarHBondContact O-N 3.21Å
121	R	88.3	Confident	91.8	Very high	25 Å²	25	25.5 Å²	25.5	9%	0.094	13%	0.134	C	C	.	.	I	π-helix	trans	-114.7	-80.7	-170.4	-50.6	-74.6	-73	178.9	-7.2	111	S34 N117 S123 Q124 E125 I187 D189 R197	S34-R121 PolarHBondContact OG-NH1 3.16Å; N117-R121 WeakPolarHBondContact O-CA 3.47Å; N117-R121 WeakPolarHBondContact O-CB 3.11Å; N117-R121 PolarHBondContact O-N 3.02Å; N117-R121 WeakPolarHBondContact OD1-CG 3.38Å; R121-S123 PolarHBondContact O-N 3.43Å; R121-Q124 PolarHBondContact O-N 3.05Å; R121-Q124 VanDerWaalsContact O-N 3.12Å; R121-E125 IonicContact CZ-OE1 2.75Å; R121-E125 WeakPolarHBondContact O-CB 3.46Å; R121-E125 VanDerWaalsContact O-CG 3.23Å; R121-E125 WeakPolarHBondContact O-CG 3.26Å; R121-E125 PolarHBondContact O-N 3.43Å; R121-I187 WeakPolarHBondContact CD-O 3.22Å; R121-I187 HydrophobicContact CG-CG2 4.22Å; R121-I187 PolarHBondContact NE-O 3.09Å; R121-D189 PolarHBondContact NH2-O 3.31Å; R121-R197 VanDerWaalsContact NH2-CZ 3.3Å; R121-R197 VanDerWaalsContact NH2-NE 3.12Å
122	F	92.8	Very high	91.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.148	C	C	.	.	I	π-helix	trans	-62.4	-41.7	-164.4	-70.9	-69.6	0	0	0	113.5	N117 Q124 E125 V126 Y135 F194 R197 L198 F201	N117-F122 WeakPolarHBondContact ND2-CE2 3.45Å; N117-F122 PolarHBondContact O-N 3.18Å; F122-Q124 VanDerWaalsContact C-N 3.31Å; F122-Q124 PolarHBondContact O-N 3.31Å; F122-E125 PolarHBondContact O-N 3.27Å; F122-V126 WeakPolarHBondContact O-CB 3.37Å; F122-V126 WeakPolarHBondContact O-CG2 3.47Å; F122-V126 PolarHBondContact O-N 3.37Å; F122-Y135 HydrophobicContact CB-CD2 4.4Å; F122-Y135 HydrophobicContact CB-CE2 3.64Å; F122-F194 HydrophobicContact CD1-CD2 4.4Å; F122-F194 AromaticContact CD1-CE2 3.52Å; F122-F194 HydrophobicContact CD1-CE2 3.52Å; F122-F194 AromaticContact CD1-CZ 3.79Å; F122-F194 HydrophobicContact CD1-CZ 3.79Å; F122-F194 HydrophobicContact CE1-CD2 4.4Å; F122-F194 AromaticContact CE1-CE2 3.83Å; F122-F194 HydrophobicContact CE1-CE2 3.83Å; F122-F194 HydrophobicContact CE1-CZ 4.02Å; F122-R197 HydrophobicContact CZ-CB 4.44Å; F122-L198 HydrophobicContact CE1-CB 4.3Å; F122-L198 HydrophobicContact CE1-CD1 3.99Å; F122-L198 HydrophobicContact CZ-CD1 4.33Å; F122-F201 HydrophobicContact CD2-CD1 4.46Å; F122-F201 HydrophobicContact CD2-CG 4.45Å; F122-F201 HydrophobicContact CE2-CB 3.77Å; F122-F201 AromaticContact CE2-CD1 3.89Å; F122-F201 HydrophobicContact CE2-CD1 3.89Å; F122-F201 AromaticContact CE2-CD2 3.92Å; F122-F201 HydrophobicContact CE2-CD2 3.92Å; F122-F201 HydrophobicContact CE2-CE1 4.48Å; F122-F201 HydrophobicContact CE2-CE2 4.48Å; F122-F201 AromaticContact CE2-CG 3.57Å; F122-F201 HydrophobicContact CE2-CG 3.57Å; F122-F201 HydrophobicContact CZ-CB 3.76Å; F122-F201 HydrophobicContact CZ-CD1 4.27Å; F122-F201 HydrophobicContact CZ-CG 4.02Å
123	S	90.5	Very high	92.2	Very high	26 Å²	26	29.5 Å²	29.5	18%	0.182	15%	0.145	C	C	.	.	H	α-helix	trans	-68.8	-28.9	-180	-62.7	0	0	0	0	113.3	L118 R121	L118-S123 WeakPolarHBondContact O-CB 3.4Å; L118-S123 PolarHBondContact O-N 2.95Å; L118-S123 PolarHBondContact O-OG 2.96Å; R121-S123 PolarHBondContact O-N 3.43Å
124	Q	87.3	Confident	92.5	Very high	96 Å²	96	28.8 Å²	28.8	45%	0.449	14%	0.141	S	C	.	.	H	α-helix	trans	-78.8	-37.9	178	-55.6	-166.8	16.7	0	0	111.6	L119 R121 F122 Q127	L119-Q124 VanDerWaalsContact O-CG 3.31Å; L119-Q124 WeakPolarHBondContact O-CG 3.39Å; L119-Q124 PolarHBondContact O-NE2 2.79Å; R121-Q124 PolarHBondContact O-N 3.05Å; R121-Q124 VanDerWaalsContact O-N 3.12Å; F122-Q124 VanDerWaalsContact C-N 3.31Å; F122-Q124 PolarHBondContact O-N 3.31Å; Q124-Q127 PolarHBondContact O-NE2 2.99Å
125	E	90.3	Very high	92.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-79.2	-46	-175	-68.8	171.3	162.4	0	0	113	S34 V35 L46 R121 F122 Q127 F194 R197	S34-E125 WeakPolarHBondContact CB-OE1 3.43Å; S34-E125 PolarHBondContact OG-OE1 3.18Å; V35-E125 HydrophobicContact CG1-CG 4.23Å; L46-E125 HydrophobicContact CD2-CB 4.17Å; R121-E125 IonicContact CZ-OE1 2.75Å; R121-E125 WeakPolarHBondContact O-CB 3.46Å; R121-E125 VanDerWaalsContact O-CG 3.23Å; R121-E125 WeakPolarHBondContact O-CG 3.26Å; R121-E125 PolarHBondContact O-N 3.43Å; F122-E125 PolarHBondContact O-N 3.27Å; E125-Q127 PolarHBondContact O-NE2 3.45Å; E125-F194 HydrophobicContact CB-CE2 4.37Å; E125-F194 WeakPolarHBondContact OE2-CD2 3.14Å; E125-R197 IonicContact OE1-CZ 2.94Å; E125-R197 IonicContact OE1-NH1 3.85Å; E125-R197 PolarHBondContact OE1-NH1 3.3Å; E125-R197 IonicContact OE1-NH2 3.45Å; E125-R197 PolarHBondContact OE1-NH2 3.27Å; E125-R197 IonicContact OE2-CZ 3.82Å; E125-R197 IonicContact OE2-NH1 3.08Å; E125-R197 PolarHBondContact OE2-NH1 3.23Å; E125-R197 IonicContact OE2-NH2 3.04Å; E125-R197 PolarHBondContact OE2-NH2 2.74Å
126	V	92.1	Very high	92.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.			trans	-71.4	133.7	-178.9	177.7	0	0	0	0	110.3	L45 F122 I128 V131 R132 Y135 F194	L45-V126 WeakPolarHBondContact O-CA 3.35Å; F122-V126 WeakPolarHBondContact O-CB 3.37Å; F122-V126 WeakPolarHBondContact O-CG2 3.47Å; F122-V126 PolarHBondContact O-N 3.37Å; V126-I128 HydrophobicContact CG1-CB 4.3Å; V126-V131 HydrophobicContact CB-CG1 4.3Å; V126-V131 HydrophobicContact CG1-CB 3.67Å; V126-V131 HydrophobicContact CG1-CG1 3.61Å; V126-V131 HydrophobicContact CG1-CG2 4.15Å; V126-V131 HydrophobicContact CG2-CG1 4.41Å; V126-R132 PolarHBondContact O-NE 2.93Å; V126-R132 PolarHBondContact O-NH2 3.44Å; V126-Y135 HydrophobicContact CB-CE2 4.49Å; V126-Y135 HydrophobicContact CG2-CE2 4.1Å; V126-F194 HydrophobicContact CG2-CE2 3.97Å; V126-F194 HydrophobicContact CG2-CZ 3.72Å
127	Q	90.1	Very high	92.9	Very high	10 Å²	10	27 Å²	27	5%	0.047	14%	0.144	C	C	.	.			trans	-102.8	-18.8	-177.8	-59.2	-49.6	-58.3	0	0	113.8	L45 L46 K47 N49 Q124 E125 P129	L45-Q127 PolarHBondContact O-N 2.87Å; L46-Q127 WeakPolarHBondContact O-CG 3.48Å; K47-Q127 WeakPolarHBondContact O-CB 3.42Å; K47-Q127 WeakPolarHBondContact O-CG 3.49Å; N49-Q127 PolarHBondContact ND2-O 2.9Å; N49-Q127 PolarHBondContact OD1-O 3.44Å; Q124-Q127 PolarHBondContact O-NE2 2.99Å; E125-Q127 PolarHBondContact O-NE2 3.45Å; Q127-P129 WeakPolarHBondContact O-CD 3.16Å
128	I	92.3	Very high	93.1	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.031	14%	0.141	C	C	.	.			trans	-67.7	121.1	-178.8	-62.2	175.3	0	0	0	110.4	L45 Y60 V126 E130 V131 R132	L45-I128 HydrophobicContact CB-CD1 4.46Å; L45-I128 HydrophobicContact CD2-CD1 3.4Å; L45-I128 HydrophobicContact CG-CD1 4.46Å; Y60-I128 HydrophobicContact CD1-CD1 4.36Å; Y60-I128 HydrophobicContact CD2-CD1 4.04Å; Y60-I128 HydrophobicContact CD2-CG2 3.69Å; Y60-I128 HydrophobicContact CE1-CD1 3.91Å; Y60-I128 HydrophobicContact CE2-CD1 3.56Å; Y60-I128 HydrophobicContact CE2-CG1 4.07Å; Y60-I128 HydrophobicContact CE2-CG2 4.1Å; Y60-I128 HydrophobicContact CG-CD1 4.42Å; Y60-I128 HydrophobicContact CG-CG2 4.22Å; Y60-I128 VanDerWaalsContact CZ-CD1 3.48Å; V126-I128 HydrophobicContact CG1-CB 4.3Å; I128-E130 VanDerWaalsContact C-N 3.32Å; I128-E130 HydrophobicContact CG2-CB 4.15Å; I128-E130 WeakPolarHBondContact CG2-OE2 3.16Å; I128-E130 PolarHBondContact O-N 2.72Å; I128-V131 HydrophobicContact CB-CB 4.29Å; I128-V131 HydrophobicContact CB-CG2 3.88Å; I128-V131 HydrophobicContact CG2-CG2 3.9Å; I128-V131 PolarHBondContact O-N 3.17Å; I128-R132 PolarHBondContact O-N 3.4Å; I128-R132 VanDerWaalsContact O-N 3.14Å
129	P	92.8	Very high	93.3	Very high	18 Å²	18	28 Å²	28	12%	0.117	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-39.4	-178.7	-24.7	34.9	0	0	0	113.3	R52 L55 Q127 V131 R132 C133	R52-P129 HydrophobicContact CB-CG 4.03Å; R52-P129 WeakPolarHBondContact O-CG 3.5Å; L55-P129 HydrophobicContact CD1-CB 4.21Å; Q127-P129 WeakPolarHBondContact O-CD 3.16Å; P129-V131 VanDerWaalsContact C-N 3.3Å; P129-V131 PolarHBondContact O-N 3.04Å; P129-R132 PolarHBondContact O-N 3.28Å; P129-C133 PolarHBondContact O-N 3.18Å; P129-C133 PolarHBondContact O-SG 3.04Å; P129-C133 VanDerWaalsContact O-SG 3.36Å
130	E	95.3	Very high	93.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-38.6	179	-62.1	90.8	151.1	0	0	112	R52 L55 I58 E59 Y60 V63 W64 I128 C133 F134	R52-E130 IonicContact CZ-OE1 3.45Å; R52-E130 IonicContact CZ-OE2 3.42Å; R52-E130 IonicContact NH1-OE1 2.81Å; R52-E130 IonicContact NH1-OE2 3.33Å; R52-E130 PolarHBondContact NH1-OE2 2.96Å; R52-E130 IonicContact NH2-OE1 3.88Å; R52-E130 PolarHBondContact NH2-OE1 2.85Å; R52-E130 IonicContact NH2-OE2 2.79Å; R52-E130 PolarHBondContact NH2-OE2 3.2Å; L55-E130 HydrophobicContact CD1-CG 4.47Å; I58-E130 HydrophobicContact CD1-CG 4.16Å; I58-E130 HydrophobicContact CG2-CG 4.18Å; E59-E130 PolarHBondContact N-OE1 3.1Å; Y60-E130 PolarHBondContact N-OE1 3.31Å; V63-E130 HydrophobicContact CB-CB 4.24Å; V63-E130 HydrophobicContact CG1-CB 3.68Å; W64-E130 HydrophobicContact CB-CG 4.47Å; W64-E130 HydrophobicContact CE3-CB 4.29Å; W64-E130 HydrophobicContact CE3-CG 4.05Å; I128-E130 VanDerWaalsContact C-N 3.32Å; I128-E130 HydrophobicContact CG2-CB 4.15Å; I128-E130 WeakPolarHBondContact CG2-OE2 3.16Å; I128-E130 PolarHBondContact O-N 2.72Å; E130-C133 WeakPolarHBondContact O-CB 3.34Å; E130-C133 PolarHBondContact O-N 3.34Å; E130-F134 PolarHBondContact O-N 3.25Å
131	V	95.9	Very high	93.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.6	-42.9	175.7	178.1	0	0	0	0	110.3	V63 V126 I128 P129 C133 F134 Y135 F245 L249	V63-V131 HydrophobicContact CG1-CB 4.27Å; V63-V131 HydrophobicContact CG1-CG2 3.57Å; V63-V131 HydrophobicContact CG2-CG2 4.27Å; V126-V131 HydrophobicContact CB-CG1 4.3Å; V126-V131 HydrophobicContact CG1-CB 3.67Å; V126-V131 HydrophobicContact CG1-CG1 3.61Å; V126-V131 HydrophobicContact CG1-CG2 4.15Å; V126-V131 HydrophobicContact CG2-CG1 4.41Å; I128-V131 HydrophobicContact CB-CB 4.29Å; I128-V131 HydrophobicContact CB-CG2 3.88Å; I128-V131 HydrophobicContact CG2-CG2 3.9Å; I128-V131 PolarHBondContact O-N 3.17Å; P129-V131 VanDerWaalsContact C-N 3.3Å; P129-V131 PolarHBondContact O-N 3.04Å; V131-C133 VanDerWaalsContact C-N 3.26Å; V131-C133 PolarHBondContact O-N 3.45Å; V131-F134 WeakPolarHBondContact O-CB 3.45Å; V131-F134 PolarHBondContact O-N 2.97Å; V131-F134 VanDerWaalsContact O-N 3.07Å; V131-Y135 HydrophobicContact CG1-CD2 3.86Å; V131-Y135 HydrophobicContact CG1-CE2 3.61Å; V131-Y135 PolarHBondContact O-N 3.03Å; V131-F245 HydrophobicContact CB-CZ 4.35Å; V131-F245 HydrophobicContact CG1-CE1 4.01Å; V131-F245 HydrophobicContact CG1-CZ 3.86Å; V131-F245 HydrophobicContact CG2-CZ 4.4Å; V131-L249 HydrophobicContact CB-CD2 4.48Å; V131-L249 HydrophobicContact CG1-CD1 3.99Å; V131-L249 HydrophobicContact CG1-CD2 4.01Å; V131-L249 HydrophobicContact CG2-CD2 3.62Å
132	R	94.2	Very high	94.3	Very high	77 Å²	77	20.3 Å²	20.3	29%	0.291	12%	0.118	S	C	.	.	H	α-helix	trans	-62.1	-33.1	175	-70.3	-176.4	174.3	156.9	6	112.5	V126 I128 P129 G136	V126-R132 PolarHBondContact O-NE 2.93Å; V126-R132 PolarHBondContact O-NH2 3.44Å; I128-R132 PolarHBondContact O-N 3.4Å; I128-R132 VanDerWaalsContact O-N 3.14Å; P129-R132 PolarHBondContact O-N 3.28Å; R132-G136 PolarHBondContact O-N 3.21Å
133	C	95.7	Very high	94.5	Very high	37 Å²	37	24.1 Å²	24.1	25%	0.25	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-42.3	171.8	-71.1	0	0	0	0	111.8	W64 Y67 P129 E130 V131 M137	W64-C133 HydrophobicContact CZ3-CB 4.05Å; Y67-C133 HydrophobicContact CD1-CB 4.4Å; Y67-C133 VanDerWaalsContact CD2-C 3.46Å; Y67-C133 HydrophobicContact CD2-CB 3.69Å; Y67-C133 VanDerWaalsContact CD2-O 3.27Å; Y67-C133 WeakPolarHBondContact CD2-O 3.45Å; Y67-C133 HydrophobicContact CE2-CB 3.86Å; Y67-C133 WeakPolarHBondContact CE2-O 3.38Å; Y67-C133 HydrophobicContact CG-CB 3.97Å; P129-C133 PolarHBondContact O-N 3.18Å; P129-C133 PolarHBondContact O-SG 3.04Å; P129-C133 VanDerWaalsContact O-SG 3.36Å; E130-C133 WeakPolarHBondContact O-CB 3.34Å; E130-C133 PolarHBondContact O-N 3.34Å; V131-C133 VanDerWaalsContact C-N 3.26Å; V131-C133 PolarHBondContact O-N 3.45Å; C133-M137 PolarHBondContact O-N 2.93Å
134	F	97.2	Very high	94.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-51	174	-174.3	-84	0	0	0	111.3	F66 A70 E130 V131 G136 M137 Q138 L241 F245	F66-F134 HydrophobicContact CB-CD2 3.84Å; F66-F134 HydrophobicContact CB-CE2 3.89Å; F66-F134 HydrophobicContact CD1-CE2 4.18Å; A70-F134 HydrophobicContact CB-CD2 4.28Å; A70-F134 HydrophobicContact CB-CE2 4.01Å; E130-F134 PolarHBondContact O-N 3.25Å; V131-F134 WeakPolarHBondContact O-CB 3.45Å; V131-F134 PolarHBondContact O-N 2.97Å; V131-F134 VanDerWaalsContact O-N 3.07Å; F134-G136 PolarHBondContact O-N 3.43Å; F134-M137 CarbonylContact O-C 3.59Å; F134-M137 WeakPolarHBondContact O-CA 3.28Å; F134-M137 WeakPolarHBondContact O-CB 3.47Å; F134-M137 PolarHBondContact O-N 2.95Å; F134-Q138 HydrophobicContact CD1-CB 4.4Å; F134-Q138 HydrophobicContact CE1-CB 4.19Å; F134-Q138 PolarHBondContact O-N 3.16Å; F134-L241 HydrophobicContact CE2-CD2 4.19Å; F134-L241 HydrophobicContact CE2-CG 4.12Å; F134-L241 HydrophobicContact CZ-CD2 4.4Å; F134-L241 HydrophobicContact CZ-CG 4.07Å; F134-F245 HydrophobicContact CB-CE1 3.92Å; F134-F245 HydrophobicContact CB-CE2 3.89Å; F134-F245 HydrophobicContact CB-CZ 3.53Å; F134-F245 HydrophobicContact CD1-CB 4.29Å; F134-F245 AromaticContact CD1-CD1 3.16Å; F134-F245 HydrophobicContact CD1-CD1 3.16Å; F134-F245 AromaticContact CD1-CD2 3.97Å; F134-F245 HydrophobicContact CD1-CD2 3.97Å; F134-F245 AromaticContact CD1-CE1 3.24Å; F134-F245 HydrophobicContact CD1-CE1 3.24Å; F134-F245 HydrophobicContact CD1-CE2 4.04Å; F134-F245 AromaticContact CD1-CG 3.54Å; F134-F245 HydrophobicContact CD1-CG 3.54Å; F134-F245 AromaticContact CD1-CZ 3.7Å; F134-F245 HydrophobicContact CD1-CZ 3.7Å; F134-F245 AromaticContact CD2-CD2 3.88Å; F134-F245 HydrophobicContact CD2-CD2 3.88Å; F134-F245 AromaticContact CD2-CE2 3.99Å; F134-F245 HydrophobicContact CD2-CE2 3.99Å; F134-F245 HydrophobicContact CD2-CG 4.15Å; F134-F245 HydrophobicContact CD2-CZ 4.35Å; F134-F245 HydrophobicContact CE1-CB 3.61Å; F134-F245 AromaticContact CE1-CD1 3.27Å; F134-F245 HydrophobicContact CE1-CD1 3.27Å; F134-F245 HydrophobicContact CE1-CD2 4.1Å; F134-F245 AromaticContact CE1-CE1 3.89Å; F134-F245 HydrophobicContact CE1-CE1 3.89Å; F134-F245 AromaticContact CE1-CG 3.38Å; F134-F245 HydrophobicContact CE1-CG 3.38Å; F134-F245 HydrophobicContact CE2-CB 4.18Å; F134-F245 HydrophobicContact CE2-CD2 4.02Å; F134-F245 HydrophobicContact CE2-CG 4.03Å; F134-F245 AromaticContact CG-CD1 3.86Å; F134-F245 HydrophobicContact CG-CD1 3.86Å; F134-F245 AromaticContact CG-CD2 3.86Å; F134-F245 HydrophobicContact CG-CD2 3.86Å; F134-F245 AromaticContact CG-CE1 3.68Å; F134-F245 HydrophobicContact CG-CE1 3.68Å; F134-F245 AromaticContact CG-CE2 3.69Å; F134-F245 HydrophobicContact CG-CE2 3.69Å; F134-F245 AromaticContact CG-CG 3.93Å; F134-F245 HydrophobicContact CG-CG 3.93Å; F134-F245 AromaticContact CG-CZ 3.59Å; F134-F245 HydrophobicContact CG-CZ 3.59Å; F134-F245 HydrophobicContact CZ-CB 3.54Å; F134-F245 HydrophobicContact CZ-CD1 4.04Å; F134-F245 HydrophobicContact CZ-CD2 4.11Å; F134-F245 AromaticContact CZ-CG 3.64Å; F134-F245 HydrophobicContact CZ-CG 3.64Å
135	Y	97	Very high	95.3	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-59.8	-34	178.3	-72.5	-29.9	0	0	0	112.9	L118 F122 V126 V131 M137 Q138 I139 F245 L249	L118-Y135 HydrophobicContact CD2-CD1 3.74Å; L118-Y135 HydrophobicContact CD2-CE1 3.83Å; L118-Y135 HydrophobicContact CD2-CG 4.38Å; F122-Y135 HydrophobicContact CB-CD2 4.4Å; F122-Y135 HydrophobicContact CB-CE2 3.64Å; V126-Y135 HydrophobicContact CB-CE2 4.49Å; V126-Y135 HydrophobicContact CG2-CE2 4.1Å; V131-Y135 HydrophobicContact CG1-CD2 3.86Å; V131-Y135 HydrophobicContact CG1-CE2 3.61Å; V131-Y135 PolarHBondContact O-N 3.03Å; Y135-M137 VanDerWaalsContact C-N 3.3Å; Y135-M137 PolarHBondContact O-N 2.86Å; Y135-Q138 PolarHBondContact O-N 2.99Å; Y135-I139 VanDerWaalsContact O-CB 3.3Å; Y135-I139 WeakPolarHBondContact O-CB 3.39Å; Y135-I139 WeakPolarHBondContact O-CD1 3.34Å; Y135-I139 WeakPolarHBondContact O-CG1 3.44Å; Y135-I139 PolarHBondContact O-N 3.4Å; Y135-F245 HydrophobicContact CD1-CE1 4.08Å; Y135-F245 HydrophobicContact CE1-CD1 4.06Å; Y135-F245 AromaticContact CE1-CE1 3.72Å; Y135-F245 HydrophobicContact CE1-CE1 3.72Å; Y135-L249 HydrophobicContact CE1-CD1 4.4Å; Y135-L249 WeakPolarHBondContact OH-CD1 3.46Å
136	G	96.4	Very high	95.5	Very high	41 Å²	41	20.3 Å²	20.3	42%	0.423	12%	0.121	S	C	.	.	H	α-helix	trans	-61.2	-37	172	0	0	0	0	0	113.2	R132 F134 A140	R132-G136 PolarHBondContact O-N 3.21Å; F134-G136 PolarHBondContact O-N 3.43Å; G136-A140 PolarHBondContact O-N 3.06Å
137	M	96.6	Very high	95.7	Very high	38 Å²	38	25.1 Å²	25.1	19%	0.187	14%	0.143	C	C	.	.	H	α-helix	trans	-74.5	-40.2	173.8	-69	-59.6	-50.8	0	0	112.3	Y67 A70 V71 F74 C133 F134 Y135 A140 I141	Y67-M137 HydrophobicContact CD2-CG 3.82Å; Y67-M137 HydrophobicContact CE2-CG 3.54Å; Y67-M137 HydrophobicContact CE2-SD 4.36Å; A70-M137 HydrophobicContact CB-CB 3.98Å; A70-M137 HydrophobicContact CB-CG 4.46Å; V71-M137 HydrophobicContact CG2-CE 4.28Å; V71-M137 HydrophobicContact CG2-CG 4.07Å; V71-M137 HydrophobicContact CG2-SD 4Å; F74-M137 HydrophobicContact CB-CE 4.4Å; F74-M137 HydrophobicContact CD2-CE 3.64Å; F74-M137 HydrophobicContact CE2-CE 4.33Å; F74-M137 HydrophobicContact CG-CE 4.33Å; C133-M137 PolarHBondContact O-N 2.93Å; F134-M137 CarbonylContact O-C 3.59Å; F134-M137 WeakPolarHBondContact O-CA 3.28Å; F134-M137 WeakPolarHBondContact O-CB 3.47Å; F134-M137 PolarHBondContact O-N 2.95Å; Y135-M137 VanDerWaalsContact C-N 3.3Å; Y135-M137 PolarHBondContact O-N 2.86Å; M137-A140 WeakPolarHBondContact O-CB 3.38Å; M137-A140 PolarHBondContact O-N 3.3Å; M137-I141 PolarHBondContact O-N 2.94Å
138	Q	97.2	Very high	96	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-52.7	175.8	-177.8	169.6	2.9	0	0	110	L118 F134 Y135 A140 I141 E142 E205	L118-Q138 HydrophobicContact CD1-CB 4.45Å; L118-Q138 HydrophobicContact CD1-CG 3.65Å; F134-Q138 HydrophobicContact CD1-CB 4.4Å; F134-Q138 HydrophobicContact CE1-CB 4.19Å; F134-Q138 PolarHBondContact O-N 3.16Å; Y135-Q138 PolarHBondContact O-N 2.99Å; Q138-A140 PolarHBondContact O-N 2.92Å; Q138-A140 VanDerWaalsContact O-N 3.15Å; Q138-I141 WeakPolarHBondContact O-CG2 3.08Å; Q138-I141 PolarHBondContact O-N 2.97Å; Q138-E142 HydrophobicContact CG-CG 4.25Å; Q138-E142 WeakPolarHBondContact O-CG 3.42Å; Q138-E142 PolarHBondContact O-N 3.29Å; Q138-E205 PolarHBondContact NE2-OE1 3.49Å
139	I	97.5	Very high	96.1	Very high	29 Å²	29	24.5 Å²	24.5	15%	0.149	14%	0.14	C	C	.	.	H	α-helix	trans	-52	-42.1	174.2	-73.1	162.4	0	0	0	111.7	L115 L118 L119 Y135 N143	L115-I139 HydrophobicContact CD1-CB 4.24Å; L115-I139 HydrophobicContact CD1-CG1 4.23Å; L115-I139 HydrophobicContact CD1-CG2 3.81Å; L118-I139 HydrophobicContact CB-CD1 4.31Å; L118-I139 HydrophobicContact CB-CG1 3.96Å; L118-I139 HydrophobicContact CD1-CG1 4.16Å; L119-I139 HydrophobicContact CD2-CD1 3.68Å; L119-I139 HydrophobicContact CD2-CG1 4.37Å; L119-I139 HydrophobicContact CD2-CG2 4.39Å; L119-I139 HydrophobicContact CG-CD1 4.24Å; Y135-I139 VanDerWaalsContact O-CB 3.3Å; Y135-I139 WeakPolarHBondContact O-CB 3.39Å; Y135-I139 WeakPolarHBondContact O-CD1 3.34Å; Y135-I139 WeakPolarHBondContact O-CG1 3.44Å; Y135-I139 PolarHBondContact O-N 3.4Å; I139-N143 PolarHBondContact O-N 3.06Å; I139-N143 PolarHBondContact O-ND2 3.25Å
140	A	96.9	Very high	96.1	Very high	34 Å²	34	25.9 Å²	25.9	28%	0.281	15%	0.151	S	C	.	.	H	α-helix	trans	-65.2	-42.1	178.3	0	0	0	0	0	112.3	G136 M137 Q138 N143 I144	G136-A140 PolarHBondContact O-N 3.06Å; M137-A140 WeakPolarHBondContact O-CB 3.38Å; M137-A140 PolarHBondContact O-N 3.3Å; Q138-A140 PolarHBondContact O-N 2.92Å; Q138-A140 VanDerWaalsContact O-N 3.15Å; A140-N143 PolarHBondContact O-N 3.47Å; A140-I144 WeakPolarHBondContact O-CG1 3.33Å; A140-I144 PolarHBondContact O-N 3.28Å
141	I	96.7	Very high	96.1	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.051	17%	0.167	C	C	.	.	H	α-helix	trans	-74.6	-34.4	-179.6	-150.7	62.7	0	0	0	112.1	F74 W75 M137 Q138 N143 I144 H145 D238 H242	F74-I141 HydrophobicContact CD2-CD1 4.2Å; F74-I141 HydrophobicContact CE2-CD1 4.4Å; W75-I141 HydrophobicContact CG-CD1 4.48Å; M137-I141 PolarHBondContact O-N 2.94Å; Q138-I141 WeakPolarHBondContact O-CG2 3.08Å; Q138-I141 PolarHBondContact O-N 2.97Å; I141-N143 VanDerWaalsContact C-N 3.26Å; I141-N143 PolarHBondContact O-N 3.23Å; I141-I144 HydrophobicContact CD1-CB 4.26Å; I141-I144 HydrophobicContact CD1-CD1 3.97Å; I141-I144 HydrophobicContact CD1-CG2 4.43Å; I141-I144 CarbonylContact O-C 3.56Å; I141-I144 WeakPolarHBondContact O-CA 3.36Å; I141-I144 WeakPolarHBondContact O-CB 3.38Å; I141-I144 PolarHBondContact O-N 3.15Å; I141-H145 PolarHBondContact O-CD2 2.78Å; I141-H145 VanDerWaalsContact O-CG 3.29Å; I141-H145 PolarHBondContact O-N 2.78Å; I141-D238 HydrophobicContact CG1-CB 4.47Å; I141-D238 WeakPolarHBondContact CG1-OD2 3.38Å; I141-H242 VanDerWaalsContact CG2-CE1 3.44Å; I141-H242 WeakPolarHBondContact CG2-CE1 3.43Å; I141-H242 WeakPolarHBondContact CG2-NE2 3.1Å
142	E	96.7	Very high	96	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-36.7	172.8	-66.9	-53.4	157.4	0	0	112.3	V114 L115 L118 Q138 I144 H145 S146 H242	V114-E142 HydrophobicContact CG1-CG 4.17Å; L115-E142 HydrophobicContact CD1-CB 4.27Å; L118-E142 HydrophobicContact CD1-CG 4.16Å; Q138-E142 HydrophobicContact CG-CG 4.25Å; Q138-E142 WeakPolarHBondContact O-CG 3.42Å; Q138-E142 PolarHBondContact O-N 3.29Å; E142-I144 VanDerWaalsContact C-N 3.31Å; E142-I144 PolarHBondContact O-N 2.91Å; E142-H145 PolarHBondContact O-N 3.33Å; E142-H145 IonicContact OE2-ND1 3.16Å; E142-H145 PolarHBondContact OE2-ND1 3.33Å; E142-S146 WeakPolarHBondContact O-CB 3.49Å; E142-S146 PolarHBondContact O-N 3.07Å; E142-S146 PolarHBondContact O-OG 3.14Å; E142-H242 IonicContact OE1-CE1 2.7Å; E142-H242 PolarHBondContact OE1-CE1 3.27Å; E142-H242 IonicContact OE1-ND1 3.06Å; E142-H242 PolarHBondContact OE1-ND1 3.05Å
143	N	96.6	Very high	96	Very high	81 Å²	81	25.4 Å²	25.4	43%	0.433	15%	0.153	S	C	.	.	H	α-helix	trans	-64.8	-37.9	173.3	-75.5	-60.2	0	0	0	111.6	L115 I139 A140 I141 S146 E147	L115-N143 WeakPolarHBondContact CD2-OD1 3.48Å; I139-N143 PolarHBondContact O-N 3.06Å; I139-N143 PolarHBondContact O-ND2 3.25Å; A140-N143 PolarHBondContact O-N 3.47Å; I141-N143 VanDerWaalsContact C-N 3.26Å; I141-N143 PolarHBondContact O-N 3.23Å; N143-S146 PolarHBondContact O-N 3.05Å; N143-E147 WeakPolarHBondContact O-CB 3.47Å; N143-E147 PolarHBondContact O-N 3.11Å
144	I	97.3	Very high	95.7	Very high	17 Å²	17	27.4 Å²	27.4	9%	0.087	16%	0.161	C	C	.	.	H	α-helix	trans	-70.1	-37.9	176.6	-65.5	175	0	0	0	110.4	F74 W75 V77 A140 I141 E142 E147 M148	F74-I144 HydrophobicContact CE1-CD1 4.42Å; F74-I144 HydrophobicContact CE2-CD1 3.69Å; F74-I144 HydrophobicContact CZ-CD1 3.55Å; W75-I144 HydrophobicContact CD2-CG2 4.34Å; W75-I144 HydrophobicContact CE3-CG2 4.14Å; W75-I144 HydrophobicContact CH2-CG2 3.83Å; W75-I144 HydrophobicContact CZ2-CG2 4.06Å; W75-I144 HydrophobicContact CZ3-CG2 3.87Å; W75-I144 VanDerWaalsContact O-CD1 3.28Å; W75-I144 WeakPolarHBondContact O-CD1 3.36Å; V77-I144 HydrophobicContact CG1-CG2 3.96Å; A140-I144 WeakPolarHBondContact O-CG1 3.33Å; A140-I144 PolarHBondContact O-N 3.28Å; I141-I144 HydrophobicContact CD1-CB 4.26Å; I141-I144 HydrophobicContact CD1-CD1 3.97Å; I141-I144 HydrophobicContact CD1-CG2 4.43Å; I141-I144 CarbonylContact O-C 3.56Å; I141-I144 WeakPolarHBondContact O-CA 3.36Å; I141-I144 WeakPolarHBondContact O-CB 3.38Å; I141-I144 PolarHBondContact O-N 3.15Å; E142-I144 VanDerWaalsContact C-N 3.31Å; E142-I144 PolarHBondContact O-N 2.91Å; I144-E147 PolarHBondContact O-N 3.21Å; I144-M148 VanDerWaalsContact O-CB 3.29Å; I144-M148 WeakPolarHBondContact O-CB 3.4Å; I144-M148 PolarHBondContact O-N 3.46Å
145	H	96.3	Very high	95.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.1	-49.2	172.6	-59	176.8	0	0	0	110.6	W75 D111 I141 E142 E147 M148 Y149 D238 E239	W75-H145 AromaticContact CZ2-CD2 3.78Å; D111-H145 WeakPolarHBondContact OD2-CB 3.33Å; I141-H145 PolarHBondContact O-CD2 2.78Å; I141-H145 VanDerWaalsContact O-CG 3.29Å; I141-H145 PolarHBondContact O-N 2.78Å; E142-H145 PolarHBondContact O-N 3.33Å; E142-H145 IonicContact OE2-ND1 3.16Å; E142-H145 PolarHBondContact OE2-ND1 3.33Å; H145-E147 VanDerWaalsContact C-N 3.33Å; H145-E147 PolarHBondContact O-N 2.95Å; H145-M148 WeakPolarHBondContact O-CB 3.4Å; H145-M148 PolarHBondContact O-N 2.83Å; H145-M148 VanDerWaalsContact O-N 3.13Å; H145-Y149 HydrophobicContact CB-CD2 4.47Å; H145-Y149 HydrophobicContact CB-CE2 4.22Å; H145-Y149 WeakPolarHBondContact O-CD2 3.47Å; H145-Y149 PolarHBondContact O-N 3.15Å; H145-D238 IonicContact NE2-OD2 3.71Å; H145-E239 IonicContact CE1-OE1 2.7Å; H145-E239 PolarHBondContact CE1-OE1 3.22Å; H145-E239 IonicContact ND1-OE1 2.6Å; H145-E239 PolarHBondContact ND1-OE1 2.89Å
146	S	94.7	Very high	95.3	Very high	26 Å²	26	29 Å²	29	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-58.6	-42.3	177.4	-64.1	0	0	0	0	112.6	E142 N143 S150	E142-S146 WeakPolarHBondContact O-CB 3.49Å; E142-S146 PolarHBondContact O-N 3.07Å; E142-S146 PolarHBondContact O-OG 3.14Å; N143-S146 PolarHBondContact O-N 3.05Å; S146-S150 WeakPolarHBondContact O-CB 3.47Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.11Å; S146-S150 PolarHBondContact O-OG 2.69Å
147	E	95.8	Very high	95	Very high	100 Å²	100	27.2 Å²	27.2	47%	0.467	15%	0.152	S	C	.	.	H	α-helix	trans	-63.7	-47	173.8	-175.9	177	-165.8	0	0	111.5	V77 N143 I144 H145 Y149 S150 L151	V77-E147 HydrophobicContact CG1-CB 4.04Å; V77-E147 HydrophobicContact CG1-CG 3.87Å; V77-E147 HydrophobicContact CG2-CG 4.18Å; N143-E147 WeakPolarHBondContact O-CB 3.47Å; N143-E147 PolarHBondContact O-N 3.11Å; I144-E147 PolarHBondContact O-N 3.21Å; H145-E147 VanDerWaalsContact C-N 3.33Å; H145-E147 PolarHBondContact O-N 2.95Å; E147-Y149 PolarHBondContact O-N 2.94Å; E147-S150 PolarHBondContact O-N 3.25Å; E147-L151 WeakPolarHBondContact O-CB 3.35Å; E147-L151 PolarHBondContact O-N 2.86Å
148	M	97	Very high	94.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-47.4	-179.7	-169.6	68	-110.9	0	0	111.4	W75 V77 V80 L82 I144 H145 S150 L151 L152 I235	W75-M148 HydrophobicContact CH2-CB 4.16Å; W75-M148 HydrophobicContact CH2-CG 4.07Å; W75-M148 HydrophobicContact CH2-SD 4.47Å; W75-M148 HydrophobicContact CZ3-CG 4.4Å; W75-M148 HydrophobicContact CZ3-SD 4.21Å; V77-M148 HydrophobicContact CB-SD 4.16Å; V77-M148 HydrophobicContact CG1-CB 3.96Å; V77-M148 HydrophobicContact CG1-SD 4.09Å; V80-M148 HydrophobicContact CB-CE 4.29Å; V80-M148 HydrophobicContact CB-SD 3.95Å; V80-M148 HydrophobicContact CG1-CE 4.09Å; V80-M148 HydrophobicContact CG1-SD 4.21Å; V80-M148 HydrophobicContact CG2-SD 3.82Å; L82-M148 HydrophobicContact CD1-CE 3.94Å; L82-M148 HydrophobicContact CD2-CE 4.15Å; L82-M148 HydrophobicContact CG-CE 4.36Å; I144-M148 VanDerWaalsContact O-CB 3.29Å; I144-M148 WeakPolarHBondContact O-CB 3.4Å; I144-M148 PolarHBondContact O-N 3.46Å; H145-M148 WeakPolarHBondContact O-CB 3.4Å; H145-M148 PolarHBondContact O-N 2.83Å; H145-M148 VanDerWaalsContact O-N 3.13Å; M148-S150 VanDerWaalsContact C-N 3.34Å; M148-S150 PolarHBondContact O-N 3.14Å; M148-L151 HydrophobicContact CE-CB 4.43Å; M148-L151 HydrophobicContact CE-CD2 4.02Å; M148-L151 HydrophobicContact CE-CG 4.45Å; M148-L151 PolarHBondContact O-N 3.02Å; M148-L152 HydrophobicContact CE-CD1 4.23Å; M148-L152 HydrophobicContact CE-CD2 3.95Å; M148-L152 HydrophobicContact CE-CG 3.71Å; M148-L152 HydrophobicContact CG-CD1 4.21Å; M148-L152 WeakPolarHBondContact O-CG 3.45Å; M148-L152 PolarHBondContact O-N 3.35Å; M148-I235 HydrophobicContact CB-CD1 4.49Å; M148-I235 HydrophobicContact CG-CD1 4.31Å
149	Y	95.4	Very high	94.3	Very high	3 Å²	3	35.7 Å²	35.7	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-64.2	-38.8	177.5	-68.4	-52.7	0	0	0	112.5	L104 F107 D111 H145 E147 L152 I153 I235	L104-Y149 HydrophobicContact CD2-CD1 3.83Å; L104-Y149 HydrophobicContact CD2-CE1 4.29Å; F107-Y149 HydrophobicContact CB-CD1 3.88Å; F107-Y149 HydrophobicContact CB-CD2 3.7Å; F107-Y149 HydrophobicContact CB-CE1 3.72Å; F107-Y149 HydrophobicContact CB-CE2 3.52Å; F107-Y149 HydrophobicContact CB-CG 3.87Å; F107-Y149 HydrophobicContact CD2-CD1 4Å; F107-Y149 AromaticContact CD2-CE1 3.26Å; F107-Y149 HydrophobicContact CD2-CE1 3.26Å; F107-Y149 HydrophobicContact CD2-CE2 4.34Å; F107-Y149 AromaticContact CD2-CZ 3.44Å; F107-Y149 VanDerWaalsContact CD2-CZ 3.44Å; F107-Y149 WeakPolarHBondContact CD2-OH 3.38Å; F107-Y149 HydrophobicContact CE2-CE1 4.04Å; F107-Y149 HydrophobicContact CG-CD1 4.44Å; F107-Y149 AromaticContact CG-CE1 3.86Å; F107-Y149 HydrophobicContact CG-CE1 3.86Å; F107-Y149 HydrophobicContact CG-CE2 4.14Å; F107-Y149 AromaticContact CG-CZ 3.65Å; D111-Y149 WeakPolarHBondContact OD2-CD2 3.47Å; D111-Y149 WeakPolarHBondContact OD2-CE2 3.25Å; H145-Y149 HydrophobicContact CB-CD2 4.47Å; H145-Y149 HydrophobicContact CB-CE2 4.22Å; H145-Y149 WeakPolarHBondContact O-CD2 3.47Å; H145-Y149 PolarHBondContact O-N 3.15Å; E147-Y149 PolarHBondContact O-N 2.94Å; Y149-L152 HydrophobicContact CD1-CD1 3.98Å; Y149-L152 HydrophobicContact CE1-CD1 4.5Å; Y149-L152 PolarHBondContact O-N 3.02Å; Y149-I153 WeakPolarHBondContact O-CG1 3.36Å; Y149-I153 PolarHBondContact O-N 3.42Å; Y149-I235 HydrophobicContact CE1-CD1 3.88Å; Y149-I235 HydrophobicContact CE2-CD1 3.95Å; Y149-I235 HydrophobicContact CE2-CG2 4.48Å; Y149-I235 WeakPolarHBondContact OH-CG2 3.39Å
150	S	92.7	Very high	93.9	Very high	48 Å²	48	37.3 Å²	37.3	34%	0.336	21%	0.206	S	C	.	.	H	α-helix	trans	-62.7	-42.7	174.5	-60.6	0	0	0	0	111.9	S146 E147 M148 I153 D154	S146-S150 WeakPolarHBondContact O-CB 3.47Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.11Å; S146-S150 PolarHBondContact O-OG 2.69Å; E147-S150 PolarHBondContact O-N 3.25Å; M148-S150 VanDerWaalsContact C-N 3.34Å; M148-S150 PolarHBondContact O-N 3.14Å; S150-I153 PolarHBondContact O-N 3.49Å; S150-D154 WeakPolarHBondContact O-CB 3.3Å; S150-D154 PolarHBondContact O-N 3.44Å
151	L	93.6	Very high	93.5	Very high	67 Å²	67	43.5 Å²	43.5	35%	0.351	23%	0.226	S	C	.	.	H	α-helix	trans	-65.4	-40.4	176.5	-179.1	62.8	0	0	0	112	L82 E147 M148 D154 T155	L82-L151 HydrophobicContact CD1-CD2 4.03Å; L82-L151 HydrophobicContact CD1-CG 3.88Å; E147-L151 WeakPolarHBondContact O-CB 3.35Å; E147-L151 PolarHBondContact O-N 2.86Å; M148-L151 HydrophobicContact CE-CB 4.43Å; M148-L151 HydrophobicContact CE-CD2 4.02Å; M148-L151 HydrophobicContact CE-CG 4.45Å; M148-L151 PolarHBondContact O-N 3.02Å; L151-D154 PolarHBondContact O-N 2.91Å; L151-T155 VanDerWaalsContact O-CB 3.24Å; L151-T155 WeakPolarHBondContact O-CB 2.94Å; L151-T155 PolarHBondContact O-N 2.68Å; L151-T155 PolarHBondContact O-OG1 2.74Å
152	L	95.3	Very high	93.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-47.7	175.4	-70.8	165.2	0	0	0	110.8	L82 L104 M148 Y149 T155 Y156 L228	L82-L152 HydrophobicContact CD1-CD2 4.14Å; L82-L152 HydrophobicContact CD2-CD2 3.65Å; L104-L152 HydrophobicContact CD1-CB 4.05Å; L104-L152 HydrophobicContact CD2-CB 4.11Å; L104-L152 HydrophobicContact CD2-CD1 3.83Å; M148-L152 HydrophobicContact CE-CD1 4.23Å; M148-L152 HydrophobicContact CE-CD2 3.95Å; M148-L152 HydrophobicContact CE-CG 3.71Å; M148-L152 HydrophobicContact CG-CD1 4.21Å; M148-L152 WeakPolarHBondContact O-CG 3.45Å; M148-L152 PolarHBondContact O-N 3.35Å; Y149-L152 HydrophobicContact CD1-CD1 3.98Å; Y149-L152 HydrophobicContact CE1-CD1 4.5Å; Y149-L152 PolarHBondContact O-N 3.02Å; L152-T155 PolarHBondContact O-N 3.49Å; L152-Y156 HydrophobicContact CB-CD2 4.45Å; L152-Y156 HydrophobicContact CB-CE2 3.97Å; L152-Y156 HydrophobicContact CD2-CE2 3.7Å; L152-Y156 WeakPolarHBondContact CD2-OH 3.49Å; L152-Y156 HydrophobicContact CG-CE2 4.44Å; L152-Y156 WeakPolarHBondContact O-CB 3.34Å; L152-Y156 WeakPolarHBondContact O-CD2 3.4Å; L152-Y156 PolarHBondContact O-N 3.13Å; L152-L228 HydrophobicContact CD1-CD1 3.91Å; L152-L228 HydrophobicContact CD2-CB 4.48Å; L152-L228 HydrophobicContact CD2-CD1 4.21Å
153	I	92.9	Very high	92.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-49.2	176.9	-70.3	169.3	0	0	0	110.8	L104 A108 Y149 S150 T155 Y156 I157 R163 F167	L104-I153 HydrophobicContact CB-CD1 4.2Å; L104-I153 HydrophobicContact CB-CG1 3.8Å; L104-I153 HydrophobicContact CD1-CG1 4.42Å; A108-I153 HydrophobicContact CB-CD1 4.07Å; Y149-I153 WeakPolarHBondContact O-CG1 3.36Å; Y149-I153 PolarHBondContact O-N 3.42Å; S150-I153 PolarHBondContact O-N 3.49Å; I153-T155 VanDerWaalsContact C-N 3.28Å; I153-T155 PolarHBondContact O-N 3.38Å; I153-Y156 PolarHBondContact O-N 3.32Å; I153-I157 HydrophobicContact CG2-CD1 4.31Å; I153-I157 WeakPolarHBondContact O-CB 3.41Å; I153-I157 PolarHBondContact O-N 3.28Å; I153-R163 HydrophobicContact CG2-CG 3.86Å; I153-F167 HydrophobicContact CB-CE1 4.24Å; I153-F167 HydrophobicContact CB-CZ 4.08Å; I153-F167 HydrophobicContact CD1-CD1 4.22Å; I153-F167 HydrophobicContact CD1-CE1 3.82Å; I153-F167 HydrophobicContact CG2-CE1 4.02Å; I153-F167 HydrophobicContact CG2-CE2 4.04Å; I153-F167 HydrophobicContact CG2-CZ 3.66Å
154	D	90.8	Very high	92.4	Very high	78 Å²	78	51 Å²	51	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-33.2	-179.7	-166.4	65.7	0	0	0	112.4	S150 L151 R163	S150-D154 WeakPolarHBondContact O-CB 3.3Å; S150-D154 PolarHBondContact O-N 3.44Å; L151-D154 PolarHBondContact O-N 2.91Å; D154-R163 IonicContact OD1-CZ 3.13Å; D154-R163 IonicContact OD1-NE 3.55Å; D154-R163 IonicContact OD1-NH1 3.04Å; D154-R163 PolarHBondContact OD1-NH1 3.18Å
155	T	91.8	Very high	92	Very high	30 Å²	30	53.8 Å²	53.8	18%	0.184	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-45.9	177.3	-60.9	0	0	0	0	111.5	L82 L151 L152 I153 K158	L82-T155 HydrophobicContact CB-CG2 4.38Å; L82-T155 HydrophobicContact CD1-CG2 4.36Å; L151-T155 VanDerWaalsContact O-CB 3.24Å; L151-T155 WeakPolarHBondContact O-CB 2.94Å; L151-T155 PolarHBondContact O-N 2.68Å; L151-T155 PolarHBondContact O-OG1 2.74Å; L152-T155 PolarHBondContact O-N 3.49Å; I153-T155 VanDerWaalsContact C-N 3.28Å; I153-T155 PolarHBondContact O-N 3.38Å; T155-K158 WeakPolarHBondContact O-CE 3.47Å; T155-K158 PolarHBondContact O-NZ 3.1Å
156	Y	92.9	Very high	91.5	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-86.2	-32.4	-171.8	-56.4	-25.1	0	0	0	113.6	D85 W89 L104 L152 I153 M225	D85-Y156 HydrophobicContact CB-CE1 3.65Å; D85-Y156 PolarHBondContact OD2-OH 2.91Å; W89-Y156 HydrophobicContact CD2-CG 4.15Å; W89-Y156 HydrophobicContact CE3-CD2 4.24Å; W89-Y156 HydrophobicContact CE3-CG 4.07Å; W89-Y156 HydrophobicContact CZ3-CD2 4.23Å; W89-Y156 HydrophobicContact CZ3-CG 4.38Å; W89-Y156 PolarHBondContact NE1-O 3.44Å; L104-Y156 HydrophobicContact CD1-CD2 3.77Å; L104-Y156 HydrophobicContact CD1-CE2 4.02Å; L152-Y156 HydrophobicContact CB-CD2 4.45Å; L152-Y156 HydrophobicContact CB-CE2 3.97Å; L152-Y156 HydrophobicContact CD2-CE2 3.7Å; L152-Y156 WeakPolarHBondContact CD2-OH 3.49Å; L152-Y156 HydrophobicContact CG-CE2 4.44Å; L152-Y156 WeakPolarHBondContact O-CB 3.34Å; L152-Y156 WeakPolarHBondContact O-CD2 3.4Å; L152-Y156 PolarHBondContact O-N 3.13Å; I153-Y156 PolarHBondContact O-N 3.32Å; Y156-M225 HydrophobicContact CD1-CE 4.13Å; Y156-M225 HydrophobicContact CD2-CE 4.27Å; Y156-M225 HydrophobicContact CE1-CE 3.66Å; Y156-M225 HydrophobicContact CE2-CE 3.79Å; Y156-M225 HydrophobicContact CG-CE 4.45Å; Y156-M225 VanDerWaalsContact CZ-CE 3.48Å
157	I	90.9	Very high	91	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	28%	0.279	C	S	.	.			trans	-108.7	97.8	-167.5	-50.4	-169.7	0	0	0	109.8	I153 E162 R163 L166	I153-I157 HydrophobicContact CG2-CD1 4.31Å; I153-I157 WeakPolarHBondContact O-CB 3.41Å; I153-I157 PolarHBondContact O-N 3.28Å; I157-E162 HydrophobicContact CG2-CB 3.84Å; I157-E162 HydrophobicContact CG2-CG 3.78Å; I157-R163 HydrophobicContact CG2-CB 4.14Å; I157-L166 HydrophobicContact CD1-CD1 2.99Å; I157-L166 HydrophobicContact CD1-CG 4.45Å; I157-L166 HydrophobicContact CG1-CD1 4.4Å; I157-L166 HydrophobicContact CG2-CD1 4.47Å
158	K	87.5	Confident	90.4	Very high	133 Å²	133	56.2 Å²	56.2	58%	0.578	28%	0.28	S	S	*	.			trans	-79.1	-28	-176.3	-58.1	-52	-175.1	-161.1	0	113.6	T155 S160	T155-K158 WeakPolarHBondContact O-CE 3.47Å; T155-K158 PolarHBondContact O-NZ 3.1Å; K158-S160 PolarHBondContact O-N 3.09Å
159	D	90.3	Very high	89.5	Confident	85 Å²	85	56.2 Å²	56.2	46%	0.455	28%	0.28	S	S	.	.			trans	-74.4	119.4	176.8	-174.7	-82.1	0	0	0	109.7	K161 E162 R163	D159-K161 VanDerWaalsContact C-N 3.27Å; D159-K161 PolarHBondContact O-N 3.11Å; D159-K161 WeakPolarHBondContact OD1-CA 3.49Å; D159-K161 VanDerWaalsContact OD1-CB 3.28Å; D159-K161 WeakPolarHBondContact OD1-CB 3.35Å; D159-K161 PolarHBondContact OD1-N 3.07Å; D159-E162 HydrophobicContact CB-CB 3.98Å; D159-E162 PolarHBondContact O-N 3.31Å; D159-E162 PolarHBondContact OD1-N 3.23Å; D159-R163 WeakPolarHBondContact O-CB 3.37Å; D159-R163 PolarHBondContact O-N 3Å
160	S	89.6	Confident	88.6	Confident	63 Å²	63	59.1 Å²	59.1	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-64.9	-31.7	-176.1	67.7	0	0	0	0	112.5	K158 D164	K158-S160 PolarHBondContact O-N 3.09Å; S160-D164 WeakPolarHBondContact O-CB 3.33Å; S160-D164 PolarHBondContact O-N 3.36Å
161	K	89.4	Confident	87.9	Confident	163 Å²	163	61.9 Å²	61.9	71%	0.709	31%	0.314	S	S	*	.	H	α-helix	trans	-74.8	-39.7	-179.9	-61.2	179.4	178.4	177.2	0	111	D159 R163 D164 F165	D159-K161 VanDerWaalsContact C-N 3.27Å; D159-K161 PolarHBondContact O-N 3.11Å; D159-K161 WeakPolarHBondContact OD1-CA 3.49Å; D159-K161 VanDerWaalsContact OD1-CB 3.28Å; D159-K161 WeakPolarHBondContact OD1-CB 3.35Å; D159-K161 PolarHBondContact OD1-N 3.07Å; K161-R163 VanDerWaalsContact C-N 3.32Å; K161-D164 PolarHBondContact O-N 3.17Å; K161-F165 VanDerWaalsContact O-CB 3.26Å; K161-F165 WeakPolarHBondContact O-CB 3.45Å; K161-F165 PolarHBondContact O-N 3.4Å
162	E	88.6	Confident	87.2	Confident	93 Å²	93	62.2 Å²	62.2	44%	0.435	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-43.3	172.9	-172.2	177.5	-176.5	0	0	110.4	I157 D159 F165 L166	I157-E162 HydrophobicContact CG2-CB 3.84Å; I157-E162 HydrophobicContact CG2-CG 3.78Å; D159-E162 HydrophobicContact CB-CB 3.98Å; D159-E162 PolarHBondContact O-N 3.31Å; D159-E162 PolarHBondContact OD1-N 3.23Å; E162-F165 WeakPolarHBondContact O-CB 3.09Å; E162-F165 PolarHBondContact O-N 3.04Å; E162-L166 HydrophobicContact CG-CD1 4.05Å; E162-L166 VanDerWaalsContact O-CG 3.27Å; E162-L166 WeakPolarHBondContact O-CG 3.43Å; E162-L166 PolarHBondContact O-N 3.28Å
163	R	88.9	Confident	86.4	Confident	71 Å²	71	63 Å²	63	27%	0.268	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-48.7	175.1	-172.7	179.6	68.4	-164	6.3	112.2	I153 D154 I157 D159 K161 F165 L166 F167	I153-R163 HydrophobicContact CG2-CG 3.86Å; D154-R163 IonicContact OD1-CZ 3.13Å; D154-R163 IonicContact OD1-NE 3.55Å; D154-R163 IonicContact OD1-NH1 3.04Å; D154-R163 PolarHBondContact OD1-NH1 3.18Å; I157-R163 HydrophobicContact CG2-CB 4.14Å; D159-R163 WeakPolarHBondContact O-CB 3.37Å; D159-R163 PolarHBondContact O-N 3Å; K161-R163 VanDerWaalsContact C-N 3.32Å; R163-F165 VanDerWaalsContact C-N 3.28Å; R163-F165 PolarHBondContact O-N 3.39Å; R163-L166 PolarHBondContact O-N 2.95Å; R163-F167 HydrophobicContact CG-CD2 3.71Å; R163-F167 HydrophobicContact CG-CE2 3.35Å; R163-F167 HydrophobicContact CG-CZ 4.29Å; R163-F167 WeakPolarHBondContact O-CD2 3.49Å; R163-F167 PolarHBondContact O-N 2.87Å
164	D	88.6	Confident	85.9	Confident	84 Å²	84	69 Å²	69	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-36.3	177.1	-68	-14.6	0	0	0	111.6	S160 K161 L166 N168	S160-D164 WeakPolarHBondContact O-CB 3.33Å; S160-D164 PolarHBondContact O-N 3.36Å; K161-D164 PolarHBondContact O-N 3.17Å; D164-L166 VanDerWaalsContact C-N 3.33Å; D164-L166 PolarHBondContact O-N 3.35Å; D164-N168 WeakPolarHBondContact O-CB 3.42Å; D164-N168 PolarHBondContact O-N 2.94Å; D164-N168 PolarHBondContact O-ND2 2.95Å
165	F	88.9	Confident	85.3	Confident	76 Å²	76	66.7 Å²	66.7	33%	0.333	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174.8	174.4	-90.9	0	0	0	111.8	Y102 K161 E162 R163 N168 A169 N172 L173	Y102-F165 HydrophobicContact CE2-CE1 4.46Å; K161-F165 VanDerWaalsContact O-CB 3.26Å; K161-F165 WeakPolarHBondContact O-CB 3.45Å; K161-F165 PolarHBondContact O-N 3.4Å; E162-F165 WeakPolarHBondContact O-CB 3.09Å; E162-F165 PolarHBondContact O-N 3.04Å; R163-F165 VanDerWaalsContact C-N 3.28Å; R163-F165 PolarHBondContact O-N 3.39Å; F165-N168 CarbonylContact O-C 3.54Å; F165-N168 PolarHBondContact O-N 3.13Å; F165-A169 PolarHBondContact O-N 3.47Å; F165-N172 HydrophobicContact CD2-CB 4Å; F165-N172 WeakPolarHBondContact CD2-ND2 3.48Å; F165-N172 HydrophobicContact CE2-CB 3.55Å; F165-N172 HydrophobicContact CZ-CB 3.86Å; F165-N172 PolarHBondContact O-ND2 3Å; F165-L173 HydrophobicContact CE1-CD2 4.06Å; F165-L173 HydrophobicContact CE1-CG 4.49Å; F165-L173 HydrophobicContact CZ-CD2 3.86Å
166	L	85.6	Confident	84.9	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-76	-39.1	-178.5	-69.6	168.1	0	0	0	112.7	Y102 A105 I157 E162 R163 D164 N168 A169	Y102-L166 HydrophobicContact CD2-CD2 3.76Å; Y102-L166 HydrophobicContact CE2-CD2 3.86Å; A105-L166 HydrophobicContact CB-CB 3.88Å; A105-L166 HydrophobicContact CB-CD2 3.75Å; A105-L166 HydrophobicContact CB-CG 4.38Å; A105-L166 WeakPolarHBondContact CB-O 3.46Å; I157-L166 HydrophobicContact CD1-CD1 2.99Å; I157-L166 HydrophobicContact CD1-CG 4.45Å; I157-L166 HydrophobicContact CG1-CD1 4.4Å; I157-L166 HydrophobicContact CG2-CD1 4.47Å; E162-L166 HydrophobicContact CG-CD1 4.05Å; E162-L166 VanDerWaalsContact O-CG 3.27Å; E162-L166 WeakPolarHBondContact O-CG 3.43Å; E162-L166 PolarHBondContact O-N 3.28Å; R163-L166 PolarHBondContact O-N 2.95Å; D164-L166 VanDerWaalsContact C-N 3.33Å; D164-L166 PolarHBondContact O-N 3.35Å; L166-N168 PolarHBondContact O-N 3.35Å; L166-A169 WeakPolarHBondContact O-CB 3.3Å; L166-A169 PolarHBondContact O-N 3.03Å
167	F	84.3	Confident	84.6	Confident	85 Å²	85	66.6 Å²	66.6	37%	0.373	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-25.6	171.3	-74.5	-51.8	0	0	0	112.7	I153 R163	I153-F167 HydrophobicContact CB-CE1 4.24Å; I153-F167 HydrophobicContact CB-CZ 4.08Å; I153-F167 HydrophobicContact CD1-CD1 4.22Å; I153-F167 HydrophobicContact CD1-CE1 3.82Å; I153-F167 HydrophobicContact CG2-CE1 4.02Å; I153-F167 HydrophobicContact CG2-CE2 4.04Å; I153-F167 HydrophobicContact CG2-CZ 3.66Å; R163-F167 HydrophobicContact CG-CD2 3.71Å; R163-F167 HydrophobicContact CG-CE2 3.35Å; R163-F167 HydrophobicContact CG-CZ 4.29Å; R163-F167 WeakPolarHBondContact O-CD2 3.49Å; R163-F167 PolarHBondContact O-N 2.87Å
168	N	84.3	Confident	84.5	Confident	91 Å²	91	70.8 Å²	70.8	49%	0.487	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	25.1	173.8	-66.9	-73.3	0	0	0	113.1	D164 F165 L166 I170 S171 N172	D164-N168 WeakPolarHBondContact O-CB 3.42Å; D164-N168 PolarHBondContact O-N 2.94Å; D164-N168 PolarHBondContact O-ND2 2.95Å; F165-N168 CarbonylContact O-C 3.54Å; F165-N168 PolarHBondContact O-N 3.13Å; L166-N168 PolarHBondContact O-N 3.35Å; N168-I170 VanDerWaalsContact C-N 3.27Å; N168-I170 PolarHBondContact O-N 2.99Å; N168-S171 PolarHBondContact O-N 3.49Å; N168-N172 PolarHBondContact O-N 3.19Å; N168-N172 PolarHBondContact O-ND2 3.04Å
169	A	77.8	Confident	84.6	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-56.5	-33.9	-175.9	0	0	0	0	0	114.4	A105 F165 L166 S171 N172 L173 V176	A105-A169 HydrophobicContact CB-CB 3.81Å; F165-A169 PolarHBondContact O-N 3.47Å; L166-A169 WeakPolarHBondContact O-CB 3.3Å; L166-A169 PolarHBondContact O-N 3.03Å; A169-S171 PolarHBondContact O-N 3.38Å; A169-N172 PolarHBondContact O-N 3.27Å; A169-L173 HydrophobicContact CB-CD1 3.95Å; A169-L173 HydrophobicContact CB-CG 4.38Å; A169-L173 WeakPolarHBondContact O-CB 3.47Å; A169-L173 PolarHBondContact O-N 3.25Å; A169-V176 HydrophobicContact CB-CG1 4.38Å
170	I	75.5	Confident	84.6	Confident	64 Å²	64	60.6 Å²	60.6	33%	0.328	32%	0.32	S	S	.	.	H	α-helix	trans	-56	-39.4	175.4	-60.9	178.1	0	0	0	111.1	A109 I113 N168 V176 A177 A180	A109-I170 HydrophobicContact CB-CD1 3.76Å; A109-I170 HydrophobicContact CB-CG1 3.55Å; I113-I170 HydrophobicContact CD1-CD1 4.26Å; N168-I170 VanDerWaalsContact C-N 3.27Å; N168-I170 PolarHBondContact O-N 2.99Å; I170-V176 HydrophobicContact CG1-CG1 4.25Å; I170-A177 VanDerWaalsContact O-CB 3.25Å; I170-A177 WeakPolarHBondContact O-CB 3.46Å; I170-A180 HydrophobicContact CD1-CB 4.34Å; I170-A180 HydrophobicContact CG1-CB 4.24Å; I170-A180 HydrophobicContact CG2-CB 4.04Å
171	S	78.6	Confident	84.7	Confident	105 Å²	105	62.4 Å²	62.4	73%	0.734	32%	0.321	S	S	*	.	H	α-helix	trans	-84.8	-30.1	-179.5	-64.9	0	0	0	0	112.5	N168 A169	N168-S171 PolarHBondContact O-N 3.49Å; A169-S171 PolarHBondContact O-N 3.38Å
172	N	78.4	Confident	84.9	Confident	74 Å²	74	55.7 Å²	55.7	40%	0.396	29%	0.291	S	S	.	.	H	α-helix	trans	-93.7	-25.8	-170.7	-68.1	-27.8	0	0	0	114.1	F165 N168 A169	F165-N172 HydrophobicContact CD2-CB 4Å; F165-N172 WeakPolarHBondContact CD2-ND2 3.48Å; F165-N172 HydrophobicContact CE2-CB 3.55Å; F165-N172 HydrophobicContact CZ-CB 3.86Å; F165-N172 PolarHBondContact O-ND2 3Å; N168-N172 PolarHBondContact O-N 3.19Å; N168-N172 PolarHBondContact O-ND2 3.04Å; A169-N172 PolarHBondContact O-N 3.27Å
173	L	78.2	Confident	85.1	Confident	18 Å²	18	51.7 Å²	51.7	9%	0.094	28%	0.275	C	S	.	.			trans	-118.6	109.7	-172.8	-60.2	-179.6	0	0	0	110.5	Y102 F165 A169 C175 V176 A177	Y102-L173 HydrophobicContact CD1-CD1 3.5Å; Y102-L173 VanDerWaalsContact CD1-CD1 3.5Å; Y102-L173 HydrophobicContact CD1-CD2 4.21Å; Y102-L173 HydrophobicContact CE1-CD1 3.52Å; Y102-L173 HydrophobicContact CE1-CD2 3.39Å; Y102-L173 HydrophobicContact CE1-CG 4.11Å; Y102-L173 HydrophobicContact CG-CD1 4.13Å; F165-L173 HydrophobicContact CE1-CD2 4.06Å; F165-L173 HydrophobicContact CE1-CG 4.49Å; F165-L173 HydrophobicContact CZ-CD2 3.86Å; A169-L173 HydrophobicContact CB-CD1 3.95Å; A169-L173 HydrophobicContact CB-CG 4.38Å; A169-L173 WeakPolarHBondContact O-CB 3.47Å; A169-L173 PolarHBondContact O-N 3.25Å; L173-C175 PolarHBondContact O-N 2.97Å; L173-C175 VanDerWaalsContact O-N 3.14Å; L173-V176 HydrophobicContact CB-CB 4.05Å; L173-V176 HydrophobicContact CB-CG2 3.88Å; L173-V176 HydrophobicContact CD1-CG2 3.99Å; L173-V176 PolarHBondContact O-N 3.37Å; L173-A177 WeakPolarHBondContact O-CB 3.27Å; L173-A177 PolarHBondContact O-N 3.27Å
174	T	83.1	Confident	85.3	Confident	126 Å²	126	51.8 Å²	51.8	77%	0.773	28%	0.28	S	S	*	.	H	α-helix	trans	-54.9	-36	-178.5	-48.1	0	0	0	0	113.2	A177 K178	T174-A177 PolarHBondContact O-N 3.29Å; T174-K178 PolarHBondContact O-N 2.86Å
175	C	79.3	Confident	85.5	Confident	28 Å²	28	52.2 Å²	52.2	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-71.3	-36.8	-179.9	60.3	0	0	0	0	113.1	L173 F276 A280	L173-C175 PolarHBondContact O-N 2.97Å; L173-C175 VanDerWaalsContact O-N 3.14Å; C175-F276 HydrophobicContact CB-CD2 3.98Å; C175-F276 HydrophobicContact CB-CE2 4.41Å; C175-A280 HydrophobicContact CB-CB 3.24Å
176	V	82.4	Confident	85.7	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-70.2	-43.3	172.5	178	0	0	0	0	109.6	F106 A169 I170 L173 K178 K179 A180 F276	F106-V176 HydrophobicContact CB-CG2 4.25Å; F106-V176 HydrophobicContact CD2-CG1 4.29Å; A169-V176 HydrophobicContact CB-CG1 4.38Å; I170-V176 HydrophobicContact CG1-CG1 4.25Å; L173-V176 HydrophobicContact CB-CB 4.05Å; L173-V176 HydrophobicContact CB-CG2 3.88Å; L173-V176 HydrophobicContact CD1-CG2 3.99Å; L173-V176 PolarHBondContact O-N 3.37Å; V176-K178 VanDerWaalsContact C-N 3.27Å; V176-K178 PolarHBondContact O-N 2.85Å; V176-K179 PolarHBondContact O-N 3.16Å; V176-A180 WeakPolarHBondContact O-CB 3.43Å; V176-A180 PolarHBondContact O-N 3.08Å; V176-F276 HydrophobicContact CG2-CE2 4.27Å
177	A	87.4	Confident	85.9	Confident	32 Å²	32	50.3 Å²	50.3	26%	0.264	27%	0.274	S	S	.	.	H	α-helix	trans	-55.6	-41.8	177	0	0	0	0	0	112.1	I170 L173 T174 A180 Q181	I170-A177 VanDerWaalsContact O-CB 3.25Å; I170-A177 WeakPolarHBondContact O-CB 3.46Å; L173-A177 WeakPolarHBondContact O-CB 3.27Å; L173-A177 PolarHBondContact O-N 3.27Å; T174-A177 PolarHBondContact O-N 3.29Å; A177-A180 PolarHBondContact O-N 2.94Å; A177-Q181 WeakPolarHBondContact O-CB 3.44Å; A177-Q181 PolarHBondContact O-N 3.22Å
178	K	88.9	Confident	86	Confident	93 Å²	93	49.1 Å²	49.1	40%	0.404	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-45.2	179.1	-170.5	179.9	-174.2	178.4	0	112.5	T174 V176 W182 E275	T174-K178 PolarHBondContact O-N 2.86Å; V176-K178 VanDerWaalsContact C-N 3.27Å; V176-K178 PolarHBondContact O-N 2.85Å; K178-W182 PolarHBondContact O-N 3.32Å; K178-W182 VanDerWaalsContact O-N 3.07Å; K178-E275 VanDerWaalsContact NZ-CD 3.26Å; K178-E275 IonicContact NZ-OE1 2.93Å; K178-E275 PolarHBondContact NZ-OE1 3.01Å; K178-E275 VanDerWaalsContact NZ-OE1 3.13Å; K178-E275 IonicContact NZ-OE2 3.92Å; K178-E275 PolarHBondContact NZ-OE2 2.8Å
179	K	88.6	Confident	86.2	Confident	3 Å²	3	46.5 Å²	46.5	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-49.3	175.8	-77.6	-177.7	170.5	-171.3	0	111.8	F106 V176 Q181 W182 A183 I272 E273 F276	F106-K179 HydrophobicContact CD2-CD 4.05Å; F106-K179 HydrophobicContact CE2-CB 4.1Å; F106-K179 HydrophobicContact CE2-CD 3.31Å; F106-K179 HydrophobicContact CE2-CG 4.36Å; F106-K179 HydrophobicContact CZ-CD 3.75Å; V176-K179 PolarHBondContact O-N 3.16Å; K179-Q181 VanDerWaalsContact C-N 3.32Å; K179-Q181 PolarHBondContact O-N 2.92Å; K179-W182 PolarHBondContact O-N 3.42Å; K179-A183 PolarHBondContact O-N 3.25Å; K179-A183 VanDerWaalsContact O-N 3.08Å; K179-I272 HydrophobicContact CB-CG2 4.43Å; K179-I272 HydrophobicContact CD-CG2 4.43Å; K179-I272 HydrophobicContact CG-CG2 3.37Å; K179-E273 WeakPolarHBondContact CE-OE2 3.43Å; K179-E273 IonicContact NZ-OE1 3.67Å; K179-E273 PolarHBondContact NZ-OE1 2.99Å; K179-E273 VanDerWaalsContact NZ-OE1 3.07Å; K179-E273 IonicContact NZ-OE2 3.29Å; K179-E273 PolarHBondContact NZ-OE2 3Å; K179-F276 HydrophobicContact CD-CD2 4.27Å; K179-F276 HydrophobicContact CD-CG 4.29Å; K179-F276 VanDerWaalsContact CE-CB 3.48Å; K179-F276 VanDerWaalsContact CE-CG 3.45Å; K179-F276 VanDerWaalsContact NZ-CG 3.31Å
180	A	89.9	Confident	86.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-58.3	-45.4	177.9	0	0	0	0	0	111.2	I113 I170 V176 A177 W182 A183 L184	I113-A180 HydrophobicContact CD1-CB 3.58Å; I170-A180 HydrophobicContact CD1-CB 4.34Å; I170-A180 HydrophobicContact CG1-CB 4.24Å; I170-A180 HydrophobicContact CG2-CB 4.04Å; V176-A180 WeakPolarHBondContact O-CB 3.43Å; V176-A180 PolarHBondContact O-N 3.08Å; A177-A180 PolarHBondContact O-N 2.94Å; A180-W182 PolarHBondContact O-N 3.05Å; A180-A183 PolarHBondContact O-N 3.07Å; A180-L184 WeakPolarHBondContact O-CB 3.15Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.49Å; A180-L184 PolarHBondContact O-N 3.19Å
181	Q	91.7	Very high	87.1	Confident	101 Å²	101	57 Å²	57	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-43.6	178	-170.5	62.7	55.3	0	0	111.6	A177 K179 A183 L184 D185	A177-Q181 WeakPolarHBondContact O-CB 3.44Å; A177-Q181 PolarHBondContact O-N 3.22Å; K179-Q181 VanDerWaalsContact C-N 3.32Å; K179-Q181 PolarHBondContact O-N 2.92Å; Q181-A183 VanDerWaalsContact C-N 3.31Å; Q181-A183 PolarHBondContact O-N 3.27Å; Q181-L184 PolarHBondContact O-N 2.95Å; Q181-D185 PolarHBondContact NE2-OD1 2.88Å; Q181-D185 WeakPolarHBondContact O-CB 3.36Å; Q181-D185 PolarHBondContact O-N 3.48Å
182	W	94.1	Very high	87.7	Confident	21 Å²	21	52.6 Å²	52.6	8%	0.08	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-44.7	176.2	-173.1	93.9	0	0	0	111.4	K178 K179 A180 D185 W186 A200 A203 V204 F208 I265 E268 A269 I272	K178-W182 PolarHBondContact O-N 3.32Å; K178-W182 VanDerWaalsContact O-N 3.07Å; K179-W182 PolarHBondContact O-N 3.42Å; A180-W182 PolarHBondContact O-N 3.05Å; W182-D185 PolarHBondContact O-N 2.6Å; W182-W186 AromaticContact CD2-CD1 3.74Å; W182-W186 AromaticContact CD2-NE1 3.67Å; W182-W186 AromaticContact CE2-CD1 3.81Å; W182-W186 AromaticContact CE2-NE1 3.23Å; W182-W186 AromaticContact CE3-CD1 3.61Å; W182-W186 AromaticContact CE3-NE1 3.9Å; W182-W186 AromaticContact CH2-CD1 3.72Å; W182-W186 AromaticContact CH2-NE1 3.43Å; W182-W186 AromaticContact CZ2-CD1 3.84Å; W182-W186 AromaticContact CZ2-NE1 3.14Å; W182-W186 AromaticContact CZ3-CD1 3.59Å; W182-W186 AromaticContact CZ3-NE1 3.79Å; W182-W186 AromaticContact NE1-NE1 3.77Å; W182-W186 PolarHBondContact O-N 3.27Å; W182-A200 HydrophobicContact CH2-CB 3.91Å; W182-A200 HydrophobicContact CZ3-CB 4.41Å; W182-A203 HydrophobicContact CH2-CB 4.18Å; W182-V204 HydrophobicContact CE3-CG2 4.3Å; W182-V204 HydrophobicContact CZ3-CG2 3.71Å; W182-F208 HydrophobicContact CD2-CE2 4.17Å; W182-F208 AromaticContact CD2-CZ 3.88Å; W182-F208 HydrophobicContact CD2-CZ 3.88Å; W182-F208 AromaticContact CE3-CE2 3.46Å; W182-F208 HydrophobicContact CE3-CE2 3.46Å; W182-F208 VanDerWaalsContact CE3-CE2 3.46Å; W182-F208 AromaticContact CE3-CZ 3.59Å; W182-F208 HydrophobicContact CE3-CZ 3.59Å; W182-F208 HydrophobicContact CG-CZ 4.32Å; W182-F208 AromaticContact CZ3-CE2 3.91Å; W182-F208 HydrophobicContact CZ3-CE2 3.91Å; W182-F208 HydrophobicContact CZ3-CZ 4.06Å; W182-I265 HydrophobicContact CH2-CG2 4.08Å; W182-I265 HydrophobicContact CZ2-CG2 3.94Å; W182-E268 PolarHBondContact NE1-OE2 3.08Å; W182-A269 HydrophobicContact CH2-CB 4.36Å; W182-A269 HydrophobicContact CZ2-CB 4.32Å; W182-I272 HydrophobicContact CB-CD1 4.03Å; W182-I272 HydrophobicContact CG-CD1 3.79Å
183	A	93.5	Very high	88.4	Confident	10 Å²	10	50.7 Å²	50.7	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-44	177.1	0	0	0	0	0	112.4	I113 K179 A180 Q181 D185 W186 I187 V204	I113-A183 HydrophobicContact CG2-CB 3.75Å; K179-A183 PolarHBondContact O-N 3.25Å; K179-A183 VanDerWaalsContact O-N 3.08Å; A180-A183 PolarHBondContact O-N 3.07Å; Q181-A183 VanDerWaalsContact C-N 3.31Å; Q181-A183 PolarHBondContact O-N 3.27Å; A183-D185 VanDerWaalsContact C-N 3.32Å; A183-D185 PolarHBondContact O-N 2.83Å; A183-W186 PolarHBondContact O-N 3.06Å; A183-I187 WeakPolarHBondContact O-CG1 3.21Å; A183-I187 PolarHBondContact O-N 2.92Å; A183-I187 VanDerWaalsContact O-N 3.16Å; A183-V204 HydrophobicContact CB-CG2 4.23Å
184	L	92.5	Very high	89.2	Confident	73 Å²	73	49.9 Å²	49.9	38%	0.382	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-36.9	177.1	-72.2	168.2	0	0	0	112.6	I113 A180 Q181 W186 I187 G188	I113-L184 HydrophobicContact CD1-CG 4.36Å; I113-L184 HydrophobicContact CG1-CD2 4.43Å; I113-L184 HydrophobicContact CG2-CD2 4.15Å; I113-L184 HydrophobicContact CG2-CG 4.3Å; A180-L184 WeakPolarHBondContact O-CB 3.15Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.49Å; A180-L184 PolarHBondContact O-N 3.19Å; Q181-L184 PolarHBondContact O-N 2.95Å; L184-W186 VanDerWaalsContact C-N 3.26Å; L184-W186 PolarHBondContact O-N 3.39Å; L184-I187 HydrophobicContact CD2-CD1 4.32Å; L184-I187 PolarHBondContact O-N 2.59Å; L184-G188 PolarHBondContact O-N 2.97Å
185	D	93.7	Very high	89.8	Confident	92 Å²	92	44 Å²	44	49%	0.492	25%	0.247	S	C	.	.	H	α-helix	trans	-60	-39.1	176.3	-71.9	-16.7	0	0	0	110.8	Q181 W182 A183 D189	Q181-D185 PolarHBondContact NE2-OD1 2.88Å; Q181-D185 WeakPolarHBondContact O-CB 3.36Å; Q181-D185 PolarHBondContact O-N 3.48Å; W182-D185 PolarHBondContact O-N 2.6Å; A183-D185 VanDerWaalsContact C-N 3.32Å; A183-D185 PolarHBondContact O-N 2.83Å; D185-D189 WeakPolarHBondContact O-CB 3.37Å; D185-D189 PolarHBondContact O-N 3.02Å
186	W	93.1	Very high	90.6	Very high	22 Å²	22	44.2 Å²	44.2	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-31.8	176	-74.1	110.4	0	0	0	114.2	W182 A183 L184 E196 R197 A200 R261 I265	W182-W186 AromaticContact CD2-CD1 3.74Å; W182-W186 AromaticContact CD2-NE1 3.67Å; W182-W186 AromaticContact CE2-CD1 3.81Å; W182-W186 AromaticContact CE2-NE1 3.23Å; W182-W186 AromaticContact CE3-CD1 3.61Å; W182-W186 AromaticContact CE3-NE1 3.9Å; W182-W186 AromaticContact CH2-CD1 3.72Å; W182-W186 AromaticContact CH2-NE1 3.43Å; W182-W186 AromaticContact CZ2-CD1 3.84Å; W182-W186 AromaticContact CZ2-NE1 3.14Å; W182-W186 AromaticContact CZ3-CD1 3.59Å; W182-W186 AromaticContact CZ3-NE1 3.79Å; W182-W186 AromaticContact NE1-NE1 3.77Å; W182-W186 PolarHBondContact O-N 3.27Å; A183-W186 PolarHBondContact O-N 3.06Å; L184-W186 VanDerWaalsContact C-N 3.26Å; L184-W186 PolarHBondContact O-N 3.39Å; W186-E196 HydrophobicContact CZ3-CB 4.34Å; W186-R197 HydrophobicContact CE3-CG 4.15Å; W186-A200 HydrophobicContact CB-CB 4.26Å; W186-A200 HydrophobicContact CD2-CB 3.34Å; W186-A200 VanDerWaalsContact CE2-CB 3.48Å; W186-A200 HydrophobicContact CE3-CB 3.78Å; W186-A200 HydrophobicContact CG-CB 3.55Å; W186-A200 HydrophobicContact CH2-CB 4.35Å; W186-A200 HydrophobicContact CZ2-CB 4.02Å; W186-A200 HydrophobicContact CZ3-CB 4.25Å; W186-R261 VanDerWaalsContact CH2-NH2 3.32Å; W186-I265 HydrophobicContact CH2-CD1 3.58Å; W186-I265 HydrophobicContact CH2-CG1 3.72Å; W186-I265 HydrophobicContact CZ2-CB 4.44Å; W186-I265 HydrophobicContact CZ2-CD1 4.04Å; W186-I265 HydrophobicContact CZ2-CG1 3.71Å; W186-I265 HydrophobicContact CZ2-CG2 4.03Å; W186-I265 HydrophobicContact CZ3-CD1 4.45Å
187	I	88.5	Confident	91.2	Very high	15 Å²	15	44.4 Å²	44.4	8%	0.077	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-48.5	173.3	-64.5	170.2	0	0	0	109.5	I113 N117 R121 A183 L184 D189	I113-I187 HydrophobicContact CG2-CD1 3.44Å; I113-I187 VanDerWaalsContact CG2-CD1 3.44Å; I113-I187 WeakPolarHBondContact O-CD1 3.39Å; N117-I187 HydrophobicContact CB-CD1 3.77Å; N117-I187 HydrophobicContact CB-CG1 3.66Å; R121-I187 WeakPolarHBondContact CD-O 3.22Å; R121-I187 HydrophobicContact CG-CG2 4.22Å; R121-I187 PolarHBondContact NE-O 3.09Å; A183-I187 WeakPolarHBondContact O-CG1 3.21Å; A183-I187 PolarHBondContact O-N 2.92Å; A183-I187 VanDerWaalsContact O-N 3.16Å; L184-I187 HydrophobicContact CD2-CD1 4.32Å; L184-I187 PolarHBondContact O-N 2.59Å; I187-D189 VanDerWaalsContact C-N 3.29Å; I187-D189 PolarHBondContact O-N 3Å
188	G	87.6	Confident	91.6	Very high	60 Å²	60	42.9 Å²	42.9	62%	0.619	23%	0.233	S	C	*	.	H	α-helix	trans	-75.6	-10.7	-179.5	0	0	0	0	0	115	L184 S190	L184-G188 PolarHBondContact O-N 2.97Å; G188-S190 PolarHBondContact O-N 3.48Å
189	D	88.5	Confident	92	Very high	36 Å²	36	38.4 Å²	38.4	19%	0.193	21%	0.214	C	C	.	.			trans	-70.9	119.1	-176.1	-169.9	7.4	0	0	0	112	R121 D185 I187 K191 S192	R121-D189 PolarHBondContact NH2-O 3.31Å; D185-D189 WeakPolarHBondContact O-CB 3.37Å; D185-D189 PolarHBondContact O-N 3.02Å; I187-D189 VanDerWaalsContact C-N 3.29Å; I187-D189 PolarHBondContact O-N 3Å; D189-K191 WeakPolarHBondContact OD1-CB 3.2Å; D189-K191 PolarHBondContact OD1-N 3.45Å; D189-S192 PolarHBondContact OD1-N 3.25Å; D189-S192 WeakPolarHBondContact OD2-CB 3.3Å; D189-S192 PolarHBondContact OD2-N 3.44Å; D189-S192 PolarHBondContact OD2-OG 3.19Å
190	S	84.3	Confident	92.4	Very high	93 Å²	93	38.3 Å²	38.3	65%	0.65	21%	0.213	S	C	*	.	S	Bend	trans	-100.6	-3.1	176.1	49	0	0	0	0	113.5	G188	G188-S190 PolarHBondContact O-N 3.48Å
191	K	87.8	Confident	92.7	Very high	192 Å²	192	38.5 Å²	38.5	84%	0.835	21%	0.214	S	C	*	.	S	Bend	trans	-99.9	-37.6	-175.5	-61.8	176.6	-175.9	170.2	0	112.7	D189	D189-K191 WeakPolarHBondContact OD1-CB 3.2Å; D189-K191 PolarHBondContact OD1-N 3.45Å
192	S	91.3	Very high	92.9	Very high	14 Å²	14	33.7 Å²	33.7	10%	0.098	19%	0.192	C	C	.	.	S	Bend	trans	-70.9	146.5	178.6	-65.2	0	0	0	0	111.7	D189	D189-S192 PolarHBondContact OD1-N 3.25Å; D189-S192 WeakPolarHBondContact OD2-CB 3.3Å; D189-S192 PolarHBondContact OD2-N 3.44Å; D189-S192 PolarHBondContact OD2-OG 3.19Å
193	T	93	Very high	93	Very high	33 Å²	33	32.7 Å²	32.7	20%	0.202	19%	0.188	C	C	.	.			trans	-64.8	159.4	175.7	58.7	0	0	0	0	111.6	E39 A195 E196 R197	E39-T193 WeakPolarHBondContact OE1-CA 3.43Å; E39-T193 VanDerWaalsContact OE1-CB 3.31Å; E39-T193 WeakPolarHBondContact OE1-CB 3.44Å; T193-A195 PolarHBondContact O-N 3Å; T193-E196 PolarHBondContact N-OE2 3.49Å; T193-E196 PolarHBondContact O-N 3.04Å; T193-E196 VanDerWaalsContact OG1-CG 3.3Å; T193-E196 WeakPolarHBondContact OG1-CG 3.34Å; T193-E196 PolarHBondContact OG1-N 2.91Å; T193-E196 PolarHBondContact OG1-OE2 3.08Å; T193-R197 PolarHBondContact O-N 3.24Å
194	F	93.9	Very high	93	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-51.9	-41	170.9	179.5	-90.4	0	0	0	111.7	V35 E39 L45 L46 F122 E125 V126 R197 L198 I253	V35-F194 HydrophobicContact CG1-CB 4.16Å; V35-F194 HydrophobicContact CG1-CD2 4.43Å; E39-F194 PolarHBondContact OE1-N 3.08Å; L45-F194 HydrophobicContact CD1-CE1 4.06Å; L46-F194 HydrophobicContact CD1-CB 4.03Å; L46-F194 HydrophobicContact CD1-CD2 4.46Å; L46-F194 HydrophobicContact CD1-CG 4.15Å; L46-F194 HydrophobicContact CD2-CD2 3.82Å; L46-F194 HydrophobicContact CD2-CE2 3.9Å; L46-F194 HydrophobicContact CD2-CG 4.17Å; L46-F194 HydrophobicContact CD2-CZ 4.34Å; F122-F194 HydrophobicContact CD1-CD2 4.4Å; F122-F194 AromaticContact CD1-CE2 3.52Å; F122-F194 HydrophobicContact CD1-CE2 3.52Å; F122-F194 AromaticContact CD1-CZ 3.79Å; F122-F194 HydrophobicContact CD1-CZ 3.79Å; F122-F194 HydrophobicContact CE1-CD2 4.4Å; F122-F194 AromaticContact CE1-CE2 3.83Å; F122-F194 HydrophobicContact CE1-CE2 3.83Å; F122-F194 HydrophobicContact CE1-CZ 4.02Å; E125-F194 HydrophobicContact CB-CE2 4.37Å; E125-F194 WeakPolarHBondContact OE2-CD2 3.14Å; V126-F194 HydrophobicContact CG2-CE2 3.97Å; V126-F194 HydrophobicContact CG2-CZ 3.72Å; F194-R197 PolarHBondContact O-N 3.43Å; F194-L198 HydrophobicContact CE1-CD2 4.09Å; F194-L198 WeakPolarHBondContact O-CB 3.24Å; F194-L198 PolarHBondContact O-N 2.83Å; F194-I253 HydrophobicContact CD1-CD1 3.72Å; F194-I253 HydrophobicContact CE1-CD1 3.97Å
195	A	95.4	Very high	93	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.033	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-42.3	-179.3	0	0	0	0	0	112.8	T193 L198 V199 F250 I253 P257	T193-A195 PolarHBondContact O-N 3Å; A195-L198 PolarHBondContact O-N 2.79Å; A195-V199 WeakPolarHBondContact O-CG2 3.44Å; A195-V199 PolarHBondContact O-N 3.01Å; A195-V199 VanDerWaalsContact O-N 3.07Å; A195-F250 HydrophobicContact CB-CE2 4.24Å; A195-I253 HydrophobicContact CB-CG1 4.4Å; A195-I253 HydrophobicContact CB-CG2 3.78Å; A195-P257 HydrophobicContact CB-CG 4.49Å
196	E	96.3	Very high	92.8	Very high	31 Å²	31	25.4 Å²	25.4	15%	0.145	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-42.6	174.8	-73.1	167.6	117.1	0	0	111.6	W186 T193 L198 V199 A200 P257 R261 I265	W186-E196 HydrophobicContact CZ3-CB 4.34Å; T193-E196 PolarHBondContact N-OE2 3.49Å; T193-E196 PolarHBondContact O-N 3.04Å; T193-E196 VanDerWaalsContact OG1-CG 3.3Å; T193-E196 WeakPolarHBondContact OG1-CG 3.34Å; T193-E196 PolarHBondContact OG1-N 2.91Å; T193-E196 PolarHBondContact OG1-OE2 3.08Å; E196-L198 VanDerWaalsContact C-N 3.31Å; E196-L198 PolarHBondContact O-N 3.49Å; E196-V199 WeakPolarHBondContact O-CB 3.49Å; E196-V199 PolarHBondContact O-N 2.98Å; E196-A200 PolarHBondContact O-N 3.28Å; E196-P257 HydrophobicContact CG-CB 3.89Å; E196-P257 HydrophobicContact CG-CG 4.36Å; E196-R261 HydrophobicContact CG-CG 4.15Å; E196-R261 VanDerWaalsContact OE1-CG 3.26Å; E196-R261 WeakPolarHBondContact OE1-CG 3.31Å; E196-R261 IonicContact OE1-CZ 3.07Å; E196-R261 IonicContact OE1-NE 2.59Å; E196-R261 PolarHBondContact OE1-NE 3.11Å; E196-R261 IonicContact OE1-NH2 3.97Å; E196-I265 HydrophobicContact CB-CD1 4.37Å
197	R	95.3	Very high	92.8	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.019	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-35.4	175.6	-71.2	-171.5	-66.5	115.6	-6.2	112.5	R121 F122 E125 W186 T193 F194 V199 A200 F201	R121-R197 VanDerWaalsContact NH2-CZ 3.3Å; R121-R197 VanDerWaalsContact NH2-NE 3.12Å; F122-R197 HydrophobicContact CZ-CB 4.44Å; E125-R197 IonicContact OE1-CZ 2.94Å; E125-R197 IonicContact OE1-NH1 3.85Å; E125-R197 PolarHBondContact OE1-NH1 3.3Å; E125-R197 IonicContact OE1-NH2 3.45Å; E125-R197 PolarHBondContact OE1-NH2 3.27Å; E125-R197 IonicContact OE2-CZ 3.82Å; E125-R197 IonicContact OE2-NH1 3.08Å; E125-R197 PolarHBondContact OE2-NH1 3.23Å; E125-R197 IonicContact OE2-NH2 3.04Å; E125-R197 PolarHBondContact OE2-NH2 2.74Å; W186-R197 HydrophobicContact CE3-CG 4.15Å; T193-R197 PolarHBondContact O-N 3.24Å; F194-R197 PolarHBondContact O-N 3.43Å; R197-V199 VanDerWaalsContact C-N 3.35Å; R197-A200 PolarHBondContact O-N 3.5Å; R197-F201 VanDerWaalsContact O-CB 3.31Å; R197-F201 WeakPolarHBondContact O-CB 3.5Å; R197-F201 PolarHBondContact O-N 3.27Å
198	L	96.2	Very high	93	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-37.2	175.5	-173.6	63.5	0	0	0	111.8	F122 F194 A195 E196 F201 A202 A246 L249 F250	F122-L198 HydrophobicContact CE1-CB 4.3Å; F122-L198 HydrophobicContact CE1-CD1 3.99Å; F122-L198 HydrophobicContact CZ-CD1 4.33Å; F194-L198 HydrophobicContact CE1-CD2 4.09Å; F194-L198 WeakPolarHBondContact O-CB 3.24Å; F194-L198 PolarHBondContact O-N 2.83Å; A195-L198 PolarHBondContact O-N 2.79Å; E196-L198 VanDerWaalsContact C-N 3.31Å; E196-L198 PolarHBondContact O-N 3.49Å; L198-F201 PolarHBondContact O-N 2.88Å; L198-A202 WeakPolarHBondContact O-CB 3.41Å; L198-A202 PolarHBondContact O-N 2.78Å; L198-A246 HydrophobicContact CD1-CB 3.96Å; L198-L249 HydrophobicContact CD2-CB 3.75Å; L198-F250 HydrophobicContact CD2-CB 3.92Å; L198-F250 HydrophobicContact CD2-CD2 4.31Å
199	V	97.4	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-45.9	172.2	171.6	0	0	0	0	110.8	A195 E196 R197 F201 A202 A203 F250 V262 I265 I266 L308	A195-V199 WeakPolarHBondContact O-CG2 3.44Å; A195-V199 PolarHBondContact O-N 3.01Å; A195-V199 VanDerWaalsContact O-N 3.07Å; E196-V199 WeakPolarHBondContact O-CB 3.49Å; E196-V199 PolarHBondContact O-N 2.98Å; R197-V199 VanDerWaalsContact C-N 3.35Å; V199-F201 VanDerWaalsContact C-N 3.31Å; V199-F201 PolarHBondContact O-N 2.73Å; V199-A202 PolarHBondContact O-N 2.58Å; V199-A203 PolarHBondContact O-N 2.86Å; V199-F250 HydrophobicContact CG2-CD2 3.86Å; V199-F250 HydrophobicContact CG2-CE2 3.41Å; V199-F250 VanDerWaalsContact CG2-CE2 3.41Å; V199-F250 HydrophobicContact CG2-CZ 4.02Å; V199-V262 HydrophobicContact CG1-CG1 3.98Å; V199-V262 HydrophobicContact CG2-CG2 4.27Å; V199-I265 HydrophobicContact CB-CD1 4.42Å; V199-I265 HydrophobicContact CG1-CB 4.25Å; V199-I265 HydrophobicContact CG1-CD1 4.18Å; V199-I265 HydrophobicContact CG1-CG2 4.06Å; V199-I266 HydrophobicContact CG1-CD1 4.04Å; V199-I266 HydrophobicContact CG1-CG1 4.43Å; V199-L308 HydrophobicContact CG1-CD1 4.18Å; V199-L308 HydrophobicContact CG2-CD1 4.3Å; V199-L308 HydrophobicContact CG2-CD2 4.46Å
200	A	96.8	Very high	93.2	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-41.8	176.9	0	0	0	0	0	111.7	W182 W186 E196 R197 A203 V204 I265	W182-A200 HydrophobicContact CH2-CB 3.91Å; W182-A200 HydrophobicContact CZ3-CB 4.41Å; W186-A200 HydrophobicContact CB-CB 4.26Å; W186-A200 HydrophobicContact CD2-CB 3.34Å; W186-A200 VanDerWaalsContact CE2-CB 3.48Å; W186-A200 HydrophobicContact CE3-CB 3.78Å; W186-A200 HydrophobicContact CG-CB 3.55Å; W186-A200 HydrophobicContact CH2-CB 4.35Å; W186-A200 HydrophobicContact CZ2-CB 4.02Å; W186-A200 HydrophobicContact CZ3-CB 4.25Å; E196-A200 PolarHBondContact O-N 3.28Å; R197-A200 PolarHBondContact O-N 3.5Å; A200-A203 WeakPolarHBondContact O-CB 2.91Å; A200-A203 PolarHBondContact O-N 3.25Å; A200-A203 VanDerWaalsContact O-N 3.16Å; A200-V204 PolarHBondContact O-N 3.19Å; A200-I265 HydrophobicContact CB-CG2 3.92Å
201	F	96	Very high	93.6	Very high	5 Å²	5	15.3 Å²	15.3	2%	0.022	8%	0.076	C	C	.	.	H	α-helix	trans	-61.8	-46	175.2	-174.4	-117.8	0	0	0	112.1	V114 N117 L118 F122 R197 L198 V199 A203 V204 E205 A246	V114-F201 HydrophobicContact CG1-CE2 3.98Å; V114-F201 HydrophobicContact CG1-CZ 4.18Å; N117-F201 VanDerWaalsContact ND2-CD2 3.27Å; N117-F201 WeakPolarHBondContact ND2-CD2 3.05Å; L118-F201 HydrophobicContact CD1-CZ 4.47Å; L118-F201 HydrophobicContact CD2-CE1 4.1Å; L118-F201 HydrophobicContact CD2-CZ 3.68Å; L118-F201 HydrophobicContact CG-CZ 3.99Å; F122-F201 HydrophobicContact CD2-CD1 4.46Å; F122-F201 HydrophobicContact CD2-CG 4.45Å; F122-F201 HydrophobicContact CE2-CB 3.77Å; F122-F201 AromaticContact CE2-CD1 3.89Å; F122-F201 HydrophobicContact CE2-CD1 3.89Å; F122-F201 AromaticContact CE2-CD2 3.92Å; F122-F201 HydrophobicContact CE2-CD2 3.92Å; F122-F201 HydrophobicContact CE2-CE1 4.48Å; F122-F201 HydrophobicContact CE2-CE2 4.48Å; F122-F201 AromaticContact CE2-CG 3.57Å; F122-F201 HydrophobicContact CE2-CG 3.57Å; F122-F201 HydrophobicContact CZ-CB 3.76Å; F122-F201 HydrophobicContact CZ-CD1 4.27Å; F122-F201 HydrophobicContact CZ-CG 4.02Å; R197-F201 VanDerWaalsContact O-CB 3.31Å; R197-F201 WeakPolarHBondContact O-CB 3.5Å; R197-F201 PolarHBondContact O-N 3.27Å; L198-F201 PolarHBondContact O-N 2.88Å; V199-F201 VanDerWaalsContact C-N 3.31Å; V199-F201 PolarHBondContact O-N 2.73Å; F201-A203 PolarHBondContact O-N 2.79Å; F201-V204 WeakPolarHBondContact O-CB 3.41Å; F201-V204 PolarHBondContact O-N 3.13Å; F201-E205 HydrophobicContact CE1-CG 4.15Å; F201-E205 HydrophobicContact CE2-CG 4.31Å; F201-E205 HydrophobicContact CZ-CG 4.04Å; F201-E205 WeakPolarHBondContact CZ-OE1 3.39Å; F201-E205 PolarHBondContact O-N 3.15Å; F201-E205 VanDerWaalsContact O-N 3.08Å; F201-A246 HydrophobicContact CD1-CB 4.38Å
202	A	95.5	Very high	93.8	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-61.2	-29.8	175.2	0	0	0	0	0	112.7	L198 V199 G206 A246 L304	L198-A202 WeakPolarHBondContact O-CB 3.41Å; L198-A202 PolarHBondContact O-N 2.78Å; V199-A202 PolarHBondContact O-N 2.58Å; A202-G206 WeakPolarHBondContact O-CA 3.37Å; A202-G206 PolarHBondContact O-N 3.4Å; A202-A246 HydrophobicContact CB-CB 3.83Å; A202-L304 HydrophobicContact CB-CD1 3.98Å
203	A	95.9	Very high	93.9	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-72.5	-34.7	173.6	0	0	0	0	0	112.6	W182 V199 A200 F201 V207 F208 I266 A269 L304	W182-A203 HydrophobicContact CH2-CB 4.18Å; V199-A203 PolarHBondContact O-N 2.86Å; A200-A203 WeakPolarHBondContact O-CB 2.91Å; A200-A203 PolarHBondContact O-N 3.25Å; A200-A203 VanDerWaalsContact O-N 3.16Å; F201-A203 PolarHBondContact O-N 2.79Å; A203-V207 WeakPolarHBondContact O-CA 3.46Å; A203-V207 VanDerWaalsContact O-CB 3.22Å; A203-V207 WeakPolarHBondContact O-CB 3.36Å; A203-V207 PolarHBondContact O-N 2.95Å; A203-F208 PolarHBondContact O-N 3.24Å; A203-I266 HydrophobicContact CB-CD1 3.81Å; A203-A269 HydrophobicContact CB-CB 4.02Å; A203-L304 HydrophobicContact CB-CD2 4.35Å
204	V	94.8	Very high	94	Very high	11 Å²	11	4.4 Å²	4.4	7%	0.067	2%	0.024	C	C	.	.	I	π-helix	trans	-61.1	-59.2	171.1	178.4	0	0	0	0	109.6	V114 W182 A183 A200 F201 G206 F208 F209	V114-V204 HydrophobicContact CG2-CG1 3.78Å; W182-V204 HydrophobicContact CE3-CG2 4.3Å; W182-V204 HydrophobicContact CZ3-CG2 3.71Å; A183-V204 HydrophobicContact CB-CG2 4.23Å; A200-V204 PolarHBondContact O-N 3.19Å; F201-V204 WeakPolarHBondContact O-CB 3.41Å; F201-V204 PolarHBondContact O-N 3.13Å; V204-G206 VanDerWaalsContact C-N 3.33Å; V204-G206 PolarHBondContact O-N 3.08Å; V204-F208 HydrophobicContact CB-CD2 4.37Å; V204-F208 HydrophobicContact CG1-CD2 4.32Å; V204-F208 HydrophobicContact CG2-CD2 4.11Å; V204-F208 HydrophobicContact CG2-CE2 4.27Å; V204-F208 WeakPolarHBondContact O-CB 3.44Å; V204-F208 PolarHBondContact O-N 2.98Å; V204-F209 HydrophobicContact CG1-CE2 3.96Å; V204-F209 WeakPolarHBondContact O-CD2 3.3Å
205	E	92.1	Very high	94	Very high	4 Å²	4	4.4 Å²	4.4	2%	0.019	2%	0.024	C	C	.	.	I	π-helix	trans	-62.7	-39.6	-177.1	-52.5	-65.3	-148.8	0	0	112.3	V114 Q138 F201 H242 C243	V114-E205 VanDerWaalsContact CG1-OE1 3.24Å; V114-E205 WeakPolarHBondContact CG1-OE1 3.49Å; Q138-E205 PolarHBondContact NE2-OE1 3.49Å; F201-E205 HydrophobicContact CE1-CG 4.15Å; F201-E205 HydrophobicContact CE2-CG 4.31Å; F201-E205 HydrophobicContact CZ-CG 4.04Å; F201-E205 WeakPolarHBondContact CZ-OE1 3.39Å; F201-E205 PolarHBondContact O-N 3.15Å; F201-E205 VanDerWaalsContact O-N 3.08Å; E205-H242 HydrophobicContact CB-CB 4.42Å; E205-H242 HydrophobicContact CG-CB 4.19Å; E205-C243 HydrophobicContact CB-CB 4.12Å
206	G	89.2	Confident	93.9	Very high	6 Å²	6	4.3 Å²	4.3	6%	0.062	2%	0.023	C	C	.	.	I	π-helix	trans	-91.5	-35.9	-170.5	0	0	0	0	0	115.3	A202 V204 S210 C243 I300	A202-G206 WeakPolarHBondContact O-CA 3.37Å; A202-G206 PolarHBondContact O-N 3.4Å; V204-G206 VanDerWaalsContact C-N 3.33Å; V204-G206 PolarHBondContact O-N 3.08Å; G206-S210 WeakPolarHBondContact O-CB 3.25Å; G206-C243 VanDerWaalsContact CA-SG 3.57Å; G206-I300 VanDerWaalsContact O-CG2 3.26Å; G206-I300 WeakPolarHBondContact O-CG2 3.17Å
207	V	93.4	Very high	93.8	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.017	C	C	.	.	I	π-helix	trans	-104.5	-51.4	-172.4	-175.5	0	0	0	0	110.9	A203 F209 S210 V270 E273 I297 L304	A203-V207 WeakPolarHBondContact O-CA 3.46Å; A203-V207 VanDerWaalsContact O-CB 3.22Å; A203-V207 WeakPolarHBondContact O-CB 3.36Å; A203-V207 PolarHBondContact O-N 2.95Å; V207-F209 VanDerWaalsContact C-N 3.3Å; V207-F209 PolarHBondContact O-N 3.14Å; V207-S210 PolarHBondContact O-N 3.29Å; V207-S210 PolarHBondContact O-OG 3.21Å; V207-V270 HydrophobicContact CG1-CG2 4.38Å; V207-E273 HydrophobicContact CG1-CB 4.43Å; V207-I297 HydrophobicContact CG1-CG2 3.98Å; V207-L304 HydrophobicContact CG2-CD2 3.89Å
208	F	92.3	Very high	93.7	Very high	4 Å²	4	5.9 Å²	5.9	2%	0.018	3%	0.028	C	C	.	.	I	π-helix	trans	-64.9	-29.2	-172.2	-75.7	-12.3	0	0	0	114.8	W182 A203 V204 A269 I272 E273	W182-F208 HydrophobicContact CD2-CE2 4.17Å; W182-F208 AromaticContact CD2-CZ 3.88Å; W182-F208 HydrophobicContact CD2-CZ 3.88Å; W182-F208 AromaticContact CE3-CE2 3.46Å; W182-F208 HydrophobicContact CE3-CE2 3.46Å; W182-F208 VanDerWaalsContact CE3-CE2 3.46Å; W182-F208 AromaticContact CE3-CZ 3.59Å; W182-F208 HydrophobicContact CE3-CZ 3.59Å; W182-F208 HydrophobicContact CG-CZ 4.32Å; W182-F208 AromaticContact CZ3-CE2 3.91Å; W182-F208 HydrophobicContact CZ3-CE2 3.91Å; W182-F208 HydrophobicContact CZ3-CZ 4.06Å; A203-F208 PolarHBondContact O-N 3.24Å; V204-F208 HydrophobicContact CB-CD2 4.37Å; V204-F208 HydrophobicContact CG1-CD2 4.32Å; V204-F208 HydrophobicContact CG2-CD2 4.11Å; V204-F208 HydrophobicContact CG2-CE2 4.27Å; V204-F208 WeakPolarHBondContact O-CB 3.44Å; V204-F208 PolarHBondContact O-N 2.98Å; F208-A269 HydrophobicContact CD1-CB 4.38Å; F208-A269 HydrophobicContact CE1-CB 3.75Å; F208-A269 WeakPolarHBondContact CE1-O 3.45Å; F208-A269 HydrophobicContact CZ-CB 4.25Å; F208-I272 HydrophobicContact CE1-CB 4.17Å; F208-I272 HydrophobicContact CE1-CG2 4.11Å; F208-I272 HydrophobicContact CZ-CD1 4.36Å; F208-I272 HydrophobicContact CZ-CG2 4.29Å; F208-E273 WeakPolarHBondContact CA-OE2 3.36Å
209	F	90.5	Very high	93.5	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-26.6	176.6	-61.2	-77.8	0	0	0	113.1	F106 F107 D111 V114 V204 V207 G211 S212 F213	F106-F209 HydrophobicContact CE1-CD1 4.29Å; F106-F209 HydrophobicContact CE1-CE1 4.5Å; F107-F209 AromaticContact CD1-CD1 3.6Å; F107-F209 HydrophobicContact CD1-CD1 3.6Å; F107-F209 AromaticContact CD1-CE1 3.97Å; F107-F209 HydrophobicContact CD1-CE1 3.97Å; F107-F209 HydrophobicContact CE1-CB 4.47Å; F107-F209 AromaticContact CE1-CD1 3.64Å; F107-F209 HydrophobicContact CE1-CD1 3.64Å; F107-F209 HydrophobicContact CE1-CE1 4.45Å; D111-F209 WeakPolarHBondContact OD1-CE1 3.29Å; V114-F209 HydrophobicContact CG2-CE2 4.3Å; V114-F209 HydrophobicContact CG2-CZ 4.28Å; V204-F209 HydrophobicContact CG1-CE2 3.96Å; V204-F209 WeakPolarHBondContact O-CD2 3.3Å; V207-F209 VanDerWaalsContact C-N 3.3Å; V207-F209 PolarHBondContact O-N 3.14Å; F209-G211 PolarHBondContact O-N 3.01Å; F209-S212 PolarHBondContact O-N 3.12Å; F209-F213 HydrophobicContact CB-CD2 3.97Å; F209-F213 HydrophobicContact CB-CE1 4.32Å; F209-F213 HydrophobicContact CB-CE2 3.41Å; F209-F213 VanDerWaalsContact CB-CE2 3.41Å; F209-F213 HydrophobicContact CB-CZ 3.63Å; F209-F213 HydrophobicContact CD1-CZ 4.4Å; F209-F213 HydrophobicContact CG-CE2 4.39Å; F209-F213 HydrophobicContact CG-CZ 4.25Å; F209-F213 WeakPolarHBondContact O-CD2 3.11Å; F209-F213 WeakPolarHBondContact O-CG 3.5Å; F209-F213 PolarHBondContact O-N 3.02Å
210	S	90	Very high	93.2	Very high	10 Å²	10	9.2 Å²	9.2	7%	0.07	4%	0.042	C	C	.	.	H	α-helix	trans	-57.8	-43.5	-168.7	66.5	0	0	0	0	114.5	G206 V207 F213 A214	G206-S210 WeakPolarHBondContact O-CB 3.25Å; V207-S210 PolarHBondContact O-N 3.29Å; V207-S210 PolarHBondContact O-OG 3.21Å; S210-F213 PolarHBondContact O-N 3.49Å; S210-A214 WeakPolarHBondContact O-CB 3.41Å; S210-A214 PolarHBondContact O-N 3.29Å
211	G	92	Very high	92.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-71.3	-38.2	-178.1	0	0	0	0	0	113	F209 A214 A215 L277 M293	F209-G211 PolarHBondContact O-N 3.01Å; G211-A214 PolarHBondContact O-N 3.05Å; G211-A215 WeakPolarHBondContact O-CB 3.43Å; G211-A215 PolarHBondContact O-N 3.11Å; G211-L277 VanDerWaalsContact CA-CD1 3.44Å; G211-M293 WeakPolarHBondContact O-CE 3.23Å
212	S	92.9	Very high	92.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.1	-39.3	173.8	-63.9	0	0	0	0	111.8	F107 F209 A215 I216	F107-S212 VanDerWaalsContact CE1-CB 3.43Å; F209-S212 PolarHBondContact O-N 3.12Å; S212-A215 WeakPolarHBondContact O-CB 3.16Å; S212-A215 PolarHBondContact O-N 3.39Å; S212-I216 PolarHBondContact O-N 3.44Å
213	F	93.9	Very high	92.3	Very high	11 Å²	11	21.8 Å²	21.8	5%	0.048	11%	0.109	C	C	.	.	H	α-helix	trans	-61.6	-45.5	171.6	-65.7	-26.7	0	0	0	112.1	F107 F209 S210 A215 I216 F217 N232 I235 S236 E239	F107-F213 HydrophobicContact CE1-CD1 4.33Å; F107-F213 HydrophobicContact CE1-CE1 4.07Å; F107-F213 HydrophobicContact CE2-CD1 4.17Å; F107-F213 HydrophobicContact CE2-CE1 4.09Å; F107-F213 AromaticContact CZ-CD1 3.57Å; F107-F213 HydrophobicContact CZ-CD1 3.57Å; F107-F213 AromaticContact CZ-CE1 3.59Å; F107-F213 HydrophobicContact CZ-CE1 3.59Å; F209-F213 HydrophobicContact CB-CD2 3.97Å; F209-F213 HydrophobicContact CB-CE1 4.32Å; F209-F213 HydrophobicContact CB-CE2 3.41Å; F209-F213 VanDerWaalsContact CB-CE2 3.41Å; F209-F213 HydrophobicContact CB-CZ 3.63Å; F209-F213 HydrophobicContact CD1-CZ 4.4Å; F209-F213 HydrophobicContact CG-CE2 4.39Å; F209-F213 HydrophobicContact CG-CZ 4.25Å; F209-F213 WeakPolarHBondContact O-CD2 3.11Å; F209-F213 WeakPolarHBondContact O-CG 3.5Å; F209-F213 PolarHBondContact O-N 3.02Å; S210-F213 PolarHBondContact O-N 3.49Å; F213-A215 VanDerWaalsContact C-N 3.25Å; F213-A215 PolarHBondContact O-N 2.98Å; F213-I216 PolarHBondContact O-N 3.36Å; F213-F217 HydrophobicContact CB-CE2 4.44Å; F213-F217 WeakPolarHBondContact O-CD2 3.24Å; F213-F217 PolarHBondContact O-N 3.29Å; F213-N232 WeakPolarHBondContact CD1-OD1 3.31Å; F213-N232 PolarHBondContact O-ND2 2.87Å; F213-I235 HydrophobicContact CE1-CG2 4.17Å; F213-I235 HydrophobicContact CZ-CG2 3.92Å; F213-S236 VanDerWaalsContact CD2-CB 3.46Å; F213-E239 HydrophobicContact CE2-CB 3.9Å; F213-E239 HydrophobicContact CE2-CG 3.66Å; F213-E239 HydrophobicContact CZ-CB 4.35Å; F213-E239 HydrophobicContact CZ-CG 3.59Å
214	A	94	Very high	92.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.5	-36.6	176	0	0	0	0	0	112.1	S210 G211 F217 W218 M293 Y296 M323	S210-A214 WeakPolarHBondContact O-CB 3.41Å; S210-A214 PolarHBondContact O-N 3.29Å; G211-A214 PolarHBondContact O-N 3.05Å; A214-F217 PolarHBondContact O-N 3.44Å; A214-W218 PolarHBondContact O-N 2.9Å; A214-M293 HydrophobicContact CB-CE 4.09Å; A214-Y296 HydrophobicContact CB-CD1 4.09Å; A214-Y296 HydrophobicContact CB-CE1 3.64Å; A214-M323 HydrophobicContact CB-CE 4.07Å; A214-M323 HydrophobicContact CB-CG 4.33Å; A214-M323 HydrophobicContact CB-SD 3.94Å
215	A	94.1	Very high	92.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.8	-37.3	175.8	0	0	0	0	0	113	F99 G211 S212 F213 W218 L219 V283 I286 M288 M293	F99-A215 HydrophobicContact CE1-CB 3.55Å; F99-A215 HydrophobicContact CZ-CB 3.5Å; G211-A215 WeakPolarHBondContact O-CB 3.43Å; G211-A215 PolarHBondContact O-N 3.11Å; S212-A215 WeakPolarHBondContact O-CB 3.16Å; S212-A215 PolarHBondContact O-N 3.39Å; F213-A215 VanDerWaalsContact C-N 3.25Å; F213-A215 PolarHBondContact O-N 2.98Å; A215-W218 WeakPolarHBondContact O-CB 3.29Å; A215-W218 PolarHBondContact O-N 2.73Å; A215-L219 PolarHBondContact O-N 3.31Å; A215-V283 HydrophobicContact CB-CG1 4.46Å; A215-I286 HydrophobicContact CB-CD1 3.7Å; A215-I286 WeakPolarHBondContact O-CD1 3.15Å; A215-M288 HydrophobicContact CB-SD 4.3Å; A215-M293 HydrophobicContact CB-CE 4.35Å
216	I	94	Very high	92.2	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-73.1	-38.8	174.3	-66.5	167.5	0	0	0	110.9	V103 F107 S212 F213 W218 L219 K220 L228 N232	V103-I216 HydrophobicContact CG1-CD1 4.03Å; F107-I216 HydrophobicContact CE2-CD1 3.69Å; F107-I216 HydrophobicContact CZ-CD1 4.44Å; S212-I216 PolarHBondContact O-N 3.44Å; F213-I216 PolarHBondContact O-N 3.36Å; I216-W218 PolarHBondContact O-N 3.24Å; I216-L219 WeakPolarHBondContact O-CA 3.48Å; I216-L219 VanDerWaalsContact O-CB 3.26Å; I216-L219 WeakPolarHBondContact O-CB 3.49Å; I216-L219 PolarHBondContact O-N 2.93Å; I216-K220 PolarHBondContact O-N 2.99Å; I216-L228 HydrophobicContact CD1-CD1 4.35Å; I216-L228 HydrophobicContact CG2-CD2 4.36Å; I216-L228 HydrophobicContact CG2-CG 3.98Å; I216-N232 HydrophobicContact CB-CB 4.31Å; I216-N232 WeakPolarHBondContact CD1-OD1 3.46Å; I216-N232 HydrophobicContact CG2-CB 3.59Å
217	F	93.5	Very high	92.4	Very high	4 Å²	4	25 Å²	25	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-28.6	173.6	-75.8	-52.8	0	0	0	113.4	F213 A214 L219 K220 K221 N232 E233 S236 F322 M323 I326	F213-F217 HydrophobicContact CB-CE2 4.44Å; F213-F217 WeakPolarHBondContact O-CD2 3.24Å; F213-F217 PolarHBondContact O-N 3.29Å; A214-F217 PolarHBondContact O-N 3.44Å; F217-L219 VanDerWaalsContact C-N 3.29Å; F217-L219 PolarHBondContact O-N 2.99Å; F217-K220 HydrophobicContact CD1-CB 4.49Å; F217-K220 HydrophobicContact CD1-CD 3.99Å; F217-K220 HydrophobicContact CE1-CD 4.34Å; F217-K220 WeakPolarHBondContact O-CB 3.45Å; F217-K220 PolarHBondContact O-N 3.21Å; F217-K221 PolarHBondContact O-N 3.43Å; F217-N232 WeakPolarHBondContact CE2-ND2 3.31Å; F217-N232 WeakPolarHBondContact CZ-ND2 2.96Å; F217-E233 HydrophobicContact CE1-CB 4.16Å; F217-E233 HydrophobicContact CZ-CB 4.38Å; F217-S236 WeakPolarHBondContact CZ-OG 3.45Å; F217-F322 HydrophobicContact CB-CD2 4.04Å; F217-F322 HydrophobicContact CB-CE2 3.93Å; F217-M323 HydrophobicContact CB-SD 4.07Å; F217-M323 HydrophobicContact CD2-CE 3.78Å; F217-M323 HydrophobicContact CD2-SD 3.59Å; F217-M323 VanDerWaalsContact CD2-SD 3.59Å; F217-M323 HydrophobicContact CE2-CE 4.14Å; F217-M323 HydrophobicContact CE2-SD 4.41Å; F217-M323 HydrophobicContact CG-SD 4.2Å; F217-I326 HydrophobicContact CB-CD1 3.63Å; F217-I326 HydrophobicContact CD1-CD1 3.28Å; F217-I326 HydrophobicContact CD1-CG1 4.22Å; F217-I326 HydrophobicContact CD2-CD1 3.75Å; F217-I326 HydrophobicContact CE1-CD1 3.74Å; F217-I326 HydrophobicContact CE1-CG1 4.3Å; F217-I326 HydrophobicContact CE1-CG2 3.87Å; F217-I326 HydrophobicContact CE2-CD1 4.15Å; F217-I326 HydrophobicContact CE2-CG2 4.25Å; F217-I326 HydrophobicContact CG-CD1 3.28Å; F217-I326 HydrophobicContact CZ-CD1 4.14Å; F217-I326 HydrophobicContact CZ-CG2 3.68Å
218	W	93	Very high	92.5	Very high	65 Å²	65	25 Å²	25	25%	0.246	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-37	168.7	177.2	-103.4	0	0	0	112.6	A214 A215 I216 K221 R222 I286 M288 F322	A214-W218 PolarHBondContact O-N 2.9Å; A215-W218 WeakPolarHBondContact O-CB 3.29Å; A215-W218 PolarHBondContact O-N 2.73Å; I216-W218 PolarHBondContact O-N 3.24Å; W218-K221 PolarHBondContact O-N 2.98Å; W218-R222 WeakPolarHBondContact O-CG 3.26Å; W218-R222 PolarHBondContact O-N 2.91Å; W218-I286 PolarHBondContact NE1-O 3.23Å; W218-M288 HydrophobicContact CB-CE 4.15Å; W218-M288 HydrophobicContact CB-CG 4Å; W218-M288 HydrophobicContact CB-SD 3.47Å; W218-M288 WeakPolarHBondContact CB-SD 3.17Å; W218-M288 VanDerWaalsContact CD1-CG 3.47Å; W218-M288 HydrophobicContact CD2-CG 3.58Å; W218-M288 HydrophobicContact CD2-SD 4.2Å; W218-M288 HydrophobicContact CE3-CG 4.28Å; W218-M288 HydrophobicContact CG-CE 4.42Å; W218-M288 HydrophobicContact CG-CG 3.42Å; W218-M288 VanDerWaalsContact CG-CG 3.42Å; W218-M288 HydrophobicContact CG-SD 3.62Å; W218-F322 HydrophobicContact CB-CZ 4.45Å; W218-F322 AromaticContact CE3-CE1 3.88Å; W218-F322 HydrophobicContact CE3-CE1 3.88Å; W218-F322 HydrophobicContact CE3-CZ 4.21Å; W218-F322 HydrophobicContact CZ3-CE1 4.34Å
219	L	91.4	Very high	92.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68	-40.1	172.6	-57.1	173.5	0	0	0	111.3	I100 A215 I216 F217 K221 R222 G223 L224 I286	I100-L219 HydrophobicContact CD1-CD1 3.5Å; I100-L219 HydrophobicContact CG1-CD1 3.66Å; A215-L219 PolarHBondContact O-N 3.31Å; I216-L219 WeakPolarHBondContact O-CA 3.48Å; I216-L219 VanDerWaalsContact O-CB 3.26Å; I216-L219 WeakPolarHBondContact O-CB 3.49Å; I216-L219 PolarHBondContact O-N 2.93Å; F217-L219 VanDerWaalsContact C-N 3.29Å; F217-L219 PolarHBondContact O-N 2.99Å; L219-K221 VanDerWaalsContact C-N 3.33Å; L219-K221 PolarHBondContact O-N 3.49Å; L219-R222 CarbonylContact O-C 3.51Å; L219-R222 WeakPolarHBondContact O-CA 3.33Å; L219-R222 WeakPolarHBondContact O-CB 3.4Å; L219-R222 PolarHBondContact O-N 3.35Å; L219-G223 PolarHBondContact O-N 3.14Å; L219-L224 HydrophobicContact CB-CB 4.45Å; L219-L224 PolarHBondContact O-N 3.26Å; L219-L224 VanDerWaalsContact O-N 3.1Å; L219-I286 HydrophobicContact CD2-CB 4.32Å; L219-I286 HydrophobicContact CD2-CG2 4.28Å
220	K	91.3	Very high	92.7	Very high	69 Å²	69	28.6 Å²	28.6	30%	0.3	15%	0.145	S	C	.	.	H	α-helix	trans	-55.8	-46.6	172.5	-172.7	-176.6	176.1	-173.7	0	111.3	I216 F217 R222 G223 S229 E233	I216-K220 PolarHBondContact O-N 2.99Å; F217-K220 HydrophobicContact CD1-CB 4.49Å; F217-K220 HydrophobicContact CD1-CD 3.99Å; F217-K220 HydrophobicContact CE1-CD 4.34Å; F217-K220 WeakPolarHBondContact O-CB 3.45Å; F217-K220 PolarHBondContact O-N 3.21Å; K220-R222 PolarHBondContact O-N 3.38Å; K220-R222 VanDerWaalsContact O-N 3.15Å; K220-G223 PolarHBondContact O-N 3.33Å; K220-S229 WeakPolarHBondContact CB-OG 3.37Å; K220-E233 IonicContact NZ-OE2 3.2Å; K220-E233 PolarHBondContact NZ-OE2 2.97Å
221	K	89.3	Confident	92.9	Very high	114 Å²	114	28.2 Å²	28.2	50%	0.496	14%	0.142	S	C	.	.	H	α-helix	trans	-59.1	-27	177.3	-168.9	173	-172.6	170.6	0	112.6	F217 W218 L219 D321 F322	F217-K221 PolarHBondContact O-N 3.43Å; W218-K221 PolarHBondContact O-N 2.98Å; L219-K221 VanDerWaalsContact C-N 3.33Å; L219-K221 PolarHBondContact O-N 3.49Å; K221-D321 IonicContact NZ-OD1 2.69Å; K221-D321 PolarHBondContact NZ-OD1 3.06Å; K221-D321 IonicContact NZ-OD2 2.82Å; K221-F322 HydrophobicContact CD-CB 4.17Å; K221-F322 HydrophobicContact CD-CD1 4.06Å; K221-F322 HydrophobicContact CD-CG 4.27Å
222	R	90.6	Very high	93	Very high	104 Å²	104	28.3 Å²	28.3	39%	0.392	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.3	176.2	-65.8	171.4	57.4	-163.6	-8.3	113.6	E96 W218 L219 K220 L224 I286	E96-R222 IonicContact OE1-CZ 3.55Å; E96-R222 IonicContact OE1-NH1 3.94Å; E96-R222 PolarHBondContact OE1-NH1 3.02Å; E96-R222 IonicContact OE1-NH2 3.98Å; E96-R222 PolarHBondContact OE1-NH2 3.13Å; W218-R222 WeakPolarHBondContact O-CG 3.26Å; W218-R222 PolarHBondContact O-N 2.91Å; L219-R222 CarbonylContact O-C 3.51Å; L219-R222 WeakPolarHBondContact O-CA 3.33Å; L219-R222 WeakPolarHBondContact O-CB 3.4Å; L219-R222 PolarHBondContact O-N 3.35Å; K220-R222 PolarHBondContact O-N 3.38Å; K220-R222 VanDerWaalsContact O-N 3.15Å; R222-L224 VanDerWaalsContact C-N 3.33Å; R222-L224 HydrophobicContact CB-CD1 4.08Å; R222-L224 HydrophobicContact CB-CG 4.19Å; R222-I286 PolarHBondContact NH1-O 3.45Å
223	G	89.6	Confident	92.9	Very high	53 Å²	53	30 Å²	30	55%	0.546	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	24	-178.4	0	0	0	0	0	113.9	H88 L219 K220	H88-G223 PolarHBondContact CE1-O 2.91Å; L219-G223 PolarHBondContact O-N 3.14Å; K220-G223 PolarHBondContact O-N 3.33Å
224	L	92.4	Very high	92.9	Very high	29 Å²	29	29.7 Å²	29.7	15%	0.152	15%	0.149	C	C	.	.			trans	-101	151.8	-178	-62.5	172.4	0	0	0	110.9	L92 L219 R222 S229	L92-L224 HydrophobicContact CD2-CD1 3.86Å; L92-L224 HydrophobicContact CD2-CD2 4.36Å; L92-L224 HydrophobicContact CD2-CG 4.5Å; L219-L224 HydrophobicContact CB-CB 4.45Å; L219-L224 PolarHBondContact O-N 3.26Å; L219-L224 VanDerWaalsContact O-N 3.1Å; R222-L224 VanDerWaalsContact C-N 3.33Å; R222-L224 HydrophobicContact CB-CD1 4.08Å; R222-L224 HydrophobicContact CB-CG 4.19Å; L224-S229 PolarHBondContact O-OG 3.31Å
225	M	94.5	Very high	92.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.			trans	44.5	65.6	175	-52	-62.6	-68.2	0	0	114	D85 H88 W89 L92 Y156 G227 L228 S229	D85-M225 HydrophobicContact CB-CE 3.76Å; D85-M225 HydrophobicContact CB-SD 4.41Å; D85-M225 WeakPolarHBondContact OD2-CA 3.39Å; H88-M225 HydrophobicContact CB-CG 4.5Å; H88-M225 HydrophobicContact CB-SD 3.57Å; H88-M225 VanDerWaalsContact CB-SD 3.57Å; H88-M225 PolarHBondContact ND1-N 3.23Å; H88-M225 VanDerWaalsContact ND1-N 3.13Å; W89-M225 HydrophobicContact CB-CE 4.2Å; W89-M225 HydrophobicContact CB-SD 4.23Å; W89-M225 HydrophobicContact CE3-CE 3.83Å; W89-M225 HydrophobicContact CE3-SD 4.4Å; L92-M225 HydrophobicContact CD1-CG 4.18Å; L92-M225 HydrophobicContact CD1-SD 4Å; Y156-M225 HydrophobicContact CD1-CE 4.13Å; Y156-M225 HydrophobicContact CD2-CE 4.27Å; Y156-M225 HydrophobicContact CE1-CE 3.66Å; Y156-M225 HydrophobicContact CE2-CE 3.79Å; Y156-M225 HydrophobicContact CG-CE 4.45Å; Y156-M225 VanDerWaalsContact CZ-CE 3.48Å; M225-G227 VanDerWaalsContact C-N 3.33Å; M225-G227 PolarHBondContact O-N 3.2Å; M225-L228 HydrophobicContact CB-CB 3.79Å; M225-L228 HydrophobicContact CB-CD2 4.05Å; M225-L228 HydrophobicContact CB-CG 4.48Å; M225-L228 HydrophobicContact CG-CD2 4.36Å; M225-L228 PolarHBondContact O-N 2.98Å; M225-S229 VanDerWaalsContact O-CB 3.3Å; M225-S229 WeakPolarHBondContact O-CB 3.15Å; M225-S229 PolarHBondContact O-N 3.32Å; M225-S229 PolarHBondContact O-OG 2.89Å
226	P	93.3	Very high	92.8	Very high	55 Å²	55	31 Å²	31	36%	0.357	16%	0.158	S	C	.	.	H	α-helix	trans	-59.3	-37.2	-175.9	23.2	-34.6	0	0	0	114.2	K84 D85 H88 S229 F230	K84-P226 HydrophobicContact CB-CG 3.92Å; K84-P226 HydrophobicContact CD-CG 4.42Å; D85-P226 WeakPolarHBondContact OD1-CD 3.27Å; D85-P226 VanDerWaalsContact OD1-CG 3.29Å; D85-P226 WeakPolarHBondContact OD1-CG 3.46Å; D85-P226 VanDerWaalsContact OD1-N 3.11Å; H88-P226 WeakPolarHBondContact ND1-CD 3.49Å; P226-S229 PolarHBondContact O-N 3.24Å; P226-F230 VanDerWaalsContact O-CB 3.32Å; P226-F230 WeakPolarHBondContact O-CB 3.34Å; P226-F230 PolarHBondContact O-N 3.45Å
227	G	93.8	Very high	92.7	Very high	3 Å²	3	34.4 Å²	34.4	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-51.1	176.8	0	0	0	0	0	112	D81 D85 M225 S229 F230 S231	D81-G227 WeakPolarHBondContact O-CA 3.38Å; D85-G227 VanDerWaalsContact CG-N 3.33Å; D85-G227 PolarHBondContact OD1-N 3.44Å; D85-G227 WeakPolarHBondContact OD2-CA 3.46Å; D85-G227 PolarHBondContact OD2-N 3.36Å; M225-G227 VanDerWaalsContact C-N 3.33Å; M225-G227 PolarHBondContact O-N 3.2Å; G227-S229 VanDerWaalsContact C-N 3.3Å; G227-S229 PolarHBondContact O-N 3.35Å; G227-F230 PolarHBondContact O-N 3.18Å; G227-S231 PolarHBondContact O-N 3.07Å; G227-S231 PolarHBondContact O-OG 3.37Å
228	L	95.5	Very high	92.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-57.2	-42.9	173	176.2	62.3	0	0	0	111.9	D85 I100 L104 L152 I216 M225 F230 S231 N232	D85-L228 WeakPolarHBondContact OD2-CB 3.3Å; D85-L228 PolarHBondContact OD2-N 2.87Å; I100-L228 HydrophobicContact CG2-CD2 3.75Å; L104-L228 HydrophobicContact CD2-CD1 3.88Å; L152-L228 HydrophobicContact CD1-CD1 3.91Å; L152-L228 HydrophobicContact CD2-CB 4.48Å; L152-L228 HydrophobicContact CD2-CD1 4.21Å; I216-L228 HydrophobicContact CD1-CD1 4.35Å; I216-L228 HydrophobicContact CG2-CD2 4.36Å; I216-L228 HydrophobicContact CG2-CG 3.98Å; M225-L228 HydrophobicContact CB-CB 3.79Å; M225-L228 HydrophobicContact CB-CD2 4.05Å; M225-L228 HydrophobicContact CB-CG 4.48Å; M225-L228 HydrophobicContact CG-CD2 4.36Å; M225-L228 PolarHBondContact O-N 2.98Å; L228-F230 VanDerWaalsContact C-N 3.33Å; L228-S231 WeakPolarHBondContact CA-OG 3.41Å; L228-S231 PolarHBondContact O-OG 3.32Å; L228-N232 WeakPolarHBondContact O-CB 3.36Å; L228-N232 PolarHBondContact O-N 3.22Å
229	S	93.3	Very high	92.7	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.028	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-38.7	-179.5	-63.8	0	0	0	0	111.7	K220 L224 M225 P226 G227 E233	K220-S229 WeakPolarHBondContact CB-OG 3.37Å; L224-S229 PolarHBondContact O-OG 3.31Å; M225-S229 VanDerWaalsContact O-CB 3.3Å; M225-S229 WeakPolarHBondContact O-CB 3.15Å; M225-S229 PolarHBondContact O-N 3.32Å; M225-S229 PolarHBondContact O-OG 2.89Å; P226-S229 PolarHBondContact O-N 3.24Å; G227-S229 VanDerWaalsContact C-N 3.3Å; G227-S229 PolarHBondContact O-N 3.35Å; S229-E233 PolarHBondContact O-N 3.39Å; S229-E233 VanDerWaalsContact O-N 3.1Å
230	F	93.5	Very high	92.7	Very high	76 Å²	76	32.7 Å²	32.7	33%	0.333	17%	0.172	S	C	.	.	H	α-helix	trans	-71.1	-45.3	177.7	-178	-116.8	0	0	0	111.8	V80 P226 G227 L228 N232 E233 L234	V80-F230 HydrophobicContact CG1-CD1 4.36Å; V80-F230 HydrophobicContact CG2-CD1 4.11Å; V80-F230 HydrophobicContact CG2-CE1 4.31Å; P226-F230 VanDerWaalsContact O-CB 3.32Å; P226-F230 WeakPolarHBondContact O-CB 3.34Å; P226-F230 PolarHBondContact O-N 3.45Å; G227-F230 PolarHBondContact O-N 3.18Å; L228-F230 VanDerWaalsContact C-N 3.33Å; F230-N232 VanDerWaalsContact C-N 3.28Å; F230-N232 PolarHBondContact O-N 2.88Å; F230-E233 WeakPolarHBondContact O-CB 3.26Å; F230-E233 PolarHBondContact O-N 2.94Å; F230-E233 VanDerWaalsContact O-N 3.12Å; F230-L234 HydrophobicContact CD1-CD1 4.27Å; F230-L234 HydrophobicContact CE1-CD1 3.78Å; F230-L234 HydrophobicContact CE2-CD2 4.48Å; F230-L234 HydrophobicContact CE2-CG 4.49Å; F230-L234 HydrophobicContact CZ-CD1 3.95Å; F230-L234 HydrophobicContact CZ-CD2 4.33Å; F230-L234 HydrophobicContact CZ-CG 4.31Å; F230-L234 PolarHBondContact O-N 2.87Å; F230-L234 VanDerWaalsContact O-N 3.14Å
231	S	94.5	Very high	92.7	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-40.1	173.8	60.8	0	0	0	0	111.6	G227 L228 E233 L234 I235	G227-S231 PolarHBondContact O-N 3.07Å; G227-S231 PolarHBondContact O-OG 3.37Å; L228-S231 WeakPolarHBondContact CA-OG 3.41Å; L228-S231 PolarHBondContact O-OG 3.32Å; S231-E233 VanDerWaalsContact C-N 3.28Å; S231-E233 PolarHBondContact O-N 3.44Å; S231-L234 PolarHBondContact O-N 3.32Å; S231-I235 VanDerWaalsContact O-CG1 3.24Å; S231-I235 WeakPolarHBondContact O-CG1 3.44Å; S231-I235 PolarHBondContact O-N 3.35Å
232	N	94	Very high	93	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-33.6	176.2	-175.4	82.7	0	0	0	112.7	F213 I216 F217 L228 F230 S236	F213-N232 WeakPolarHBondContact CD1-OD1 3.31Å; F213-N232 PolarHBondContact O-ND2 2.87Å; I216-N232 HydrophobicContact CB-CB 4.31Å; I216-N232 WeakPolarHBondContact CD1-OD1 3.46Å; I216-N232 HydrophobicContact CG2-CB 3.59Å; F217-N232 WeakPolarHBondContact CE2-ND2 3.31Å; F217-N232 WeakPolarHBondContact CZ-ND2 2.96Å; L228-N232 WeakPolarHBondContact O-CB 3.36Å; L228-N232 PolarHBondContact O-N 3.22Å; F230-N232 VanDerWaalsContact C-N 3.28Å; F230-N232 PolarHBondContact O-N 2.88Å; N232-S236 WeakPolarHBondContact O-CB 3.33Å; N232-S236 PolarHBondContact O-N 3.04Å; N232-S236 PolarHBondContact O-OG 3.23Å
233	E	92	Very high	93.2	Very high	36 Å²	36	20.4 Å²	20.4	17%	0.168	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-46.2	174.3	-172.2	178.2	126	0	0	112	F217 K220 S229 F230 S231 S236 R237	F217-E233 HydrophobicContact CE1-CB 4.16Å; F217-E233 HydrophobicContact CZ-CB 4.38Å; K220-E233 IonicContact NZ-OE2 3.2Å; K220-E233 PolarHBondContact NZ-OE2 2.97Å; S229-E233 PolarHBondContact O-N 3.39Å; S229-E233 VanDerWaalsContact O-N 3.1Å; F230-E233 WeakPolarHBondContact O-CB 3.26Å; F230-E233 PolarHBondContact O-N 2.94Å; F230-E233 VanDerWaalsContact O-N 3.12Å; S231-E233 VanDerWaalsContact C-N 3.28Å; S231-E233 PolarHBondContact O-N 3.44Å; E233-S236 PolarHBondContact O-OG 3.49Å; E233-R237 WeakPolarHBondContact O-CB 3.37Å; E233-R237 PolarHBondContact O-N 2.86Å
234	L	93.4	Very high	93.3	Very high	5 Å²	5	21.2 Å²	21.2	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-62.6	-49	177.2	-62.5	175.7	0	0	0	111.4	W75 V80 F230 S231 R237 D238	W75-L234 HydrophobicContact CB-CD1 4.49Å; W75-L234 HydrophobicContact CD2-CB 4.07Å; W75-L234 HydrophobicContact CD2-CD1 3.67Å; W75-L234 HydrophobicContact CD2-CG 4.42Å; W75-L234 HydrophobicContact CE3-CD1 3.66Å; W75-L234 HydrophobicContact CG-CB 4.44Å; W75-L234 HydrophobicContact CG-CD1 4.05Å; W75-L234 HydrophobicContact CZ2-CB 3.96Å; W75-L234 HydrophobicContact CZ3-CD1 4.18Å; V80-L234 HydrophobicContact CG2-CD1 4.22Å; F230-L234 HydrophobicContact CD1-CD1 4.27Å; F230-L234 HydrophobicContact CE1-CD1 3.78Å; F230-L234 HydrophobicContact CE2-CD2 4.48Å; F230-L234 HydrophobicContact CE2-CG 4.49Å; F230-L234 HydrophobicContact CZ-CD1 3.95Å; F230-L234 HydrophobicContact CZ-CD2 4.33Å; F230-L234 HydrophobicContact CZ-CG 4.31Å; F230-L234 PolarHBondContact O-N 2.87Å; F230-L234 VanDerWaalsContact O-N 3.14Å; S231-L234 PolarHBondContact O-N 3.32Å; L234-R237 WeakPolarHBondContact O-CB 3.46Å; L234-R237 PolarHBondContact O-N 3.21Å; L234-D238 VanDerWaalsContact O-CG 3.28Å; L234-D238 PolarHBondContact O-N 3.38Å
235	I	94	Very high	93.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.9	-47.7	-177.6	-62	167	0	0	0	110.8	W75 M148 Y149 F213 S231 R237 D238 E239	W75-I235 HydrophobicContact CH2-CD1 4.41Å; W75-I235 HydrophobicContact CH2-CG1 4.02Å; W75-I235 HydrophobicContact CZ2-CG1 3.67Å; M148-I235 HydrophobicContact CB-CD1 4.49Å; M148-I235 HydrophobicContact CG-CD1 4.31Å; Y149-I235 HydrophobicContact CE1-CD1 3.88Å; Y149-I235 HydrophobicContact CE2-CD1 3.95Å; Y149-I235 HydrophobicContact CE2-CG2 4.48Å; Y149-I235 WeakPolarHBondContact OH-CG2 3.39Å; F213-I235 HydrophobicContact CE1-CG2 4.17Å; F213-I235 HydrophobicContact CZ-CG2 3.92Å; S231-I235 VanDerWaalsContact O-CG1 3.24Å; S231-I235 WeakPolarHBondContact O-CG1 3.44Å; S231-I235 PolarHBondContact O-N 3.35Å; I235-R237 PolarHBondContact O-N 3.14Å; I235-D238 WeakPolarHBondContact O-CA 3.47Å; I235-D238 PolarHBondContact O-N 3.08Å; I235-E239 HydrophobicContact CG2-CG 4.19Å; I235-E239 WeakPolarHBondContact O-CG 3.44Å; I235-E239 PolarHBondContact O-N 3.03Å
236	S	92.6	Very high	93.6	Very high	26 Å²	26	20 Å²	20	18%	0.182	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-28.1	-179.9	63.9	0	0	0	0	113.7	F213 F217 N232 E233 G240	F213-S236 VanDerWaalsContact CD2-CB 3.46Å; F217-S236 WeakPolarHBondContact CZ-OG 3.45Å; N232-S236 WeakPolarHBondContact O-CB 3.33Å; N232-S236 PolarHBondContact O-N 3.04Å; N232-S236 PolarHBondContact O-OG 3.23Å; E233-S236 PolarHBondContact O-OG 3.49Å; S236-G240 PolarHBondContact O-N 3.42Å
237	R	90.6	Very high	93.7	Very high	76 Å²	76	17.4 Å²	17.4	29%	0.287	9%	0.092	S	C	.	.	H	α-helix	trans	-67	-44.3	170.4	177	-157.8	67.7	-165.2	-7.1	111	S73 W75 E233 L234 I235 G240 L241	S73-R237 PolarHBondContact O-NH2 2.98Å; W75-R237 VanDerWaalsContact CD1-NH2 3.29Å; E233-R237 WeakPolarHBondContact O-CB 3.37Å; E233-R237 PolarHBondContact O-N 2.86Å; L234-R237 WeakPolarHBondContact O-CB 3.46Å; L234-R237 PolarHBondContact O-N 3.21Å; I235-R237 PolarHBondContact O-N 3.14Å; R237-G240 PolarHBondContact O-N 3.12Å; R237-L241 PolarHBondContact O-N 3.25Å
238	D	93.9	Very high	93.8	Very high	6 Å²	6	18.2 Å²	18.2	3%	0.032	10%	0.095	C	C	.	.	H	α-helix	trans	-67.7	-43.1	-179.3	-63.4	-18.7	0	0	0	110.4	W75 I141 H145 L234 I235 G240 L241 H242	W75-D238 PolarHBondContact NE1-OD2 3.01Å; I141-D238 HydrophobicContact CG1-CB 4.47Å; I141-D238 WeakPolarHBondContact CG1-OD2 3.38Å; H145-D238 IonicContact NE2-OD2 3.71Å; L234-D238 VanDerWaalsContact O-CG 3.28Å; L234-D238 PolarHBondContact O-N 3.38Å; I235-D238 WeakPolarHBondContact O-CA 3.47Å; I235-D238 PolarHBondContact O-N 3.08Å; D238-G240 VanDerWaalsContact C-N 3.31Å; D238-G240 PolarHBondContact O-N 2.75Å; D238-L241 CarbonylContact O-C 3.4Å; D238-L241 WeakPolarHBondContact O-CA 3.48Å; D238-L241 WeakPolarHBondContact O-CB 3.37Å; D238-L241 PolarHBondContact O-N 3.46Å; D238-H242 PolarHBondContact O-CD2 3.09Å; D238-H242 PolarHBondContact O-N 3.39Å; D238-H242 PolarHBondContact O-ND1 3.48Å
239	E	93.2	Very high	93.9	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.009	10%	0.095	C	C	.	.	H	α-helix	trans	-62.5	-36.6	172.6	-59.2	-42.3	151.8	0	0	113.5	H145 F213 I235 L241 H242 C243	H145-E239 IonicContact CE1-OE1 2.7Å; H145-E239 PolarHBondContact CE1-OE1 3.22Å; H145-E239 IonicContact ND1-OE1 2.6Å; H145-E239 PolarHBondContact ND1-OE1 2.89Å; F213-E239 HydrophobicContact CE2-CB 3.9Å; F213-E239 HydrophobicContact CE2-CG 3.66Å; F213-E239 HydrophobicContact CZ-CB 4.35Å; F213-E239 HydrophobicContact CZ-CG 3.59Å; I235-E239 HydrophobicContact CG2-CG 4.19Å; I235-E239 WeakPolarHBondContact O-CG 3.44Å; I235-E239 PolarHBondContact O-N 3.03Å; E239-L241 VanDerWaalsContact C-N 3.29Å; E239-L241 PolarHBondContact O-N 2.94Å; E239-H242 PolarHBondContact O-N 3.27Å; E239-H242 IonicContact OE2-CE1 2.96Å; E239-H242 IonicContact OE2-CG 2.92Å; E239-H242 IonicContact OE2-ND1 3.65Å; E239-H242 PolarHBondContact OE2-ND1 3.39Å; E239-C243 WeakPolarHBondContact O-CB 3.36Å; E239-C243 PolarHBondContact O-N 2.85Å
240	G	90.6	Very high	94	Very high	25 Å²	25	18 Å²	18	26%	0.258	9%	0.094	S	C	.	.	H	α-helix	trans	-58.3	-43.7	170.8	0	0	0	0	0	111.8	S236 R237 D238 D244	S236-G240 PolarHBondContact O-N 3.42Å; R237-G240 PolarHBondContact O-N 3.12Å; D238-G240 VanDerWaalsContact C-N 3.31Å; D238-G240 PolarHBondContact O-N 2.75Å; G240-D244 WeakPolarHBondContact O-CB 3.22Å; G240-D244 VanDerWaalsContact O-CG 3.26Å; G240-D244 PolarHBondContact O-N 3.07Å
241	L	92.5	Very high	94.1	Very high	20 Å²	20	19.5 Å²	19.5	11%	0.105	10%	0.1	C	C	.	.	H	α-helix	trans	-67.2	-38.2	176.9	-175.5	66.9	0	0	0	112.2	F66 K69 A70 F134 R237 D238 E239 F245	F66-L241 HydrophobicContact CD1-CD1 3.58Å; F66-L241 HydrophobicContact CD1-CG 4.43Å; F66-L241 HydrophobicContact CE1-CD1 3.79Å; K69-L241 HydrophobicContact CB-CD1 4.13Å; K69-L241 HydrophobicContact CB-CD2 4.3Å; K69-L241 HydrophobicContact CD-CD1 4.11Å; A70-L241 HydrophobicContact CB-CD2 3.93Å; F134-L241 HydrophobicContact CE2-CD2 4.19Å; F134-L241 HydrophobicContact CE2-CG 4.12Å; F134-L241 HydrophobicContact CZ-CD2 4.4Å; F134-L241 HydrophobicContact CZ-CG 4.07Å; R237-L241 PolarHBondContact O-N 3.25Å; D238-L241 CarbonylContact O-C 3.4Å; D238-L241 WeakPolarHBondContact O-CA 3.48Å; D238-L241 WeakPolarHBondContact O-CB 3.37Å; D238-L241 PolarHBondContact O-N 3.46Å; E239-L241 VanDerWaalsContact C-N 3.29Å; E239-L241 PolarHBondContact O-N 2.94Å; L241-F245 VanDerWaalsContact O-CB 3.3Å; L241-F245 WeakPolarHBondContact O-CB 3.46Å; L241-F245 PolarHBondContact O-N 3.29Å
242	H	94.5	Very high	94.2	Very high	5 Å²	5	21.9 Å²	21.9	2%	0.023	11%	0.111	C	C	.	.	H	α-helix	trans	-63.9	-48	176.5	-59.5	163.7	0	0	0	111.4	I141 E142 E205 D238 E239 F245 A246	I141-H242 VanDerWaalsContact CG2-CE1 3.44Å; I141-H242 WeakPolarHBondContact CG2-CE1 3.43Å; I141-H242 WeakPolarHBondContact CG2-NE2 3.1Å; E142-H242 IonicContact OE1-CE1 2.7Å; E142-H242 PolarHBondContact OE1-CE1 3.27Å; E142-H242 IonicContact OE1-ND1 3.06Å; E142-H242 PolarHBondContact OE1-ND1 3.05Å; E205-H242 HydrophobicContact CB-CB 4.42Å; E205-H242 HydrophobicContact CG-CB 4.19Å; D238-H242 PolarHBondContact O-CD2 3.09Å; D238-H242 PolarHBondContact O-N 3.39Å; D238-H242 PolarHBondContact O-ND1 3.48Å; E239-H242 PolarHBondContact O-N 3.27Å; E239-H242 IonicContact OE2-CE1 2.96Å; E239-H242 IonicContact OE2-CG 2.92Å; E239-H242 IonicContact OE2-ND1 3.65Å; E239-H242 PolarHBondContact OE2-ND1 3.39Å; H242-F245 WeakPolarHBondContact O-CB 3.26Å; H242-F245 PolarHBondContact O-N 3.13Å; H242-A246 PolarHBondContact O-N 3.41Å
243	C	94.7	Very high	94.3	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.027	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-48.8	175.9	-172.7	0	0	0	0	111.5	E205 G206 E239 F245 A246 C247	E205-C243 HydrophobicContact CB-CB 4.12Å; G206-C243 VanDerWaalsContact CA-SG 3.57Å; E239-C243 WeakPolarHBondContact O-CB 3.36Å; E239-C243 PolarHBondContact O-N 2.85Å; C243-F245 VanDerWaalsContact C-N 3.26Å; C243-F245 PolarHBondContact O-N 3.14Å; C243-A246 WeakPolarHBondContact O-CB 3.39Å; C243-A246 PolarHBondContact O-N 3.41Å; C243-A246 VanDerWaalsContact O-N 3.14Å; C243-C247 PolarHBondContact O-N 3.16Å; C243-C247 PolarHBondContact O-SG 3.43Å
244	D	93.6	Very high	94.4	Very high	70 Å²	70	25 Å²	25	37%	0.374	13%	0.128	S	C	.	.	H	α-helix	trans	-60.5	-36.5	177.3	-77.2	-6.9	0	0	0	111.9	F66 G240 C247 L248	F66-D244 HydrophobicContact CE1-CB 3.71Å; F66-D244 HydrophobicContact CZ-CB 4.04Å; G240-D244 WeakPolarHBondContact O-CB 3.22Å; G240-D244 VanDerWaalsContact O-CG 3.26Å; G240-D244 PolarHBondContact O-N 3.07Å; D244-C247 PolarHBondContact O-N 2.59Å; D244-L248 PolarHBondContact O-N 3.47Å
245	F	95.9	Very high	94.4	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-67.6	-41.9	175.9	-174.1	-109.4	0	0	0	112	V63 F66 V131 F134 Y135 L241 H242 C243 C247 L248 L249	V63-F245 HydrophobicContact CG1-CE2 3.9Å; V63-F245 HydrophobicContact CG1-CZ 4.08Å; F66-F245 HydrophobicContact CB-CD2 3.67Å; F66-F245 HydrophobicContact CB-CE2 4.04Å; F66-F245 HydrophobicContact CD1-CB 3.89Å; F66-F245 AromaticContact CD1-CD2 3.82Å; F66-F245 HydrophobicContact CD1-CD2 3.82Å; F66-F245 HydrophobicContact CD1-CG 4.35Å; F66-F245 HydrophobicContact CE1-CB 4.2Å; F66-F245 AromaticContact CG-CD2 3.83Å; F66-F245 HydrophobicContact CG-CD2 3.83Å; V131-F245 HydrophobicContact CB-CZ 4.35Å; V131-F245 HydrophobicContact CG1-CE1 4.01Å; V131-F245 HydrophobicContact CG1-CZ 3.86Å; V131-F245 HydrophobicContact CG2-CZ 4.4Å; F134-F245 HydrophobicContact CB-CE1 3.92Å; F134-F245 HydrophobicContact CB-CE2 3.89Å; F134-F245 HydrophobicContact CB-CZ 3.53Å; F134-F245 HydrophobicContact CD1-CB 4.29Å; F134-F245 AromaticContact CD1-CD1 3.16Å; F134-F245 HydrophobicContact CD1-CD1 3.16Å; F134-F245 AromaticContact CD1-CD2 3.97Å; F134-F245 HydrophobicContact CD1-CD2 3.97Å; F134-F245 AromaticContact CD1-CE1 3.24Å; F134-F245 HydrophobicContact CD1-CE1 3.24Å; F134-F245 HydrophobicContact CD1-CE2 4.04Å; F134-F245 AromaticContact CD1-CG 3.54Å; F134-F245 HydrophobicContact CD1-CG 3.54Å; F134-F245 AromaticContact CD1-CZ 3.7Å; F134-F245 HydrophobicContact CD1-CZ 3.7Å; F134-F245 AromaticContact CD2-CD2 3.88Å; F134-F245 HydrophobicContact CD2-CD2 3.88Å; F134-F245 AromaticContact CD2-CE2 3.99Å; F134-F245 HydrophobicContact CD2-CE2 3.99Å; F134-F245 HydrophobicContact CD2-CG 4.15Å; F134-F245 HydrophobicContact CD2-CZ 4.35Å; F134-F245 HydrophobicContact CE1-CB 3.61Å; F134-F245 AromaticContact CE1-CD1 3.27Å; F134-F245 HydrophobicContact CE1-CD1 3.27Å; F134-F245 HydrophobicContact CE1-CD2 4.1Å; F134-F245 AromaticContact CE1-CE1 3.89Å; F134-F245 HydrophobicContact CE1-CE1 3.89Å; F134-F245 AromaticContact CE1-CG 3.38Å; F134-F245 HydrophobicContact CE1-CG 3.38Å; F134-F245 HydrophobicContact CE2-CB 4.18Å; F134-F245 HydrophobicContact CE2-CD2 4.02Å; F134-F245 HydrophobicContact CE2-CG 4.03Å; F134-F245 AromaticContact CG-CD1 3.86Å; F134-F245 HydrophobicContact CG-CD1 3.86Å; F134-F245 AromaticContact CG-CD2 3.86Å; F134-F245 HydrophobicContact CG-CD2 3.86Å; F134-F245 AromaticContact CG-CE1 3.68Å; F134-F245 HydrophobicContact CG-CE1 3.68Å; F134-F245 AromaticContact CG-CE2 3.69Å; F134-F245 HydrophobicContact CG-CE2 3.69Å; F134-F245 AromaticContact CG-CG 3.93Å; F134-F245 HydrophobicContact CG-CG 3.93Å; F134-F245 AromaticContact CG-CZ 3.59Å; F134-F245 HydrophobicContact CG-CZ 3.59Å; F134-F245 HydrophobicContact CZ-CB 3.54Å; F134-F245 HydrophobicContact CZ-CD1 4.04Å; F134-F245 HydrophobicContact CZ-CD2 4.11Å; F134-F245 AromaticContact CZ-CG 3.64Å; F134-F245 HydrophobicContact CZ-CG 3.64Å; Y135-F245 HydrophobicContact CD1-CE1 4.08Å; Y135-F245 HydrophobicContact CE1-CD1 4.06Å; Y135-F245 AromaticContact CE1-CE1 3.72Å; Y135-F245 HydrophobicContact CE1-CE1 3.72Å; L241-F245 VanDerWaalsContact O-CB 3.3Å; L241-F245 WeakPolarHBondContact O-CB 3.46Å; L241-F245 PolarHBondContact O-N 3.29Å; H242-F245 WeakPolarHBondContact O-CB 3.26Å; H242-F245 PolarHBondContact O-N 3.13Å; C243-F245 VanDerWaalsContact C-N 3.26Å; C243-F245 PolarHBondContact O-N 3.14Å; F245-C247 VanDerWaalsContact C-N 3.29Å; F245-C247 PolarHBondContact O-N 3.04Å; F245-L248 HydrophobicContact CD2-CD2 4.31Å; F245-L248 HydrophobicContact CE2-CD2 4.43Å; F245-L248 WeakPolarHBondContact O-CB 3.04Å; F245-L248 PolarHBondContact O-N 2.83Å; F245-L248 VanDerWaalsContact O-N 3.11Å; F245-L249 HydrophobicContact CD1-CD1 4.06Å; F245-L249 HydrophobicContact CD1-CG 4.26Å; F245-L249 HydrophobicContact CE1-CD1 3.59Å; F245-L249 HydrophobicContact CE1-CD2 4.23Å; F245-L249 HydrophobicContact CE1-CG 3.91Å; F245-L249 HydrophobicContact CE2-CD2 4.42Å; F245-L249 HydrophobicContact CZ-CD1 4.16Å; F245-L249 HydrophobicContact CZ-CD2 3.93Å; F245-L249 HydrophobicContact CZ-CG 4.08Å; F245-L249 WeakPolarHBondContact O-CG 3.27Å; F245-L249 PolarHBondContact O-N 2.93Å
246	A	96.3	Very high	94.5	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-59.8	-41.7	173.3	0	0	0	0	0	111.2	L198 F201 A202 H242 C243 L248 L249 F250	L198-A246 HydrophobicContact CD1-CB 3.96Å; F201-A246 HydrophobicContact CD1-CB 4.38Å; A202-A246 HydrophobicContact CB-CB 3.83Å; H242-A246 PolarHBondContact O-N 3.41Å; C243-A246 WeakPolarHBondContact O-CB 3.39Å; C243-A246 PolarHBondContact O-N 3.41Å; C243-A246 VanDerWaalsContact O-N 3.14Å; A246-L248 PolarHBondContact O-N 3.37Å; A246-L249 PolarHBondContact O-N 3.19Å; A246-F250 WeakPolarHBondContact O-CB 3.27Å; A246-F250 PolarHBondContact O-N 3.2Å
247	C	95.6	Very high	94.6	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-39.1	172.9	-65.6	0	0	0	0	112.6	C243 D244 F245 F250 K251 L304 E307 L308	C243-C247 PolarHBondContact O-N 3.16Å; C243-C247 PolarHBondContact O-SG 3.43Å; D244-C247 PolarHBondContact O-N 2.59Å; F245-C247 VanDerWaalsContact C-N 3.29Å; F245-C247 PolarHBondContact O-N 3.04Å; C247-F250 WeakPolarHBondContact O-CB 3.46Å; C247-F250 PolarHBondContact O-N 2.76Å; C247-K251 WeakPolarHBondContact O-CG 2.99Å; C247-K251 PolarHBondContact O-N 2.9Å; C247-L304 VanDerWaalsContact SG-CD1 3.55Å; C247-E307 HydrophobicContact CB-CB 4.11Å; C247-L308 HydrophobicContact CB-CD2 4.49Å
248	L	95.7	Very high	94.9	Very high	19 Å²	19	35.1 Å²	35.1	10%	0.099	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-47.8	174.3	179	68.1	0	0	0	111.5	D62 V63 F66 D244 F245 A246 F250 K251 H252	D62-L248 HydrophobicContact CB-CD1 4.39Å; D62-L248 HydrophobicContact CB-CD2 4.48Å; V63-L248 HydrophobicContact CG2-CD2 4.13Å; F66-L248 HydrophobicContact CD2-CD2 3.54Å; F66-L248 HydrophobicContact CE2-CB 4.49Å; F66-L248 HydrophobicContact CE2-CD2 3.76Å; F66-L248 HydrophobicContact CG-CD2 4.18Å; D244-L248 PolarHBondContact O-N 3.47Å; F245-L248 HydrophobicContact CD2-CD2 4.31Å; F245-L248 HydrophobicContact CE2-CD2 4.43Å; F245-L248 WeakPolarHBondContact O-CB 3.04Å; F245-L248 PolarHBondContact O-N 2.83Å; F245-L248 VanDerWaalsContact O-N 3.11Å; A246-L248 PolarHBondContact O-N 3.37Å; L248-F250 PolarHBondContact O-N 3.27Å; L248-K251 WeakPolarHBondContact O-CB 3.39Å; L248-K251 PolarHBondContact O-N 3.5Å; L248-K251 VanDerWaalsContact O-N 3.1Å; L248-H252 PolarHBondContact O-CD2 3.13Å; L248-H252 PolarHBondContact O-N 3.27Å
249	L	96.8	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-38.6	176.2	-67.1	-174.4	0	0	0	111.2	L45 V131 Y135 L198 F245 A246 K251 H252 I253	L45-L249 HydrophobicContact CD1-CB 4.22Å; L45-L249 HydrophobicContact CD1-CD2 4.42Å; L45-L249 HydrophobicContact CD2-CD2 4.36Å; V131-L249 HydrophobicContact CB-CD2 4.48Å; V131-L249 HydrophobicContact CG1-CD1 3.99Å; V131-L249 HydrophobicContact CG1-CD2 4.01Å; V131-L249 HydrophobicContact CG2-CD2 3.62Å; Y135-L249 HydrophobicContact CE1-CD1 4.4Å; Y135-L249 WeakPolarHBondContact OH-CD1 3.46Å; L198-L249 HydrophobicContact CD2-CB 3.75Å; F245-L249 HydrophobicContact CD1-CD1 4.06Å; F245-L249 HydrophobicContact CD1-CG 4.26Å; F245-L249 HydrophobicContact CE1-CD1 3.59Å; F245-L249 HydrophobicContact CE1-CD2 4.23Å; F245-L249 HydrophobicContact CE1-CG 3.91Å; F245-L249 HydrophobicContact CE2-CD2 4.42Å; F245-L249 HydrophobicContact CZ-CD1 4.16Å; F245-L249 HydrophobicContact CZ-CD2 3.93Å; F245-L249 HydrophobicContact CZ-CG 4.08Å; F245-L249 WeakPolarHBondContact O-CG 3.27Å; F245-L249 PolarHBondContact O-N 2.93Å; A246-L249 PolarHBondContact O-N 3.19Å; L249-K251 VanDerWaalsContact C-N 3.27Å; L249-K251 PolarHBondContact O-N 2.94Å; L249-H252 WeakPolarHBondContact O-CB 3.07Å; L249-H252 PolarHBondContact O-N 3.2Å; L249-I253 PolarHBondContact O-N 3.43Å
250	F	96.8	Very high	95.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-32.1	176.7	-168.8	-94.4	0	0	0	112.7	A195 L198 V199 A246 C247 L248 H252 I253 K256 P257 L308 Y310	A195-F250 HydrophobicContact CB-CE2 4.24Å; L198-F250 HydrophobicContact CD2-CB 3.92Å; L198-F250 HydrophobicContact CD2-CD2 4.31Å; V199-F250 HydrophobicContact CG2-CD2 3.86Å; V199-F250 HydrophobicContact CG2-CE2 3.41Å; V199-F250 VanDerWaalsContact CG2-CE2 3.41Å; V199-F250 HydrophobicContact CG2-CZ 4.02Å; A246-F250 WeakPolarHBondContact O-CB 3.27Å; A246-F250 PolarHBondContact O-N 3.2Å; C247-F250 WeakPolarHBondContact O-CB 3.46Å; C247-F250 PolarHBondContact O-N 2.76Å; L248-F250 PolarHBondContact O-N 3.27Å; F250-H252 VanDerWaalsContact C-N 3.26Å; F250-H252 PolarHBondContact O-N 2.81Å; F250-I253 WeakPolarHBondContact O-CB 3.44Å; F250-I253 PolarHBondContact O-N 3.29Å; F250-I253 VanDerWaalsContact O-N 3.15Å; F250-K256 HydrophobicContact CE1-CD 3.95Å; F250-K256 HydrophobicContact CE1-CG 4.16Å; F250-K256 HydrophobicContact CZ-CB 4.27Å; F250-K256 HydrophobicContact CZ-CD 4.42Å; F250-K256 HydrophobicContact CZ-CG 4.18Å; F250-P257 HydrophobicContact CE2-CG 4.01Å; F250-P257 HydrophobicContact CZ-CG 3.99Å; F250-L308 HydrophobicContact CB-CD2 3.85Å; F250-L308 HydrophobicContact CD1-CB 4.24Å; F250-L308 HydrophobicContact CD1-CD2 3.77Å; F250-L308 WeakPolarHBondContact CD1-O 3.47Å; F250-L308 HydrophobicContact CD2-CD2 4.25Å; F250-L308 HydrophobicContact CE1-CB 4.32Å; F250-L308 HydrophobicContact CE1-CD2 4.39Å; F250-L308 VanDerWaalsContact CE1-O 3.29Å; F250-L308 WeakPolarHBondContact CE1-O 3.42Å; F250-L308 HydrophobicContact CG-CD2 3.68Å; F250-Y310 AromaticContact CE1-CE2 3.65Å; F250-Y310 HydrophobicContact CE1-CE2 3.65Å; F250-Y310 AromaticContact CZ-CE2 3.81Å; F250-Y310 HydrophobicContact CZ-CE2 3.81Å
251	K	95.7	Very high	95.4	Very high	109 Å²	109	46.7 Å²	46.7	47%	0.474	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-33.8	173	-70	166.8	-174.5	167.6	0	111.7	C247 L248 L249 I253 E307	C247-K251 WeakPolarHBondContact O-CG 2.99Å; C247-K251 PolarHBondContact O-N 2.9Å; L248-K251 WeakPolarHBondContact O-CB 3.39Å; L248-K251 PolarHBondContact O-N 3.5Å; L248-K251 VanDerWaalsContact O-N 3.1Å; L249-K251 VanDerWaalsContact C-N 3.27Å; L249-K251 PolarHBondContact O-N 2.94Å; K251-I253 VanDerWaalsContact C-N 3.32Å; K251-E307 WeakPolarHBondContact CE-O 3.45Å; K251-E307 IonicContact NZ-OE2 3.91Å; K251-E307 PolarHBondContact NZ-OE2 2.79Å
252	H	95.5	Very high	95.7	Very high	50 Å²	50	45.7 Å²	45.7	23%	0.231	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.6	175.7	-74.9	-75.3	0	0	0	114.5	L45 Y60 D62 L248 L249 F250	L45-H252 HydrophobicContact CD1-CB 4.37Å; L45-H252 HydrophobicContact CD2-CB 3.86Å; L45-H252 HydrophobicContact CG-CB 4.27Å; Y60-H252 AromaticContact CD1-CE1 3.76Å; Y60-H252 AromaticContact CE1-CE1 3.83Å; Y60-H252 AromaticContact CE1-ND1 3.79Å; D62-H252 IonicContact OD1-NE2 3.57Å; D62-H252 IonicContact OD2-CD2 2.77Å; D62-H252 IonicContact OD2-CE1 3.87Å; D62-H252 PolarHBondContact OD2-CE1 3.39Å; D62-H252 IonicContact OD2-NE2 3.05Å; D62-H252 PolarHBondContact OD2-NE2 2.97Å; L248-H252 PolarHBondContact O-CD2 3.13Å; L248-H252 PolarHBondContact O-N 3.27Å; L249-H252 WeakPolarHBondContact O-CB 3.07Å; L249-H252 PolarHBondContact O-N 3.2Å; F250-H252 VanDerWaalsContact C-N 3.26Å; F250-H252 PolarHBondContact O-N 2.81Å
253	I	95.9	Very high	95.8	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	23%	0.225	C	C	.	.			trans	-72.7	130	174.9	-64	-62.2	0	0	0	110.7	E43 L45 F194 A195 L249 F250 K251 K256	E43-I253 HydrophobicContact CG-CD1 4.37Å; E43-I253 WeakPolarHBondContact OE2-CA 3.46Å; L45-I253 HydrophobicContact CD1-CD1 3.77Å; L45-I253 HydrophobicContact CD1-CG1 4.44Å; F194-I253 HydrophobicContact CD1-CD1 3.72Å; F194-I253 HydrophobicContact CE1-CD1 3.97Å; A195-I253 HydrophobicContact CB-CG1 4.4Å; A195-I253 HydrophobicContact CB-CG2 3.78Å; L249-I253 PolarHBondContact O-N 3.43Å; F250-I253 WeakPolarHBondContact O-CB 3.44Å; F250-I253 PolarHBondContact O-N 3.29Å; F250-I253 VanDerWaalsContact O-N 3.15Å; K251-I253 VanDerWaalsContact C-N 3.32Å; I253-K256 HydrophobicContact CG2-CG 4.35Å; I253-K256 PolarHBondContact O-NZ 2.88Å
254	I	94.8	Very high	95.9	Very high	101 Å²	101	49.2 Å²	49.2	52%	0.518	24%	0.239	S	C	.	.	S	Bend	trans	-80.2	-57.3	177.2	-59.4	-177.2	0	0	0	109.9	L42 E43 P44 K256	L42-I254 HydrophobicContact CD1-CG2 4.26Å; L42-I254 WeakPolarHBondContact O-CD1 3.22Å; E43-I254 PolarHBondContact OE2-N 2.94Å; P44-I254 HydrophobicContact CG-CD1 3.96Å; P44-I254 HydrophobicContact CG-CG1 4.34Å; I254-K256 PolarHBondContact O-N 3.28Å; I254-K256 VanDerWaalsContact O-N 3.15Å
255	K	94.1	Very high	96.1	Very high	135 Å²	135	45.9 Å²	45.9	59%	0.587	22%	0.221	S	C	*	.	S	Bend	trans	-88.7	83.3	-178.9	-171.4	-177	177.2	-172.2	0	110.3	L42 E43	L42-K255 HydrophobicContact CD2-CB 3.6Å; L42-K255 HydrophobicContact CD2-CD 4.01Å; L42-K255 HydrophobicContact CD2-CG 4.36Å; E43-K255 WeakPolarHBondContact OE1-CB 3.15Å; E43-K255 PolarHBondContact OE1-N 3.38Å
256	K	95.4	Very high	96.2	Very high	94 Å²	94	45.9 Å²	45.9	41%	0.409	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-69.5	141.6	176.4	-64.4	-176.4	169.2	64.8	0	111.2	F250 I253 I254	F250-K256 HydrophobicContact CE1-CD 3.95Å; F250-K256 HydrophobicContact CE1-CG 4.16Å; F250-K256 HydrophobicContact CZ-CB 4.27Å; F250-K256 HydrophobicContact CZ-CD 4.42Å; F250-K256 HydrophobicContact CZ-CG 4.18Å; I253-K256 HydrophobicContact CG2-CG 4.35Å; I253-K256 PolarHBondContact O-NZ 2.88Å; I254-K256 PolarHBondContact O-N 3.28Å; I254-K256 VanDerWaalsContact O-N 3.15Å
257	P	95.1	Very high	96.3	Very high	10 Å²	10	51 Å²	51	7%	0.065	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-59.9	152.5	171.4	22.8	-32.7	0	0	0	111.7	A195 E196 F250 R261 V262 Y310	A195-P257 HydrophobicContact CB-CG 4.49Å; E196-P257 HydrophobicContact CG-CB 3.89Å; E196-P257 HydrophobicContact CG-CG 4.36Å; F250-P257 HydrophobicContact CE2-CG 4.01Å; F250-P257 HydrophobicContact CZ-CG 3.99Å; P257-R261 HydrophobicContact CB-CG 4.47Å; P257-V262 HydrophobicContact CB-CG2 4Å; P257-V262 HydrophobicContact CG-CG2 3.49Å; P257-V262 VanDerWaalsContact CG-CG2 3.49Å; P257-Y310 PolarHBondContact O-OH 3.1Å
258	P	95.8	Very high	96.3	Very high	81 Å²	81	54.3 Å²	54.3	53%	0.526	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-62.9	151.6	175.7	27.8	-33.5	0	0	0	110.7	E260 R261 V262	P258-E260 PolarHBondContact O-N 3.45Å; P258-R261 HydrophobicContact CG-CB 3.81Å; P258-R261 WeakPolarHBondContact O-CB 3.47Å; P258-R261 PolarHBondContact O-N 3.38Å; P258-V262 PolarHBondContact O-N 2.9Å
259	K	96	Very high	96.4	Very high	69 Å²	69	53.4 Å²	53.4	30%	0.3	25%	0.25	S	S	.	.	H	α-helix	trans	-52.3	-45.4	-176.9	177.6	175.2	172.7	-178.7	0	111.3	R261 V262 E263 Y310 E311	K259-R261 PolarHBondContact O-N 3.5Å; K259-V262 PolarHBondContact O-N 3.31Å; K259-E263 WeakPolarHBondContact CE-OE1 3.32Å; K259-E263 HydrophobicContact CG-CG 4.18Å; K259-E263 IonicContact NZ-OE1 2.91Å; K259-E263 WeakPolarHBondContact O-CB 3.45Å; K259-E263 VanDerWaalsContact O-CG 3.31Å; K259-E263 WeakPolarHBondContact O-CG 3.41Å; K259-E263 PolarHBondContact O-N 3.39Å; K259-Y310 HydrophobicContact CB-CD1 4.04Å; K259-Y310 HydrophobicContact CB-CE1 4.15Å; K259-Y310 HydrophobicContact CG-CD1 4.08Å; K259-E311 IonicContact NZ-OE2 2.7Å; K259-E311 PolarHBondContact NZ-OE2 3.04Å
260	E	96.9	Very high	96.4	Very high	133 Å²	133	53.4 Å²	53.4	62%	0.621	25%	0.25	S	S	*	.	H	α-helix	trans	-60.6	-33.8	-178.3	-59.8	72.9	-159.5	0	0	112.1	P258 S264	P258-E260 PolarHBondContact O-N 3.45Å; E260-S264 WeakPolarHBondContact O-CB 3.49Å; E260-S264 PolarHBondContact O-N 3.28Å
261	R	96.6	Very high	96.3	Very high	74 Å²	74	58 Å²	58	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-73.6	-46	178.4	-178.9	55.8	171	152.5	0.5	111.3	W186 E196 P257 P258 K259 E263 S264 I265	W186-R261 VanDerWaalsContact CH2-NH2 3.32Å; E196-R261 HydrophobicContact CG-CG 4.15Å; E196-R261 VanDerWaalsContact OE1-CG 3.26Å; E196-R261 WeakPolarHBondContact OE1-CG 3.31Å; E196-R261 IonicContact OE1-CZ 3.07Å; E196-R261 IonicContact OE1-NE 2.59Å; E196-R261 PolarHBondContact OE1-NE 3.11Å; E196-R261 IonicContact OE1-NH2 3.97Å; P257-R261 HydrophobicContact CB-CG 4.47Å; P258-R261 HydrophobicContact CG-CB 3.81Å; P258-R261 WeakPolarHBondContact O-CB 3.47Å; P258-R261 PolarHBondContact O-N 3.38Å; K259-R261 PolarHBondContact O-N 3.5Å; R261-E263 VanDerWaalsContact C-N 3.33Å; R261-S264 WeakPolarHBondContact O-CB 3.49Å; R261-S264 PolarHBondContact O-N 2.95Å; R261-I265 HydrophobicContact CG-CD1 4.38Å; R261-I265 WeakPolarHBondContact O-CG1 2.97Å; R261-I265 PolarHBondContact O-N 3.01Å; R261-I265 VanDerWaalsContact O-N 3.15Å
262	V	97.4	Very high	96.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-47.3	175.7	175.4	0	0	0	0	110.3	V199 P257 P258 K259 S264 I265 I266 L305 L308 Y310	V199-V262 HydrophobicContact CG1-CG1 3.98Å; V199-V262 HydrophobicContact CG2-CG2 4.27Å; P257-V262 HydrophobicContact CB-CG2 4Å; P257-V262 HydrophobicContact CG-CG2 3.49Å; P257-V262 VanDerWaalsContact CG-CG2 3.49Å; P258-V262 PolarHBondContact O-N 2.9Å; K259-V262 PolarHBondContact O-N 3.31Å; V262-S264 VanDerWaalsContact C-N 3.31Å; V262-S264 PolarHBondContact O-N 3.24Å; V262-I265 PolarHBondContact O-N 3.48Å; V262-I266 HydrophobicContact CG1-CG1 4.39Å; V262-I266 WeakPolarHBondContact O-CG1 3.45Å; V262-I266 PolarHBondContact O-N 3.49Å; V262-L305 HydrophobicContact CG1-CD2 3.85Å; V262-L308 HydrophobicContact CG1-CD1 4.39Å; V262-Y310 HydrophobicContact CB-CE1 4.46Å; V262-Y310 HydrophobicContact CB-CE2 4.26Å; V262-Y310 HydrophobicContact CG1-CD2 3.96Å; V262-Y310 HydrophobicContact CG1-CE2 3.99Å; V262-Y310 HydrophobicContact CG1-CG 4.4Å; V262-Y310 HydrophobicContact CG2-CE1 4.16Å; V262-Y310 HydrophobicContact CG2-CE2 3.79Å
263	E	97.3	Very high	96.3	Very high	38 Å²	38	51.3 Å²	51.3	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-41.2	176.1	-76.2	-170.3	175.1	0	0	112.5	K259 R261 R267 M313	K259-E263 WeakPolarHBondContact CE-OE1 3.32Å; K259-E263 HydrophobicContact CG-CG 4.18Å; K259-E263 IonicContact NZ-OE1 2.91Å; K259-E263 WeakPolarHBondContact O-CB 3.45Å; K259-E263 VanDerWaalsContact O-CG 3.31Å; K259-E263 WeakPolarHBondContact O-CG 3.41Å; K259-E263 PolarHBondContact O-N 3.39Å; R261-E263 VanDerWaalsContact C-N 3.33Å; E263-R267 WeakPolarHBondContact O-CB 3.43Å; E263-R267 PolarHBondContact O-N 3.42Å; E263-M313 HydrophobicContact CB-CE 3.33Å; E263-M313 HydrophobicContact CG-CE 3.42Å; E263-M313 VanDerWaalsContact CG-CE 3.42Å; E263-M313 WeakPolarHBondContact O-CE 3.43Å
264	S	97.5	Very high	96.3	Very high	45 Å²	45	52.5 Å²	52.5	32%	0.315	25%	0.251	S	S	.	.	H	α-helix	trans	-59.2	-48.4	175.4	-166.6	0	0	0	0	111.6	E260 R261 V262 I266 R267 E268	E260-S264 WeakPolarHBondContact O-CB 3.49Å; E260-S264 PolarHBondContact O-N 3.28Å; R261-S264 WeakPolarHBondContact O-CB 3.49Å; R261-S264 PolarHBondContact O-N 2.95Å; V262-S264 VanDerWaalsContact C-N 3.31Å; V262-S264 PolarHBondContact O-N 3.24Å; S264-I266 PolarHBondContact O-N 3.31Å; S264-R267 PolarHBondContact O-N 3.22Å; S264-E268 WeakPolarHBondContact O-CB 3.31Å; S264-E268 VanDerWaalsContact O-CG 3.27Å; S264-E268 WeakPolarHBondContact O-CG 3.41Å; S264-E268 PolarHBondContact O-N 3.36Å; S264-E268 PolarHBondContact OG-OE1 2.72Å
265	I	97.5	Very high	96.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-48.9	-178	-61.5	168.8	0	0	0	110.3	W182 W186 E196 V199 A200 R261 V262 E268 A269	W182-I265 HydrophobicContact CH2-CG2 4.08Å; W182-I265 HydrophobicContact CZ2-CG2 3.94Å; W186-I265 HydrophobicContact CH2-CD1 3.58Å; W186-I265 HydrophobicContact CH2-CG1 3.72Å; W186-I265 HydrophobicContact CZ2-CB 4.44Å; W186-I265 HydrophobicContact CZ2-CD1 4.04Å; W186-I265 HydrophobicContact CZ2-CG1 3.71Å; W186-I265 HydrophobicContact CZ2-CG2 4.03Å; W186-I265 HydrophobicContact CZ3-CD1 4.45Å; E196-I265 HydrophobicContact CB-CD1 4.37Å; V199-I265 HydrophobicContact CB-CD1 4.42Å; V199-I265 HydrophobicContact CG1-CB 4.25Å; V199-I265 HydrophobicContact CG1-CD1 4.18Å; V199-I265 HydrophobicContact CG1-CG2 4.06Å; A200-I265 HydrophobicContact CB-CG2 3.92Å; R261-I265 HydrophobicContact CG-CD1 4.38Å; R261-I265 WeakPolarHBondContact O-CG1 2.97Å; R261-I265 PolarHBondContact O-N 3.01Å; R261-I265 VanDerWaalsContact O-N 3.15Å; V262-I265 PolarHBondContact O-N 3.48Å; I265-E268 PolarHBondContact O-N 3.32Å; I265-A269 PolarHBondContact O-N 2.93Å; I265-A269 VanDerWaalsContact O-N 3.14Å
266	I	97.5	Very high	96.2	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-42.4	-180	-61.1	-50.8	0	0	0	111.1	V199 A203 V262 S264 E268 A269 V270 A301 L304 L305	V199-I266 HydrophobicContact CG1-CD1 4.04Å; V199-I266 HydrophobicContact CG1-CG1 4.43Å; A203-I266 HydrophobicContact CB-CD1 3.81Å; V262-I266 HydrophobicContact CG1-CG1 4.39Å; V262-I266 WeakPolarHBondContact O-CG1 3.45Å; V262-I266 PolarHBondContact O-N 3.49Å; S264-I266 PolarHBondContact O-N 3.31Å; I266-E268 VanDerWaalsContact C-N 3.35Å; I266-E268 PolarHBondContact O-N 3.41Å; I266-A269 PolarHBondContact O-N 2.98Å; I266-V270 HydrophobicContact CG2-CG2 4.31Å; I266-V270 VanDerWaalsContact O-CG2 3.31Å; I266-V270 WeakPolarHBondContact O-CG2 3.49Å; I266-V270 PolarHBondContact O-N 2.94Å; I266-A301 HydrophobicContact CG2-CB 3.76Å; I266-L304 HydrophobicContact CD1-CD2 3.69Å; I266-L304 HydrophobicContact CD1-CG 4.31Å; I266-L305 HydrophobicContact CB-CD2 4.34Å; I266-L305 HydrophobicContact CG1-CD2 3.86Å; I266-L305 HydrophobicContact CG1-CG 4.37Å; I266-L305 HydrophobicContact CG2-CD1 4.42Å; I266-L305 HydrophobicContact CG2-CG 4.29Å
267	R	97.8	Very high	96.1	Very high	111 Å²	111	40.6 Å²	40.6	42%	0.419	20%	0.196	S	C	.	.	H	α-helix	trans	-62.1	-42.3	178.7	-176.7	-173.9	-60.4	-86.1	1.8	111.8	E263 S264 A269 V270 L271 M313	E263-R267 WeakPolarHBondContact O-CB 3.43Å; E263-R267 PolarHBondContact O-N 3.42Å; S264-R267 PolarHBondContact O-N 3.22Å; R267-A269 VanDerWaalsContact C-N 3.35Å; R267-V270 PolarHBondContact O-N 3.33Å; R267-L271 HydrophobicContact CG-CD1 4.24Å; R267-L271 VanDerWaalsContact O-CG 3.31Å; R267-L271 WeakPolarHBondContact O-CG 3.43Å; R267-L271 PolarHBondContact O-N 3.2Å; R267-M313 HydrophobicContact CB-CE 4.37Å; R267-M313 HydrophobicContact CB-SD 4.24Å; R267-M313 PolarHBondContact NH2-SD 3.36Å
268	E	97	Very high	95.9	Very high	70 Å²	70	41.8 Å²	41.8	33%	0.327	21%	0.205	S	C	.	.	H	α-helix	trans	-59.4	-46.8	175	-74.5	166.9	-143.4	0	0	111	W182 S264 I265 I266 V270 L271 I272	W182-E268 PolarHBondContact NE1-OE2 3.08Å; S264-E268 WeakPolarHBondContact O-CB 3.31Å; S264-E268 VanDerWaalsContact O-CG 3.27Å; S264-E268 WeakPolarHBondContact O-CG 3.41Å; S264-E268 PolarHBondContact O-N 3.36Å; S264-E268 PolarHBondContact OG-OE1 2.72Å; I265-E268 PolarHBondContact O-N 3.32Å; I266-E268 VanDerWaalsContact C-N 3.35Å; I266-E268 PolarHBondContact O-N 3.41Å; E268-V270 PolarHBondContact O-N 3.04Å; E268-L271 PolarHBondContact O-N 2.82Å; E268-I272 VanDerWaalsContact O-CG1 3.29Å; E268-I272 WeakPolarHBondContact O-CG1 3.35Å; E268-I272 PolarHBondContact O-N 3.21Å; E268-I272 VanDerWaalsContact O-N 3.09Å
269	A	96.4	Very high	95.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-44	177	0	0	0	0	0	112.2	W182 A203 F208 I265 I266 R267 L271 I272 E273	W182-A269 HydrophobicContact CH2-CB 4.36Å; W182-A269 HydrophobicContact CZ2-CB 4.32Å; A203-A269 HydrophobicContact CB-CB 4.02Å; F208-A269 HydrophobicContact CD1-CB 4.38Å; F208-A269 HydrophobicContact CE1-CB 3.75Å; F208-A269 WeakPolarHBondContact CE1-O 3.45Å; F208-A269 HydrophobicContact CZ-CB 4.25Å; I265-A269 PolarHBondContact O-N 2.93Å; I265-A269 VanDerWaalsContact O-N 3.14Å; I266-A269 PolarHBondContact O-N 2.98Å; R267-A269 VanDerWaalsContact C-N 3.35Å; A269-L271 PolarHBondContact O-N 3.14Å; A269-I272 PolarHBondContact O-N 3.36Å; A269-E273 WeakPolarHBondContact O-CB 3.39Å; A269-E273 PolarHBondContact O-N 3.35Å
270	V	97	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-47.2	176.9	169.8	0	0	0	0	111.7	V207 I266 R267 E268 I272 E273 Q274 I297 E298 A301 Y314	V207-V270 HydrophobicContact CG1-CG2 4.38Å; I266-V270 HydrophobicContact CG2-CG2 4.31Å; I266-V270 VanDerWaalsContact O-CG2 3.31Å; I266-V270 WeakPolarHBondContact O-CG2 3.49Å; I266-V270 PolarHBondContact O-N 2.94Å; R267-V270 PolarHBondContact O-N 3.33Å; E268-V270 PolarHBondContact O-N 3.04Å; V270-I272 VanDerWaalsContact C-N 3.34Å; V270-I272 PolarHBondContact O-N 2.94Å; V270-E273 PolarHBondContact O-N 3.14Å; V270-Q274 HydrophobicContact CG1-CG 4.15Å; V270-Q274 WeakPolarHBondContact O-CB 3.42Å; V270-Q274 VanDerWaalsContact O-CG 3.26Å; V270-Q274 WeakPolarHBondContact O-CG 3.13Å; V270-Q274 PolarHBondContact O-N 3.36Å; V270-I297 HydrophobicContact CB-CG2 4.34Å; V270-I297 HydrophobicContact CG1-CG2 4.02Å; V270-I297 HydrophobicContact CG2-CG2 4.23Å; V270-E298 HydrophobicContact CG1-CG 4.32Å; V270-A301 HydrophobicContact CG2-CB 3.31Å; V270-Y314 HydrophobicContact CG1-CE2 4.42Å; V270-Y314 HydrophobicContact CG2-CE2 4.11Å
271	L	96.3	Very high	94.7	Very high	96 Å²	96	37.3 Å²	37.3	50%	0.503	19%	0.186	S	C	.	.	H	α-helix	trans	-62.8	-42.5	-179	-71.8	173	0	0	0	111.7	R267 E268 A269 E273 Q274 E275	R267-L271 HydrophobicContact CG-CD1 4.24Å; R267-L271 VanDerWaalsContact O-CG 3.31Å; R267-L271 WeakPolarHBondContact O-CG 3.43Å; R267-L271 PolarHBondContact O-N 3.2Å; E268-L271 PolarHBondContact O-N 2.82Å; A269-L271 PolarHBondContact O-N 3.14Å; L271-E273 VanDerWaalsContact C-N 3.34Å; L271-Q274 PolarHBondContact O-N 3.31Å; L271-E275 WeakPolarHBondContact O-CB 3.46Å; L271-E275 PolarHBondContact O-N 2.85Å
272	I	95.1	Very high	94.5	Very high	18 Å²	18	35.2 Å²	35.2	9%	0.092	18%	0.182	C	C	.	.	H	α-helix	trans	-62.3	-43.4	176.6	-67.4	167.7	0	0	0	110.5	K179 W182 F208 E268 A269 V270 F276	K179-I272 HydrophobicContact CB-CG2 4.43Å; K179-I272 HydrophobicContact CD-CG2 4.43Å; K179-I272 HydrophobicContact CG-CG2 3.37Å; W182-I272 HydrophobicContact CB-CD1 4.03Å; W182-I272 HydrophobicContact CG-CD1 3.79Å; F208-I272 HydrophobicContact CE1-CB 4.17Å; F208-I272 HydrophobicContact CE1-CG2 4.11Å; F208-I272 HydrophobicContact CZ-CD1 4.36Å; F208-I272 HydrophobicContact CZ-CG2 4.29Å; E268-I272 VanDerWaalsContact O-CG1 3.29Å; E268-I272 WeakPolarHBondContact O-CG1 3.35Å; E268-I272 PolarHBondContact O-N 3.21Å; E268-I272 VanDerWaalsContact O-N 3.09Å; A269-I272 PolarHBondContact O-N 3.36Å; V270-I272 VanDerWaalsContact C-N 3.34Å; V270-I272 PolarHBondContact O-N 2.94Å; I272-F276 WeakPolarHBondContact O-CB 3.46Å; I272-F276 PolarHBondContact O-N 3.27Å
273	E	95.2	Very high	94.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-42.1	-179.8	-168.4	59.1	-144	0	0	112.5	K179 V207 F208 A269 V270 L271 F276 L277 I297	K179-E273 WeakPolarHBondContact CE-OE2 3.43Å; K179-E273 IonicContact NZ-OE1 3.67Å; K179-E273 PolarHBondContact NZ-OE1 2.99Å; K179-E273 VanDerWaalsContact NZ-OE1 3.07Å; K179-E273 IonicContact NZ-OE2 3.29Å; K179-E273 PolarHBondContact NZ-OE2 3Å; V207-E273 HydrophobicContact CG1-CB 4.43Å; F208-E273 WeakPolarHBondContact CA-OE2 3.36Å; A269-E273 WeakPolarHBondContact O-CB 3.39Å; A269-E273 PolarHBondContact O-N 3.35Å; V270-E273 PolarHBondContact O-N 3.14Å; L271-E273 VanDerWaalsContact C-N 3.34Å; E273-F276 WeakPolarHBondContact O-CB 3.48Å; E273-F276 PolarHBondContact O-N 2.9Å; E273-L277 HydrophobicContact CG-CD1 4.34Å; E273-L277 PolarHBondContact O-N 3.42Å; E273-L277 WeakPolarHBondContact OE1-CD1 3.42Å; E273-I297 HydrophobicContact CB-CG2 3.95Å; E273-I297 HydrophobicContact CG-CD1 3.7Å; E273-I297 HydrophobicContact CG-CG1 3.91Å; E273-I297 HydrophobicContact CG-CG2 4.01Å
274	Q	95	Very high	94	Very high	27 Å²	27	36.8 Å²	36.8	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-47.1	176.1	-74.5	-178.1	-18.7	0	0	111.2	V270 L271 F276 L277 S278 C294 I297 E298	V270-Q274 HydrophobicContact CG1-CG 4.15Å; V270-Q274 WeakPolarHBondContact O-CB 3.42Å; V270-Q274 VanDerWaalsContact O-CG 3.26Å; V270-Q274 WeakPolarHBondContact O-CG 3.13Å; V270-Q274 PolarHBondContact O-N 3.36Å; L271-Q274 PolarHBondContact O-N 3.31Å; Q274-F276 VanDerWaalsContact C-N 3.31Å; Q274-F276 PolarHBondContact O-N 2.55Å; Q274-L277 PolarHBondContact O-N 2.91Å; Q274-S278 WeakPolarHBondContact O-CB 3.31Å; Q274-S278 PolarHBondContact O-N 3.46Å; Q274-S278 PolarHBondContact O-OG 3.35Å; Q274-C294 HydrophobicContact CG-CB 3.97Å; Q274-C294 PolarHBondContact NE2-O 3.04Å; Q274-C294 VanDerWaalsContact NE2-O 3.13Å; Q274-I297 HydrophobicContact CG-CB 4.3Å; Q274-I297 HydrophobicContact CG-CG2 4.35Å; Q274-E298 PolarHBondContact NE2-OE1 3.45Å; Q274-E298 VanDerWaalsContact NE2-OE1 3.08Å
275	E	93.6	Very high	93.7	Very high	73 Å²	73	37.8 Å²	37.8	34%	0.341	20%	0.198	S	C	.	.	H	α-helix	trans	-60.1	-41.6	175.7	-177.1	-176.8	153.7	0	0	111.3	K178 L271 L277 E279 A280	K178-E275 VanDerWaalsContact NZ-CD 3.26Å; K178-E275 IonicContact NZ-OE1 2.93Å; K178-E275 PolarHBondContact NZ-OE1 3.01Å; K178-E275 VanDerWaalsContact NZ-OE1 3.13Å; K178-E275 IonicContact NZ-OE2 3.92Å; K178-E275 PolarHBondContact NZ-OE2 2.8Å; L271-E275 WeakPolarHBondContact O-CB 3.46Å; L271-E275 PolarHBondContact O-N 2.85Å; E275-L277 PolarHBondContact O-N 3.31Å; E275-E279 WeakPolarHBondContact O-CB 3.44Å; E275-E279 PolarHBondContact O-N 3.36Å; E275-A280 PolarHBondContact O-N 2.86Å; E275-A280 VanDerWaalsContact O-N 3.09Å
276	F	92.9	Very high	93.4	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.022	20%	0.199	C	C	.	.	I	π-helix	trans	-59.6	-48	178.1	-178.5	-103	0	0	0	112.3	F106 C175 V176 K179 I272 E273 Q274 L281	F106-F276 HydrophobicContact CB-CZ 4.23Å; F106-F276 HydrophobicContact CG-CZ 4.16Å; C175-F276 HydrophobicContact CB-CD2 3.98Å; C175-F276 HydrophobicContact CB-CE2 4.41Å; V176-F276 HydrophobicContact CG2-CE2 4.27Å; K179-F276 HydrophobicContact CD-CD2 4.27Å; K179-F276 HydrophobicContact CD-CG 4.29Å; K179-F276 VanDerWaalsContact CE-CB 3.48Å; K179-F276 VanDerWaalsContact CE-CG 3.45Å; K179-F276 VanDerWaalsContact NZ-CG 3.31Å; I272-F276 WeakPolarHBondContact O-CB 3.46Å; I272-F276 PolarHBondContact O-N 3.27Å; E273-F276 WeakPolarHBondContact O-CB 3.48Å; E273-F276 PolarHBondContact O-N 2.9Å; Q274-F276 VanDerWaalsContact C-N 3.31Å; Q274-F276 PolarHBondContact O-N 2.55Å; F276-L281 HydrophobicContact CE1-CD2 4.37Å; F276-L281 HydrophobicContact CZ-CB 4.42Å; F276-L281 HydrophobicContact CZ-CD2 4.03Å; F276-L281 CarbonylContact O-C 3.33Å; F276-L281 WeakPolarHBondContact O-CA 3.42Å; F276-L281 PolarHBondContact O-N 3.45Å
277	L	93.4	Very high	93.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.226	C	C	.	.	I	π-helix	trans	-90.7	-9.6	-174	-66.4	174.8	0	0	0	115.1	F99 G211 E273 Q274 E275 P282 V283 M293 I297	F99-L277 HydrophobicContact CZ-CD2 4.4Å; G211-L277 VanDerWaalsContact CA-CD1 3.44Å; E273-L277 HydrophobicContact CG-CD1 4.34Å; E273-L277 PolarHBondContact O-N 3.42Å; E273-L277 WeakPolarHBondContact OE1-CD1 3.42Å; Q274-L277 PolarHBondContact O-N 2.91Å; E275-L277 PolarHBondContact O-N 3.31Å; L277-P282 WeakPolarHBondContact O-CA 3.4Å; L277-V283 HydrophobicContact CB-CG1 3.93Å; L277-V283 HydrophobicContact CD2-CG1 3.83Å; L277-V283 HydrophobicContact CG-CG1 4.33Å; L277-V283 PolarHBondContact O-N 3.16Å; L277-M293 HydrophobicContact CB-CG 3.97Å; L277-M293 HydrophobicContact CD1-CG 3.74Å; L277-M293 HydrophobicContact CD1-SD 3.96Å; L277-M293 HydrophobicContact CG-CG 4.48Å; L277-I297 HydrophobicContact CD1-CD1 4.29Å
278	S	90.9	Very high	92.9	Very high	35 Å²	35	35.6 Å²	35.6	25%	0.245	21%	0.208	C	C	.	.	I	π-helix	trans	-108.6	-31.2	179.1	68.1	0	0	0	0	113.6	Q274	Q274-S278 WeakPolarHBondContact O-CB 3.31Å; Q274-S278 PolarHBondContact O-N 3.46Å; Q274-S278 PolarHBondContact O-OG 3.35Å
279	E	87.6	Confident	92.7	Very high	144 Å²	144	36.4 Å²	36.4	67%	0.673	21%	0.214	S	C	*	.	I	π-helix	trans	-116	-56.1	-175.2	-59.1	-175	-157.4	0	0	112	E275 P282	E275-E279 WeakPolarHBondContact O-CB 3.44Å; E275-E279 PolarHBondContact O-N 3.36Å; E279-P282 WeakPolarHBondContact O-CG 3.42Å
280	A	86.6	Confident	92.6	Very high	45 Å²	45	37.8 Å²	37.8	37%	0.372	22%	0.224	S	C	.	.	I	π-helix	trans	-76.7	-43	-170.1	0	0	0	0	0	113.6	C175 E275	C175-A280 HydrophobicContact CB-CB 3.24Å; E275-A280 PolarHBondContact O-N 2.86Å; E275-A280 VanDerWaalsContact O-N 3.09Å
281	L	90.2	Very high	92.5	Very high	1 Å²	1	46 Å²	46	1%	0.005	26%	0.259	C	S	.	.	S	Bend	trans	-133	74.7	174.6	-167.3	65.8	0	0	0	109	F99 Y102 V103 F276 V283 L285	F99-L281 HydrophobicContact CD2-CD1 4.29Å; F99-L281 HydrophobicContact CD2-CD2 4.12Å; F99-L281 HydrophobicContact CD2-CG 3.69Å; F99-L281 HydrophobicContact CE2-CD2 4.16Å; F99-L281 HydrophobicContact CE2-CG 3.92Å; F99-L281 WeakPolarHBondContact CE2-O 3.47Å; F99-L281 HydrophobicContact CG-CG 4.48Å; Y102-L281 HydrophobicContact CD1-CD1 4.07Å; Y102-L281 HydrophobicContact CG-CD1 4.13Å; V103-L281 HydrophobicContact CG2-CD2 3.69Å; F276-L281 HydrophobicContact CE1-CD2 4.37Å; F276-L281 HydrophobicContact CZ-CB 4.42Å; F276-L281 HydrophobicContact CZ-CD2 4.03Å; F276-L281 CarbonylContact O-C 3.33Å; F276-L281 WeakPolarHBondContact O-CA 3.42Å; F276-L281 PolarHBondContact O-N 3.45Å; L281-V283 PolarHBondContact O-N 3.01Å; L281-L285 HydrophobicContact CD1-CD1 4.41Å
282	P	92.1	Very high	92.4	Very high	30 Å²	30	44.6 Å²	44.6	20%	0.195	25%	0.252	C	S	.	.			trans	-61.8	126.9	-170.3	-24.1	35	0	0	0	112.3	L277 E279 S284 L285	L277-P282 WeakPolarHBondContact O-CA 3.4Å; E279-P282 WeakPolarHBondContact O-CG 3.42Å; P282-S284 WeakPolarHBondContact CB-OG 3.47Å; P282-S284 PolarHBondContact O-N 3.46Å; P282-L285 VanDerWaalsContact O-CB 3.29Å; P282-L285 WeakPolarHBondContact O-CB 3.11Å; P282-L285 VanDerWaalsContact O-CG 3.26Å; P282-L285 WeakPolarHBondContact O-CG 3.31Å; P282-L285 PolarHBondContact O-N 2.84Å
283	V	92.3	Very high	92.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-64.1	-11.2	175.1	-62.3	0	0	0	0	113.2	F99 A215 L277 L281 L285 I286 G287 M288 C290 M293	F99-V283 HydrophobicContact CE2-CB 4.39Å; F99-V283 HydrophobicContact CE2-CG1 3.84Å; F99-V283 HydrophobicContact CZ-CG1 3.92Å; A215-V283 HydrophobicContact CB-CG1 4.46Å; L277-V283 HydrophobicContact CB-CG1 3.93Å; L277-V283 HydrophobicContact CD2-CG1 3.83Å; L277-V283 HydrophobicContact CG-CG1 4.33Å; L277-V283 PolarHBondContact O-N 3.16Å; L281-V283 PolarHBondContact O-N 3.01Å; V283-L285 PolarHBondContact O-N 3Å; V283-I286 WeakPolarHBondContact O-CG1 3.37Å; V283-I286 PolarHBondContact O-N 3.35Å; V283-I286 VanDerWaalsContact O-N 3.16Å; V283-G287 PolarHBondContact O-N 3.14Å; V283-M288 HydrophobicContact CB-CB 3.91Å; V283-M288 HydrophobicContact CG2-CB 3.86Å; V283-M288 PolarHBondContact O-N 3.36Å; V283-C290 HydrophobicContact CG2-CB 4.35Å; V283-M293 HydrophobicContact CG1-CE 3.9Å; V283-M293 HydrophobicContact CG1-CG 4.2Å; V283-M293 HydrophobicContact CG2-CB 3.87Å; V283-M293 HydrophobicContact CG2-CG 4.28Å
284	S	92.2	Very high	92.5	Very high	70 Å²	70	45 Å²	45	49%	0.49	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-60.9	-23.1	169	61.6	0	0	0	0	113	P282 I286 G287 M288	P282-S284 WeakPolarHBondContact CB-OG 3.47Å; P282-S284 PolarHBondContact O-N 3.46Å; S284-I286 PolarHBondContact O-N 2.9Å; S284-G287 PolarHBondContact O-N 3.46Å; S284-M288 VanDerWaalsContact CA-O 3.28Å; S284-M288 WeakPolarHBondContact CA-O 3.29Å; S284-M288 PolarHBondContact N-O 2.98Å
285	L	90.5	Very high	92.6	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.346	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-61.7	-30.5	174.1	-67.9	173.8	0	0	0	113	F99 L281 P282 V283	F99-L285 HydrophobicContact CB-CB 4.26Å; F99-L285 HydrophobicContact CB-CD1 4.45Å; F99-L285 HydrophobicContact CD2-CB 4.42Å; F99-L285 HydrophobicContact CD2-CD1 4.48Å; L281-L285 HydrophobicContact CD1-CD1 4.41Å; P282-L285 VanDerWaalsContact O-CB 3.29Å; P282-L285 WeakPolarHBondContact O-CB 3.11Å; P282-L285 VanDerWaalsContact O-CG 3.26Å; P282-L285 WeakPolarHBondContact O-CG 3.31Å; P282-L285 PolarHBondContact O-N 2.84Å; V283-L285 PolarHBondContact O-N 3Å
286	I	91.9	Very high	92.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-101.1	6.8	175.2	61	167.6	0	0	0	112.9	E96 F99 A215 W218 L219 R222 V283 S284 M288	E96-I286 HydrophobicContact CB-CG2 4.42Å; E96-I286 HydrophobicContact CG-CG2 4.23Å; F99-I286 HydrophobicContact CB-CG2 3.8Å; F99-I286 HydrophobicContact CD1-CD1 4.21Å; F99-I286 HydrophobicContact CD1-CG2 3.6Å; F99-I286 HydrophobicContact CD2-CG2 4.43Å; F99-I286 HydrophobicContact CE1-CD1 3.85Å; F99-I286 HydrophobicContact CE1-CG2 4.34Å; F99-I286 HydrophobicContact CG-CG2 3.67Å; F99-I286 HydrophobicContact CZ-CD1 4.17Å; A215-I286 HydrophobicContact CB-CD1 3.7Å; A215-I286 WeakPolarHBondContact O-CD1 3.15Å; W218-I286 PolarHBondContact NE1-O 3.23Å; L219-I286 HydrophobicContact CD2-CB 4.32Å; L219-I286 HydrophobicContact CD2-CG2 4.28Å; R222-I286 PolarHBondContact NH1-O 3.45Å; V283-I286 WeakPolarHBondContact O-CG1 3.37Å; V283-I286 PolarHBondContact O-N 3.35Å; V283-I286 VanDerWaalsContact O-N 3.16Å; S284-I286 PolarHBondContact O-N 2.9Å; I286-M288 HydrophobicContact CD1-CG 4.07Å; I286-M288 HydrophobicContact CD1-SD 3.72Å; I286-M288 HydrophobicContact CG1-CG 4.11Å; I286-M288 HydrophobicContact CG1-SD 4.37Å
287	G	91.5	Very high	92.8	Very high	55 Å²	55	43.5 Å²	43.5	57%	0.567	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	13.3	177.8	0	0	0	0	0	115.3	V283 S284	V283-G287 PolarHBondContact O-N 3.14Å; S284-G287 PolarHBondContact O-N 3.46Å
288	M	92.3	Very high	93	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.039	26%	0.258	C	S	.	.			trans	-86.5	155.8	172.8	-65.2	-177.9	78.6	0	0	111.5	A215 W218 V283 S284 I286 M293 F320 F322	A215-M288 HydrophobicContact CB-SD 4.3Å; W218-M288 HydrophobicContact CB-CE 4.15Å; W218-M288 HydrophobicContact CB-CG 4Å; W218-M288 HydrophobicContact CB-SD 3.47Å; W218-M288 WeakPolarHBondContact CB-SD 3.17Å; W218-M288 VanDerWaalsContact CD1-CG 3.47Å; W218-M288 HydrophobicContact CD2-CG 3.58Å; W218-M288 HydrophobicContact CD2-SD 4.2Å; W218-M288 HydrophobicContact CE3-CG 4.28Å; W218-M288 HydrophobicContact CG-CE 4.42Å; W218-M288 HydrophobicContact CG-CG 3.42Å; W218-M288 VanDerWaalsContact CG-CG 3.42Å; W218-M288 HydrophobicContact CG-SD 3.62Å; V283-M288 HydrophobicContact CB-CB 3.91Å; V283-M288 HydrophobicContact CG2-CB 3.86Å; V283-M288 PolarHBondContact O-N 3.36Å; S284-M288 VanDerWaalsContact CA-O 3.28Å; S284-M288 WeakPolarHBondContact CA-O 3.29Å; S284-M288 PolarHBondContact N-O 2.98Å; I286-M288 HydrophobicContact CD1-CG 4.07Å; I286-M288 HydrophobicContact CD1-SD 3.72Å; I286-M288 HydrophobicContact CG1-CG 4.11Å; I286-M288 HydrophobicContact CG1-SD 4.37Å; M288-M293 HydrophobicContact CE-CE 3.54Å; M288-M293 HydrophobicContact SD-CE 3.92Å; M288-F320 HydrophobicContact CE-CD1 4.38Å; M288-F320 HydrophobicContact CE-CD2 4.43Å; M288-F320 HydrophobicContact CE-CE1 3.78Å; M288-F320 HydrophobicContact CE-CE2 3.83Å; M288-F320 HydrophobicContact CE-CZ 3.47Å; M288-F320 VanDerWaalsContact CE-CZ 3.47Å; M288-F322 HydrophobicContact CE-CZ 4.08Å
289	N	93.7	Very high	93.2	Very high	87 Å²	87	46.3 Å²	46.3	47%	0.465	26%	0.257	S	S	.	.			trans	-85.1	118.5	175.8	-173.5	-48.4	0	0	0	110.3	K291 L292 M293	N289-K291 VanDerWaalsContact C-N 3.27Å; N289-K291 PolarHBondContact O-N 3.47Å; N289-K291 WeakPolarHBondContact OD1-CA 3.31Å; N289-K291 VanDerWaalsContact OD1-CB 3.3Å; N289-K291 WeakPolarHBondContact OD1-CB 3.04Å; N289-K291 PolarHBondContact OD1-N 2.94Å; N289-L292 HydrophobicContact CB-CB 4.14Å; N289-L292 HydrophobicContact CB-CD1 3.97Å; N289-L292 HydrophobicContact CB-CG 3.93Å; N289-L292 PolarHBondContact O-N 3.37Å; N289-L292 VanDerWaalsContact O-N 3.16Å; N289-L292 PolarHBondContact OD1-N 3.18Å; N289-M293 PolarHBondContact O-N 3.2Å
290	C	94	Very high	93.5	Very high	29 Å²	29	39.6 Å²	39.6	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-58.9	-34.9	179.9	-56.3	0	0	0	0	113.1	V283 M293 C294	V283-C290 HydrophobicContact CG2-CB 4.35Å; C290-M293 WeakPolarHBondContact O-CB 3.23Å; C290-M293 PolarHBondContact O-N 2.79Å; C290-C294 PolarHBondContact O-N 2.97Å; C290-C294 PolarHBondContact O-SG 2.76Å
291	K	94.8	Very high	93.9	Very high	172 Å²	172	37.4 Å²	37.4	75%	0.748	21%	0.208	S	C	*	.	H	α-helix	trans	-66.8	-41.3	177.7	-61.7	-174.7	177.7	-174.7	0	111.9	N289 M293 C294 Q295	N289-K291 VanDerWaalsContact C-N 3.27Å; N289-K291 PolarHBondContact O-N 3.47Å; N289-K291 WeakPolarHBondContact OD1-CA 3.31Å; N289-K291 VanDerWaalsContact OD1-CB 3.3Å; N289-K291 WeakPolarHBondContact OD1-CB 3.04Å; N289-K291 PolarHBondContact OD1-N 2.94Å; K291-M293 VanDerWaalsContact C-N 3.29Å; K291-C294 PolarHBondContact O-N 3.43Å; K291-Q295 PolarHBondContact O-N 3.42Å
292	L	95.5	Very high	94.2	Very high	68 Å²	68	37.4 Å²	37.4	36%	0.356	21%	0.208	S	C	.	.	H	α-helix	trans	-67	-35.3	174.7	-62.6	-177.6	0	0	0	110.8	N289 Q295 Y296 P319 F320	N289-L292 HydrophobicContact CB-CB 4.14Å; N289-L292 HydrophobicContact CB-CD1 3.97Å; N289-L292 HydrophobicContact CB-CG 3.93Å; N289-L292 PolarHBondContact O-N 3.37Å; N289-L292 VanDerWaalsContact O-N 3.16Å; N289-L292 PolarHBondContact OD1-N 3.18Å; L292-Q295 PolarHBondContact O-N 2.79Å; L292-Y296 WeakPolarHBondContact O-CB 3.41Å; L292-Y296 PolarHBondContact O-N 3.13Å; L292-P319 HydrophobicContact CB-CB 4.11Å; L292-P319 HydrophobicContact CB-CG 4.25Å; L292-P319 HydrophobicContact CD2-CB 3.96Å; L292-P319 HydrophobicContact CG-CB 4.47Å; L292-P319 WeakPolarHBondContact O-CG 3.5Å; L292-F320 HydrophobicContact CB-CE1 3.87Å; L292-F320 HydrophobicContact CB-CZ 3.95Å
293	M	95.3	Very high	94.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-46.4	172.6	-174.4	58.4	81.6	0	0	111.2	G211 A214 A215 L277 V283 M288 N289 C290 K291 Q295 Y296 I297 F320	G211-M293 WeakPolarHBondContact O-CE 3.23Å; A214-M293 HydrophobicContact CB-CE 4.09Å; A215-M293 HydrophobicContact CB-CE 4.35Å; L277-M293 HydrophobicContact CB-CG 3.97Å; L277-M293 HydrophobicContact CD1-CG 3.74Å; L277-M293 HydrophobicContact CD1-SD 3.96Å; L277-M293 HydrophobicContact CG-CG 4.48Å; V283-M293 HydrophobicContact CG1-CE 3.9Å; V283-M293 HydrophobicContact CG1-CG 4.2Å; V283-M293 HydrophobicContact CG2-CB 3.87Å; V283-M293 HydrophobicContact CG2-CG 4.28Å; M288-M293 HydrophobicContact CE-CE 3.54Å; M288-M293 HydrophobicContact SD-CE 3.92Å; N289-M293 PolarHBondContact O-N 3.2Å; C290-M293 WeakPolarHBondContact O-CB 3.23Å; C290-M293 PolarHBondContact O-N 2.79Å; K291-M293 VanDerWaalsContact C-N 3.29Å; M293-Q295 VanDerWaalsContact C-N 3.31Å; M293-Q295 PolarHBondContact O-N 3.39Å; M293-Y296 WeakPolarHBondContact O-CB 3.33Å; M293-Y296 PolarHBondContact O-N 3.36Å; M293-Y296 HydrophobicContact SD-CD1 4.05Å; M293-I297 WeakPolarHBondContact O-CG1 3.45Å; M293-I297 PolarHBondContact O-N 2.99Å; M293-I297 HydrophobicContact SD-CD1 4.34Å; M293-F320 HydrophobicContact CB-CZ 4.42Å; M293-F320 HydrophobicContact CE-CE2 4.07Å; M293-F320 HydrophobicContact CE-CZ 4.42Å; M293-F320 HydrophobicContact SD-CE2 3.91Å
294	C	96	Very high	94.3	Very high	25 Å²	25	41.5 Å²	41.5	17%	0.169	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-42	176.1	-64.3	0	0	0	0	112.7	Q274 C290 K291 Y296 I297 E298	Q274-C294 HydrophobicContact CG-CB 3.97Å; Q274-C294 PolarHBondContact NE2-O 3.04Å; Q274-C294 VanDerWaalsContact NE2-O 3.13Å; C290-C294 PolarHBondContact O-N 2.97Å; C290-C294 PolarHBondContact O-SG 2.76Å; K291-C294 PolarHBondContact O-N 3.43Å; C294-Y296 VanDerWaalsContact C-N 3.32Å; C294-Y296 PolarHBondContact O-N 2.52Å; C294-I297 PolarHBondContact O-N 3.31Å; C294-E298 WeakPolarHBondContact O-CG 3.35Å; C294-E298 PolarHBondContact O-N 2.93Å; C294-E298 VanDerWaalsContact O-N 3.14Å
295	Q	96.5	Very high	94.5	Very high	61 Å²	61	38.1 Å²	38.1	29%	0.285	20%	0.197	S	C	.	.	H	α-helix	trans	-62.2	-38.9	174.2	-179	-175.3	-12.3	0	0	112	K291 L292 M293 E298 F299 D317 P319	K291-Q295 PolarHBondContact O-N 3.42Å; L292-Q295 PolarHBondContact O-N 2.79Å; M293-Q295 VanDerWaalsContact C-N 3.31Å; M293-Q295 PolarHBondContact O-N 3.39Å; Q295-E298 PolarHBondContact O-N 3.27Å; Q295-F299 PolarHBondContact O-N 3.38Å; Q295-D317 PolarHBondContact NE2-O 3.16Å; Q295-P319 HydrophobicContact CB-CG 4.3Å; Q295-P319 HydrophobicContact CG-CG 4.32Å
296	Y	95.4	Very high	94.7	Very high	11 Å²	11	38.5 Å²	38.5	4%	0.043	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-42.1	175.7	177.2	-107.9	0	0	0	112.1	A214 L292 M293 C294 E298 F299 I300 N318 F320 M323	A214-Y296 HydrophobicContact CB-CD1 4.09Å; A214-Y296 HydrophobicContact CB-CE1 3.64Å; L292-Y296 WeakPolarHBondContact O-CB 3.41Å; L292-Y296 PolarHBondContact O-N 3.13Å; M293-Y296 WeakPolarHBondContact O-CB 3.33Å; M293-Y296 PolarHBondContact O-N 3.36Å; M293-Y296 HydrophobicContact SD-CD1 4.05Å; C294-Y296 VanDerWaalsContact C-N 3.32Å; C294-Y296 PolarHBondContact O-N 2.52Å; Y296-E298 VanDerWaalsContact C-N 3.31Å; Y296-E298 PolarHBondContact O-N 2.81Å; Y296-F299 HydrophobicContact CD2-CD1 4.21Å; Y296-F299 HydrophobicContact CE2-CD1 4.22Å; Y296-F299 WeakPolarHBondContact O-CB 3.42Å; Y296-F299 PolarHBondContact O-N 3.43Å; Y296-I300 HydrophobicContact CD1-CG1 4.42Å; Y296-I300 HydrophobicContact CD2-CG1 4.43Å; Y296-I300 HydrophobicContact CE1-CG1 3.91Å; Y296-I300 HydrophobicContact CE2-CD1 3.99Å; Y296-I300 HydrophobicContact CE2-CG1 3.95Å; Y296-I300 WeakPolarHBondContact O-CG1 3.37Å; Y296-I300 PolarHBondContact O-N 2.68Å; Y296-N318 WeakPolarHBondContact CD2-OD1 3.4Å; Y296-F320 VanDerWaalsContact CB-CE2 3.47Å; Y296-F320 HydrophobicContact CD1-CD2 4.07Å; Y296-F320 HydrophobicContact CD1-CE2 4.11Å; Y296-F320 AromaticContact CD2-CD2 3.71Å; Y296-F320 HydrophobicContact CD2-CD2 3.71Å; Y296-F320 HydrophobicContact CD2-CE2 4.37Å; Y296-F320 HydrophobicContact CE2-CD2 4.38Å; Y296-F320 AromaticContact CG-CD2 3.52Å; Y296-F320 HydrophobicContact CG-CD2 3.52Å; Y296-F320 AromaticContact CG-CE2 3.73Å; Y296-F320 HydrophobicContact CG-CE2 3.73Å; Y296-M323 HydrophobicContact CE2-CB 4.16Å; Y296-M323 HydrophobicContact CE2-CG 3.99Å; Y296-M323 WeakPolarHBondContact OH-CE 3.38Å
297	I	95.7	Very high	94.7	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-42.4	175.5	-58.4	-46.8	0	0	0	111	V207 V270 E273 Q274 L277 M293 C294 I300 A301	V207-I297 HydrophobicContact CG1-CG2 3.98Å; V270-I297 HydrophobicContact CB-CG2 4.34Å; V270-I297 HydrophobicContact CG1-CG2 4.02Å; V270-I297 HydrophobicContact CG2-CG2 4.23Å; E273-I297 HydrophobicContact CB-CG2 3.95Å; E273-I297 HydrophobicContact CG-CD1 3.7Å; E273-I297 HydrophobicContact CG-CG1 3.91Å; E273-I297 HydrophobicContact CG-CG2 4.01Å; Q274-I297 HydrophobicContact CG-CB 4.3Å; Q274-I297 HydrophobicContact CG-CG2 4.35Å; L277-I297 HydrophobicContact CD1-CD1 4.29Å; M293-I297 WeakPolarHBondContact O-CG1 3.45Å; M293-I297 PolarHBondContact O-N 2.99Å; M293-I297 HydrophobicContact SD-CD1 4.34Å; C294-I297 PolarHBondContact O-N 3.31Å; I297-I300 PolarHBondContact O-N 2.82Å; I297-A301 WeakPolarHBondContact O-CB 3.32Å; I297-A301 PolarHBondContact O-N 2.75Å
298	E	97.4	Very high	94.9	Very high	45 Å²	45	39.6 Å²	39.6	21%	0.21	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-41.5	175.5	-69.9	170	179.6	0	0	112.4	V270 Q274 C294 Q295 Y296 I300 A301 D302 Y314 S316	V270-E298 HydrophobicContact CG1-CG 4.32Å; Q274-E298 PolarHBondContact NE2-OE1 3.45Å; Q274-E298 VanDerWaalsContact NE2-OE1 3.08Å; C294-E298 WeakPolarHBondContact O-CG 3.35Å; C294-E298 PolarHBondContact O-N 2.93Å; C294-E298 VanDerWaalsContact O-N 3.14Å; Q295-E298 PolarHBondContact O-N 3.27Å; Y296-E298 VanDerWaalsContact C-N 3.31Å; Y296-E298 PolarHBondContact O-N 2.81Å; E298-I300 PolarHBondContact O-N 3.48Å; E298-A301 PolarHBondContact O-N 3.45Å; E298-D302 PolarHBondContact O-N 3.04Å; E298-Y314 HydrophobicContact CB-CD1 4.18Å; E298-Y314 HydrophobicContact CB-CD2 4.15Å; E298-Y314 HydrophobicContact CB-CG 3.78Å; E298-Y314 HydrophobicContact CG-CD1 3.66Å; E298-Y314 HydrophobicContact CG-CD2 4.29Å; E298-Y314 HydrophobicContact CG-CE1 4.03Å; E298-Y314 HydrophobicContact CG-CG 3.79Å; E298-S316 WeakPolarHBondContact CB-OG 3.24Å; E298-S316 PolarHBondContact OE2-OG 3.25Å
299	F	95.5	Very high	95	Very high	51 Å²	51	42.4 Å²	42.4	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-44.1	174.8	164	-100.1	0	0	0	111.9	Q295 Y296 D302 R303 S316 N318	Q295-F299 PolarHBondContact O-N 3.38Å; Y296-F299 HydrophobicContact CD2-CD1 4.21Å; Y296-F299 HydrophobicContact CE2-CD1 4.22Å; Y296-F299 WeakPolarHBondContact O-CB 3.42Å; Y296-F299 PolarHBondContact O-N 3.43Å; F299-D302 PolarHBondContact O-N 3.32Å; F299-R303 PolarHBondContact O-N 3.44Å; F299-S316 WeakPolarHBondContact CD2-O 3.34Å; F299-N318 HydrophobicContact CD1-CB 3.85Å; F299-N318 HydrophobicContact CD2-CB 4.05Å; F299-N318 HydrophobicContact CE1-CB 3.76Å; F299-N318 HydrophobicContact CE2-CB 3.96Å; F299-N318 HydrophobicContact CG-CB 4Å; F299-N318 HydrophobicContact CZ-CB 3.82Å
300	I	94.2	Very high	95.1	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-39.7	177.5	-66.4	-61.6	0	0	0	111.4	G206 Y296 I297 E298 R303 L304	G206-I300 VanDerWaalsContact O-CG2 3.26Å; G206-I300 WeakPolarHBondContact O-CG2 3.17Å; Y296-I300 HydrophobicContact CD1-CG1 4.42Å; Y296-I300 HydrophobicContact CD2-CG1 4.43Å; Y296-I300 HydrophobicContact CE1-CG1 3.91Å; Y296-I300 HydrophobicContact CE2-CD1 3.99Å; Y296-I300 HydrophobicContact CE2-CG1 3.95Å; Y296-I300 WeakPolarHBondContact O-CG1 3.37Å; Y296-I300 PolarHBondContact O-N 2.68Å; I297-I300 PolarHBondContact O-N 2.82Å; E298-I300 PolarHBondContact O-N 3.48Å; I300-R303 WeakPolarHBondContact O-CB 3.44Å; I300-R303 PolarHBondContact O-N 3.31Å; I300-L304 PolarHBondContact O-N 3.24Å
301	A	95.3	Very high	95.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-43.1	175.3	0	0	0	0	0	112.3	I266 V270 I297 E298 R303 L304 L305 Y314	I266-A301 HydrophobicContact CG2-CB 3.76Å; V270-A301 HydrophobicContact CG2-CB 3.31Å; I297-A301 WeakPolarHBondContact O-CB 3.32Å; I297-A301 PolarHBondContact O-N 2.75Å; E298-A301 PolarHBondContact O-N 3.45Å; A301-R303 VanDerWaalsContact C-N 3.34Å; A301-R303 PolarHBondContact O-N 2.95Å; A301-L304 PolarHBondContact O-N 3.02Å; A301-L305 WeakPolarHBondContact O-CG 3.44Å; A301-L305 PolarHBondContact O-N 2.96Å; A301-Y314 HydrophobicContact CB-CD2 4.35Å; A301-Y314 HydrophobicContact CB-CE2 4.14Å
302	D	96.1	Very high	95.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-39.8	173.7	-86.6	-6.2	0	0	0	112.4	E298 F299 L304 L305 V306 K312 M313 Y314 H315 S316	E298-D302 PolarHBondContact O-N 3.04Å; F299-D302 PolarHBondContact O-N 3.32Å; D302-L304 VanDerWaalsContact C-N 3.34Å; D302-L305 PolarHBondContact O-N 3.4Å; D302-V306 VanDerWaalsContact O-CG2 3.32Å; D302-V306 WeakPolarHBondContact O-CG2 3.47Å; D302-V306 PolarHBondContact O-N 2.86Å; D302-K312 HydrophobicContact CB-CB 4.28Å; D302-K312 HydrophobicContact CB-CD 4.19Å; D302-K312 HydrophobicContact CB-CG 4Å; D302-M313 PolarHBondContact OD1-N 3.38Å; D302-Y314 PolarHBondContact OD1-N 3.28Å; D302-Y314 PolarHBondContact OD2-N 3.37Å; D302-H315 VanDerWaalsContact OD2-CA 3.24Å; D302-H315 WeakPolarHBondContact OD2-CA 3.47Å; D302-H315 PolarHBondContact OD2-N 3.06Å; D302-S316 PolarHBondContact OD2-N 3.18Å
303	R	93.2	Very high	95.3	Very high	110 Å²	110	39.1 Å²	39.1	42%	0.415	20%	0.2	S	C	.	.	H	α-helix	trans	-60	-46.6	174.5	-174.1	-171.8	72.7	171.8	4.1	110.8	F299 I300 A301 V306 E307	F299-R303 PolarHBondContact O-N 3.44Å; I300-R303 WeakPolarHBondContact O-CB 3.44Å; I300-R303 PolarHBondContact O-N 3.31Å; A301-R303 VanDerWaalsContact C-N 3.34Å; A301-R303 PolarHBondContact O-N 2.95Å; R303-V306 PolarHBondContact O-N 3.19Å; R303-E307 PolarHBondContact O-N 2.68Å
304	L	93.7	Very high	95.3	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-44.2	177.7	176	56.4	0	0	0	111.6	A202 A203 V207 C247 I266 I300 A301 D302 V306 E307 L308	A202-L304 HydrophobicContact CB-CD1 3.98Å; A203-L304 HydrophobicContact CB-CD2 4.35Å; V207-L304 HydrophobicContact CG2-CD2 3.89Å; C247-L304 VanDerWaalsContact SG-CD1 3.55Å; I266-L304 HydrophobicContact CD1-CD2 3.69Å; I266-L304 HydrophobicContact CD1-CG 4.31Å; I300-L304 PolarHBondContact O-N 3.24Å; A301-L304 PolarHBondContact O-N 3.02Å; D302-L304 VanDerWaalsContact C-N 3.34Å; L304-V306 VanDerWaalsContact C-N 3.32Å; L304-V306 PolarHBondContact O-N 3.39Å; L304-E307 PolarHBondContact O-N 3.48Å; L304-L308 HydrophobicContact CD1-CD1 3.96Å; L304-L308 HydrophobicContact CD1-CG 4.05Å; L304-L308 HydrophobicContact CG-CD1 3.98Å; L304-L308 WeakPolarHBondContact O-CB 3.29Å; L304-L308 VanDerWaalsContact O-CG 3.29Å; L304-L308 WeakPolarHBondContact O-CG 3.49Å; L304-L308 PolarHBondContact O-N 2.77Å
305	L	95.9	Very high	95.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.6	-44.8	175.8	-75.3	168.6	0	0	0	112	V262 I266 A301 D302 L308 G309 Y310 M313	V262-L305 HydrophobicContact CG1-CD2 3.85Å; I266-L305 HydrophobicContact CB-CD2 4.34Å; I266-L305 HydrophobicContact CG1-CD2 3.86Å; I266-L305 HydrophobicContact CG1-CG 4.37Å; I266-L305 HydrophobicContact CG2-CD1 4.42Å; I266-L305 HydrophobicContact CG2-CG 4.29Å; A301-L305 WeakPolarHBondContact O-CG 3.44Å; A301-L305 PolarHBondContact O-N 2.96Å; D302-L305 PolarHBondContact O-N 3.4Å; L305-L308 PolarHBondContact O-N 3.38Å; L305-G309 PolarHBondContact O-N 3.32Å; L305-Y310 PolarHBondContact O-N 3.02Å; L305-M313 HydrophobicContact CD1-CB 3.68Å; L305-M313 HydrophobicContact CD1-CE 4.27Å
306	V	94.8	Very high	95.1	Very high	73 Å²	73	44.6 Å²	44.6	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-63.7	-42.7	177.5	171.2	0	0	0	0	111.6	D302 R303 L304 L308 G309 Y310 K312	D302-V306 VanDerWaalsContact O-CG2 3.32Å; D302-V306 WeakPolarHBondContact O-CG2 3.47Å; D302-V306 PolarHBondContact O-N 2.86Å; R303-V306 PolarHBondContact O-N 3.19Å; L304-V306 VanDerWaalsContact C-N 3.32Å; L304-V306 PolarHBondContact O-N 3.39Å; V306-L308 VanDerWaalsContact C-N 3.31Å; V306-L308 PolarHBondContact O-N 3.36Å; V306-G309 WeakPolarHBondContact O-CA 3.43Å; V306-G309 PolarHBondContact O-N 2.91Å; V306-Y310 WeakPolarHBondContact CA-O 3.37Å; V306-K312 HydrophobicContact CG2-CG 3.76Å
307	E	92.7	Very high	95	Very high	78 Å²	78	49.8 Å²	49.8	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-67	-30.9	177.3	-77.7	-57.6	148.8	0	0	113.4	C247 K251 R303 L304 G309	C247-E307 HydrophobicContact CB-CB 4.11Å; K251-E307 WeakPolarHBondContact CE-O 3.45Å; K251-E307 IonicContact NZ-OE2 3.91Å; K251-E307 PolarHBondContact NZ-OE2 2.79Å; R303-E307 PolarHBondContact O-N 2.68Å; L304-E307 PolarHBondContact O-N 3.48Å; E307-G309 PolarHBondContact O-N 2.91Å
308	L	94.4	Very high	94.8	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.6	170.3	-67.3	170	0	0	0	112.9	V199 C247 F250 V262 L304 L305 V306 Y310	V199-L308 HydrophobicContact CG1-CD1 4.18Å; V199-L308 HydrophobicContact CG2-CD1 4.3Å; V199-L308 HydrophobicContact CG2-CD2 4.46Å; C247-L308 HydrophobicContact CB-CD2 4.49Å; F250-L308 HydrophobicContact CB-CD2 3.85Å; F250-L308 HydrophobicContact CD1-CB 4.24Å; F250-L308 HydrophobicContact CD1-CD2 3.77Å; F250-L308 WeakPolarHBondContact CD1-O 3.47Å; F250-L308 HydrophobicContact CD2-CD2 4.25Å; F250-L308 HydrophobicContact CE1-CB 4.32Å; F250-L308 HydrophobicContact CE1-CD2 4.39Å; F250-L308 VanDerWaalsContact CE1-O 3.29Å; F250-L308 WeakPolarHBondContact CE1-O 3.42Å; F250-L308 HydrophobicContact CG-CD2 3.68Å; V262-L308 HydrophobicContact CG1-CD1 4.39Å; L304-L308 HydrophobicContact CD1-CD1 3.96Å; L304-L308 HydrophobicContact CD1-CG 4.05Å; L304-L308 HydrophobicContact CG-CD1 3.98Å; L304-L308 WeakPolarHBondContact O-CB 3.29Å; L304-L308 VanDerWaalsContact O-CG 3.29Å; L304-L308 WeakPolarHBondContact O-CG 3.49Å; L304-L308 PolarHBondContact O-N 2.77Å; L305-L308 PolarHBondContact O-N 3.38Å; V306-L308 VanDerWaalsContact C-N 3.31Å; V306-L308 PolarHBondContact O-N 3.36Å; L308-Y310 HydrophobicContact CB-CD2 3.84Å; L308-Y310 HydrophobicContact CB-CE2 4.21Å
309	G	94.5	Very high	94.6	Very high	66 Å²	66	50.7 Å²	50.7	68%	0.68	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	19.1	178.4	0	0	0	0	0	114.8	L305 V306 E307	L305-G309 PolarHBondContact O-N 3.32Å; V306-G309 WeakPolarHBondContact O-CA 3.43Å; V306-G309 PolarHBondContact O-N 2.91Å; E307-G309 PolarHBondContact O-N 2.91Å
310	Y	96	Very high	94.3	Very high	35 Å²	35	48.8 Å²	48.8	14%	0.137	25%	0.251	C	S	.	.			trans	-105.7	166.7	175.7	-63.1	-91.3	0	0	0	111.5	F250 P257 K259 V262 L305 V306 L308	F250-Y310 AromaticContact CE1-CE2 3.65Å; F250-Y310 HydrophobicContact CE1-CE2 3.65Å; F250-Y310 AromaticContact CZ-CE2 3.81Å; F250-Y310 HydrophobicContact CZ-CE2 3.81Å; P257-Y310 PolarHBondContact O-OH 3.1Å; K259-Y310 HydrophobicContact CB-CD1 4.04Å; K259-Y310 HydrophobicContact CB-CE1 4.15Å; K259-Y310 HydrophobicContact CG-CD1 4.08Å; V262-Y310 HydrophobicContact CB-CE1 4.46Å; V262-Y310 HydrophobicContact CB-CE2 4.26Å; V262-Y310 HydrophobicContact CG1-CD2 3.96Å; V262-Y310 HydrophobicContact CG1-CE2 3.99Å; V262-Y310 HydrophobicContact CG1-CG 4.4Å; V262-Y310 HydrophobicContact CG2-CE1 4.16Å; V262-Y310 HydrophobicContact CG2-CE2 3.79Å; L305-Y310 PolarHBondContact O-N 3.02Å; V306-Y310 WeakPolarHBondContact CA-O 3.37Å; L308-Y310 HydrophobicContact CB-CD2 3.84Å; L308-Y310 HydrophobicContact CB-CE2 4.21Å
311	E	95.9	Very high	93.9	Very high	130 Å²	130	53.1 Å²	53.1	61%	0.607	28%	0.275	S	S	*	.			trans	-76	155.7	175.8	-66	172.8	162.9	0	0	111.1	K259	K259-E311 IonicContact NZ-OE2 2.7Å; K259-E311 PolarHBondContact NZ-OE2 3.04Å
312	K	96.4	Very high	93.3	Very high	92 Å²	92	53.8 Å²	53.8	40%	0.4	28%	0.278	S	S	.	.			trans	-60.1	145.5	171.9	-65.2	-170.9	176.9	-169.1	0	110.7	D302 V306 H315	D302-K312 HydrophobicContact CB-CB 4.28Å; D302-K312 HydrophobicContact CB-CD 4.19Å; D302-K312 HydrophobicContact CB-CG 4Å; V306-K312 HydrophobicContact CG2-CG 3.76Å; K312-H315 PolarHBondContact O-NE2 3.43Å
313	M	95.2	Very high	92.5	Very high	31 Å²	31	55.1 Å²	55.1	15%	0.153	28%	0.284	C	S	.	.	S	Bend	trans	-103	-42.2	178	178.4	-170.4	-59	0	0	111.8	E263 R267 D302 L305	E263-M313 HydrophobicContact CB-CE 3.33Å; E263-M313 HydrophobicContact CG-CE 3.42Å; E263-M313 VanDerWaalsContact CG-CE 3.42Å; E263-M313 WeakPolarHBondContact O-CE 3.43Å; R267-M313 HydrophobicContact CB-CE 4.37Å; R267-M313 HydrophobicContact CB-SD 4.24Å; R267-M313 PolarHBondContact NH2-SD 3.36Å; D302-M313 PolarHBondContact OD1-N 3.38Å; L305-M313 HydrophobicContact CD1-CB 3.68Å; L305-M313 HydrophobicContact CD1-CE 4.27Å
314	Y	95.5	Very high	91.3	Very high	48 Å²	48	54.6 Å²	54.6	19%	0.188	29%	0.286	C	S	.	.	S	Bend	trans	-98.9	-29.9	-170.2	-63	-81.9	0	0	0	112.8	V270 E298 A301 D302 S316	V270-Y314 HydrophobicContact CG1-CE2 4.42Å; V270-Y314 HydrophobicContact CG2-CE2 4.11Å; E298-Y314 HydrophobicContact CB-CD1 4.18Å; E298-Y314 HydrophobicContact CB-CD2 4.15Å; E298-Y314 HydrophobicContact CB-CG 3.78Å; E298-Y314 HydrophobicContact CG-CD1 3.66Å; E298-Y314 HydrophobicContact CG-CD2 4.29Å; E298-Y314 HydrophobicContact CG-CE1 4.03Å; E298-Y314 HydrophobicContact CG-CG 3.79Å; A301-Y314 HydrophobicContact CB-CD2 4.35Å; A301-Y314 HydrophobicContact CB-CE2 4.14Å; D302-Y314 PolarHBondContact OD1-N 3.28Å; D302-Y314 PolarHBondContact OD2-N 3.37Å; Y314-S316 PolarHBondContact O-N 2.85Å
315	H	95.9	Very high	89.3	Confident	137 Å²	137	58.1 Å²	58.1	63%	0.634	31%	0.305	S	S	*	.			trans	55.7	34.9	-172.4	-57.2	-91.1	0	0	0	113	D302 K312	D302-H315 VanDerWaalsContact OD2-CA 3.24Å; D302-H315 WeakPolarHBondContact OD2-CA 3.47Å; D302-H315 PolarHBondContact OD2-N 3.06Å; K312-H315 PolarHBondContact O-NE2 3.43Å
316	S	93.2	Very high	87.1	Confident	16 Å²	16	59.6 Å²	59.6	11%	0.112	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-85.5	137.2	-178.3	-65.8	0	0	0	0	111.1	E298 F299 D302 Y314	E298-S316 WeakPolarHBondContact CB-OG 3.24Å; E298-S316 PolarHBondContact OE2-OG 3.25Å; F299-S316 WeakPolarHBondContact CD2-O 3.34Å; D302-S316 PolarHBondContact OD2-N 3.18Å; Y314-S316 PolarHBondContact O-N 2.85Å
317	D	92.7	Very high	84.2	Confident	120 Å²	120	58.2 Å²	58.2	64%	0.642	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-84.2	155	174	-66.2	-47.3	0	0	0	111.3	Q295 P319	Q295-D317 PolarHBondContact NE2-O 3.16Å; D317-P319 VanDerWaalsContact O-CD 3.26Å; D317-P319 WeakPolarHBondContact O-CD 3.27Å
318	N	92.6	Very high	81	Confident	29 Å²	29	58.8 Å²	58.8	16%	0.155	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-70	116.3	174.3	179.1	17.5	0	0	0	111.1	Y296 F299 F320 E324	Y296-N318 WeakPolarHBondContact CD2-OD1 3.4Å; F299-N318 HydrophobicContact CD1-CB 3.85Å; F299-N318 HydrophobicContact CD2-CB 4.05Å; F299-N318 HydrophobicContact CE1-CB 3.76Å; F299-N318 HydrophobicContact CE2-CB 3.96Å; F299-N318 HydrophobicContact CG-CB 4Å; F299-N318 HydrophobicContact CZ-CB 3.82Å; N318-F320 VanDerWaalsContact C-N 3.34Å; N318-F320 PolarHBondContact ND2-O 3.25Å; N318-F320 VanDerWaalsContact ND2-O 3.09Å; N318-F320 PolarHBondContact OD1-N 3.07Å; N318-F320 PolarHBondContact OD1-O 3.5Å; N318-E324 WeakPolarHBondContact ND2-CG 3.33Å; N318-E324 PolarHBondContact ND2-OE1 3.37Å
319	P	92.3	Very high	78	Confident	36 Å²	36	63.8 Å²	63.8	23%	0.234	33%	0.334	C	S	.	.			trans	-85.1	-6.9	179.2	33.3	-30.8	0	0	0	113.5	L292 Q295 D317	L292-P319 HydrophobicContact CB-CB 4.11Å; L292-P319 HydrophobicContact CB-CG 4.25Å; L292-P319 HydrophobicContact CD2-CB 3.96Å; L292-P319 HydrophobicContact CG-CB 4.47Å; L292-P319 WeakPolarHBondContact O-CG 3.5Å; Q295-P319 HydrophobicContact CB-CG 4.3Å; Q295-P319 HydrophobicContact CG-CG 4.32Å; D317-P319 VanDerWaalsContact O-CD 3.26Å; D317-P319 WeakPolarHBondContact O-CD 3.27Å
320	F	90.1	Very high	75.1	Confident	12 Å²	12	62.1 Å²	62.1	5%	0.053	32%	0.317	C	S	.	.			trans	-115	95.8	-173.2	-60.3	-39.6	0	0	0	111.5	M288 L292 M293 Y296 N318 F322 M323	M288-F320 HydrophobicContact CE-CD1 4.38Å; M288-F320 HydrophobicContact CE-CD2 4.43Å; M288-F320 HydrophobicContact CE-CE1 3.78Å; M288-F320 HydrophobicContact CE-CE2 3.83Å; M288-F320 HydrophobicContact CE-CZ 3.47Å; M288-F320 VanDerWaalsContact CE-CZ 3.47Å; L292-F320 HydrophobicContact CB-CE1 3.87Å; L292-F320 HydrophobicContact CB-CZ 3.95Å; M293-F320 HydrophobicContact CB-CZ 4.42Å; M293-F320 HydrophobicContact CE-CE2 4.07Å; M293-F320 HydrophobicContact CE-CZ 4.42Å; M293-F320 HydrophobicContact SD-CE2 3.91Å; Y296-F320 VanDerWaalsContact CB-CE2 3.47Å; Y296-F320 HydrophobicContact CD1-CD2 4.07Å; Y296-F320 HydrophobicContact CD1-CE2 4.11Å; Y296-F320 AromaticContact CD2-CD2 3.71Å; Y296-F320 HydrophobicContact CD2-CD2 3.71Å; Y296-F320 HydrophobicContact CD2-CE2 4.37Å; Y296-F320 HydrophobicContact CE2-CD2 4.38Å; Y296-F320 AromaticContact CG-CD2 3.52Å; Y296-F320 HydrophobicContact CG-CD2 3.52Å; Y296-F320 AromaticContact CG-CE2 3.73Å; Y296-F320 HydrophobicContact CG-CE2 3.73Å; N318-F320 VanDerWaalsContact C-N 3.34Å; N318-F320 PolarHBondContact ND2-O 3.25Å; N318-F320 VanDerWaalsContact ND2-O 3.09Å; N318-F320 PolarHBondContact OD1-N 3.07Å; N318-F320 PolarHBondContact OD1-O 3.5Å; F320-F322 HydrophobicContact CB-CD1 4.05Å; F320-F322 HydrophobicContact CB-CE1 3.57Å; F320-F322 HydrophobicContact CB-CE2 4.34Å; F320-F322 HydrophobicContact CB-CZ 3.73Å; F320-F322 AromaticContact CD1-CE1 3.73Å; F320-F322 HydrophobicContact CD1-CE1 3.73Å; F320-F322 HydrophobicContact CD1-CZ 4.04Å; F320-F322 HydrophobicContact CD2-CZ 4.27Å; F320-F322 AromaticContact CG-CE1 3.75Å; F320-F322 HydrophobicContact CG-CE1 3.75Å; F320-F322 AromaticContact CG-CZ 3.76Å; F320-F322 HydrophobicContact CG-CZ 3.76Å; F320-F322 PolarHBondContact O-N 3.02Å; F320-M323 HydrophobicContact CB-CB 4.33Å; F320-M323 HydrophobicContact CB-CG 3.85Å; F320-M323 WeakPolarHBondContact O-CB 3.47Å; F320-M323 PolarHBondContact O-N 3.19Å; F320-M323 VanDerWaalsContact O-N 3.07Å
321	D	85.9	Confident	72	Confident	94 Å²	94	66.5 Å²	66.5	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-52.4	-39	176.1	64.2	-14	0	0	0	113.4	K221 M323 E324 N325	K221-D321 IonicContact NZ-OD1 2.69Å; K221-D321 PolarHBondContact NZ-OD1 3.06Å; K221-D321 IonicContact NZ-OD2 2.82Å; D321-M323 VanDerWaalsContact C-N 3.26Å; D321-M323 PolarHBondContact O-N 3.15Å; D321-E324 WeakPolarHBondContact O-CB 3.09Å; D321-E324 PolarHBondContact O-N 3.36Å; D321-E324 VanDerWaalsContact O-N 3.11Å; D321-N325 PolarHBondContact O-N 2.88Å; D321-N325 VanDerWaalsContact O-N 3.1Å
322	F	82.1	Confident	68.8	Low	14 Å²	14	62.3 Å²	62.3	6%	0.061	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-27.7	-178.7	62	-92.4	0	0	0	112.7	F217 W218 K221 M288 F320 E324 N325 I326	F217-F322 HydrophobicContact CB-CD2 4.04Å; F217-F322 HydrophobicContact CB-CE2 3.93Å; W218-F322 HydrophobicContact CB-CZ 4.45Å; W218-F322 AromaticContact CE3-CE1 3.88Å; W218-F322 HydrophobicContact CE3-CE1 3.88Å; W218-F322 HydrophobicContact CE3-CZ 4.21Å; W218-F322 HydrophobicContact CZ3-CE1 4.34Å; K221-F322 HydrophobicContact CD-CB 4.17Å; K221-F322 HydrophobicContact CD-CD1 4.06Å; K221-F322 HydrophobicContact CD-CG 4.27Å; M288-F322 HydrophobicContact CE-CZ 4.08Å; F320-F322 HydrophobicContact CB-CD1 4.05Å; F320-F322 HydrophobicContact CB-CE1 3.57Å; F320-F322 HydrophobicContact CB-CE2 4.34Å; F320-F322 HydrophobicContact CB-CZ 3.73Å; F320-F322 AromaticContact CD1-CE1 3.73Å; F320-F322 HydrophobicContact CD1-CE1 3.73Å; F320-F322 HydrophobicContact CD1-CZ 4.04Å; F320-F322 HydrophobicContact CD2-CZ 4.27Å; F320-F322 AromaticContact CG-CE1 3.75Å; F320-F322 HydrophobicContact CG-CE1 3.75Å; F320-F322 AromaticContact CG-CZ 3.76Å; F320-F322 HydrophobicContact CG-CZ 3.76Å; F320-F322 PolarHBondContact O-N 3.02Å; F322-E324 VanDerWaalsContact C-N 3.31Å; F322-N325 PolarHBondContact O-N 3.37Å; F322-I326 HydrophobicContact CD2-CD1 4.21Å; F322-I326 VanDerWaalsContact O-CD1 3.26Å; F322-I326 WeakPolarHBondContact O-CD1 3.46Å; F322-I326 VanDerWaalsContact O-CG1 3.22Å; F322-I326 WeakPolarHBondContact O-CG1 3.13Å; F322-I326 PolarHBondContact O-N 3.06Å
323	M	79.2	Confident	65.8	Low	29 Å²	29	64.1 Å²	64.1	14%	0.143	33%	0.334	C	S	.	.	H	α-helix	trans	-70.8	-29.4	175.3	-66	-55.9	-72.6	0	0	111.9	A214 F217 Y296 F320 D321 I326 S327	A214-M323 HydrophobicContact CB-CE 4.07Å; A214-M323 HydrophobicContact CB-CG 4.33Å; A214-M323 HydrophobicContact CB-SD 3.94Å; F217-M323 HydrophobicContact CB-SD 4.07Å; F217-M323 HydrophobicContact CD2-CE 3.78Å; F217-M323 HydrophobicContact CD2-SD 3.59Å; F217-M323 VanDerWaalsContact CD2-SD 3.59Å; F217-M323 HydrophobicContact CE2-CE 4.14Å; F217-M323 HydrophobicContact CE2-SD 4.41Å; F217-M323 HydrophobicContact CG-SD 4.2Å; Y296-M323 HydrophobicContact CE2-CB 4.16Å; Y296-M323 HydrophobicContact CE2-CG 3.99Å; Y296-M323 WeakPolarHBondContact OH-CE 3.38Å; F320-M323 HydrophobicContact CB-CB 4.33Å; F320-M323 HydrophobicContact CB-CG 3.85Å; F320-M323 WeakPolarHBondContact O-CB 3.47Å; F320-M323 PolarHBondContact O-N 3.19Å; F320-M323 VanDerWaalsContact O-N 3.07Å; D321-M323 VanDerWaalsContact C-N 3.26Å; D321-M323 PolarHBondContact O-N 3.15Å; M323-I326 HydrophobicContact SD-CD1 4.25Å; M323-S327 WeakPolarHBondContact O-CB 3.44Å; M323-S327 PolarHBondContact O-N 2.79Å
324	E	69	Low	63.1	Low	98 Å²	98	66.7 Å²	66.7	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-71.3	-44	170.2	-54.4	-169.1	169.3	0	0	110.2	N318 D321 F322 I326 S327 I328	N318-E324 WeakPolarHBondContact ND2-CG 3.33Å; N318-E324 PolarHBondContact ND2-OE1 3.37Å; D321-E324 WeakPolarHBondContact O-CB 3.09Å; D321-E324 PolarHBondContact O-N 3.36Å; D321-E324 VanDerWaalsContact O-N 3.11Å; F322-E324 VanDerWaalsContact C-N 3.31Å; E324-I326 PolarHBondContact O-N 2.86Å; E324-S327 CarbonylContact O-C 3.56Å; E324-S327 WeakPolarHBondContact O-CA 3.01Å; E324-S327 WeakPolarHBondContact O-CB 3.38Å; E324-S327 PolarHBondContact O-N 3.37Å; E324-S327 VanDerWaalsContact O-N 3.13Å; E324-I328 HydrophobicContact CB-CD1 4.18Å; E324-I328 WeakPolarHBondContact O-CB 3.34Å; E324-I328 WeakPolarHBondContact O-CD1 3.46Å; E324-I328 WeakPolarHBondContact O-CG1 3.34Å; E324-I328 PolarHBondContact O-N 3.05Å
325	N	51.5	Low	60.2	Low	80 Å²	80	68.3 Å²	68.3	43%	0.428	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-37.4	-178.2	-67.9	-26.3	0	0	0	112.8	D321 F322 S327 I328 E329	D321-N325 PolarHBondContact O-N 2.88Å; D321-N325 VanDerWaalsContact O-N 3.1Å; F322-N325 PolarHBondContact O-N 3.37Å; N325-S327 VanDerWaalsContact C-N 3.31Å; N325-I328 CarbonylContact O-C 3.14Å; N325-I328 WeakPolarHBondContact O-CA 3.31Å; N325-I328 PolarHBondContact O-N 3.44Å; N325-E329 WeakPolarHBondContact O-CB 3.36Å; N325-E329 WeakPolarHBondContact O-CG 3.44Å; N325-E329 PolarHBondContact O-N 3.24Å
326	I	48.5	Very low	57.1	Low	30 Å²	30	69.3 Å²	69.3	15%	0.154	36%	0.358	C	S	.	.	H	α-helix	trans	-68	-38.8	174.8	-65.9	154.2	0	0	0	110.2	F217 F322 M323 E324 I328 G330	F217-I326 HydrophobicContact CB-CD1 3.63Å; F217-I326 HydrophobicContact CD1-CD1 3.28Å; F217-I326 HydrophobicContact CD1-CG1 4.22Å; F217-I326 HydrophobicContact CD2-CD1 3.75Å; F217-I326 HydrophobicContact CE1-CD1 3.74Å; F217-I326 HydrophobicContact CE1-CG1 4.3Å; F217-I326 HydrophobicContact CE1-CG2 3.87Å; F217-I326 HydrophobicContact CE2-CD1 4.15Å; F217-I326 HydrophobicContact CE2-CG2 4.25Å; F217-I326 HydrophobicContact CG-CD1 3.28Å; F217-I326 HydrophobicContact CZ-CD1 4.14Å; F217-I326 HydrophobicContact CZ-CG2 3.68Å; F322-I326 HydrophobicContact CD2-CD1 4.21Å; F322-I326 VanDerWaalsContact O-CD1 3.26Å; F322-I326 WeakPolarHBondContact O-CD1 3.46Å; F322-I326 VanDerWaalsContact O-CG1 3.22Å; F322-I326 WeakPolarHBondContact O-CG1 3.13Å; F322-I326 PolarHBondContact O-N 3.06Å; M323-I326 HydrophobicContact SD-CD1 4.25Å; E324-I326 PolarHBondContact O-N 2.86Å; I326-I328 PolarHBondContact O-N 3.21Å; I326-G330 PolarHBondContact O-N 3.01Å
327	S	35.5	Very low	53.9	Low	45 Å²	45	76.8 Å²	76.8	32%	0.315	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-29.8	170.2	-165.6	0	0	0	0	111.4	M323 E324 N325 G330 K331	M323-S327 WeakPolarHBondContact O-CB 3.44Å; M323-S327 PolarHBondContact O-N 2.79Å; E324-S327 CarbonylContact O-C 3.56Å; E324-S327 WeakPolarHBondContact O-CA 3.01Å; E324-S327 WeakPolarHBondContact O-CB 3.38Å; E324-S327 PolarHBondContact O-N 3.37Å; E324-S327 VanDerWaalsContact O-N 3.13Å; N325-S327 VanDerWaalsContact C-N 3.31Å; S327-G330 CarbonylContact O-C 3.39Å; S327-K331 WeakPolarHBondContact O-CA 3.32Å; S327-K331 WeakPolarHBondContact O-CB 3.47Å; S327-K331 VanDerWaalsContact O-CD 3.3Å; S327-K331 WeakPolarHBondContact O-CD 2.8Å; S327-K331 WeakPolarHBondContact O-CG 3.29Å; S327-K331 PolarHBondContact O-N 2.89Å; S327-K331 VanDerWaalsContact OG-CD 3.29Å; S327-K331 WeakPolarHBondContact OG-CD 2.84Å; S327-K331 WeakPolarHBondContact OG-CE 3.13Å; S327-K331 PolarHBondContact OG-NZ 3.44Å
328	I	25.4	Very low	51.1	Low	90 Å²	90	83.4 Å²	83.4	46%	0.462	40%	0.404	S	S	.	.	H	α-helix	trans	-85.6	-34.9	-178	-67.9	160.9	0	0	0	113.8	E324 N325 I326 G330 K331	E324-I328 HydrophobicContact CB-CD1 4.18Å; E324-I328 WeakPolarHBondContact O-CB 3.34Å; E324-I328 WeakPolarHBondContact O-CD1 3.46Å; E324-I328 WeakPolarHBondContact O-CG1 3.34Å; E324-I328 PolarHBondContact O-N 3.05Å; N325-I328 CarbonylContact O-C 3.14Å; N325-I328 WeakPolarHBondContact O-CA 3.31Å; N325-I328 PolarHBondContact O-N 3.44Å; I326-I328 PolarHBondContact O-N 3.21Å; I328-G330 PolarHBondContact O-N 3.24Å; I328-K331 VanDerWaalsContact C-N 3.29Å; I328-K331 HydrophobicContact CG1-CD 4.35Å; I328-K331 CarbonylContact O-C 3.46Å; I328-K331 PolarHBondContact O-N 2.78Å
329	E	31.5	Very low	48.2	Very low	107 Å²	107	86 Å²	86	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-56.6	-36.9	164.7	-73.9	176.4	169.7	0	0	108.4	N325 E341	N325-E329 WeakPolarHBondContact O-CB 3.36Å; N325-E329 WeakPolarHBondContact O-CG 3.44Å; N325-E329 PolarHBondContact O-N 3.24Å; E329-E341 VanDerWaalsContact C-OE1 3.25Å
330	G	33.4	Very low	45.8	Very low	31 Å²	31	88.1 Å²	88.1	32%	0.32	45%	0.45	S	S	.	.	S	Bend	trans	-88.8	-2.6	165.1	0	0	0	0	0	118.3	I326 S327 I328 E341	I326-G330 PolarHBondContact O-N 3.01Å; S327-G330 CarbonylContact O-C 3.39Å; I328-G330 PolarHBondContact O-N 3.24Å; G330-E341 WeakPolarHBondContact CA-OE2 3.26Å; G330-E341 PolarHBondContact N-OE2 2.7Å
331	K	30.3	Very low	43.2	Very low	127 Å²	127	91.6 Å²	91.6	55%	0.552	47%	0.466	S	S	*	.			trans	-114	57.7	178.3	-71.2	157	169	164.3	0	110.5	S327 I328 N333	S327-K331 WeakPolarHBondContact O-CA 3.32Å; S327-K331 WeakPolarHBondContact O-CB 3.47Å; S327-K331 VanDerWaalsContact O-CD 3.3Å; S327-K331 WeakPolarHBondContact O-CD 2.8Å; S327-K331 WeakPolarHBondContact O-CG 3.29Å; S327-K331 PolarHBondContact O-N 2.89Å; S327-K331 VanDerWaalsContact OG-CD 3.29Å; S327-K331 WeakPolarHBondContact OG-CD 2.84Å; S327-K331 WeakPolarHBondContact OG-CE 3.13Å; S327-K331 PolarHBondContact OG-NZ 3.44Å; I328-K331 VanDerWaalsContact C-N 3.29Å; I328-K331 HydrophobicContact CG1-CD 4.35Å; I328-K331 CarbonylContact O-C 3.46Å; I328-K331 PolarHBondContact O-N 2.78Å; K331-N333 VanDerWaalsContact C-N 3.34Å; K331-N333 PolarHBondContact O-N 3.28Å
332	T	29	Very low	41.4	Very low	42 Å²	42	91.8 Å²	91.8	26%	0.258	46%	0.46	S	S	.	.	S	Bend		-60.7	114	121.7	43	0	0	0	0	106.2	F334 K337 V339	T332-F334 VanDerWaalsContact O-CA 3.31Å; T332-F334 WeakPolarHBondContact O-CA 3.44Å; T332-F334 PolarHBondContact O-N 2.51Å; T332-K337 HydrophobicContact CG2-CB 3.81Å; T332-K337 PolarHBondContact OG1-O 2.85Å; T332-V339 HydrophobicContact CG2-CB 3.78Å; T332-V339 HydrophobicContact CG2-CG2 3.31Å
333	N	33.5	Very low	39.9	Very low	130 Å²	130	95.1 Å²	95.1	70%	0.695	48%	0.476	S	S	*	.			trans	-28.6	112.2	164	-81.1	-30.7	0	0	0	106.7	K331 F335 E336	K331-N333 VanDerWaalsContact C-N 3.34Å; K331-N333 PolarHBondContact O-N 3.28Å; N333-F335 CarbonylContact O-C 3.53Å; N333-F335 WeakPolarHBondContact O-CA 3.31Å; N333-F335 PolarHBondContact O-N 2.81Å; N333-E336 PolarHBondContact O-N 3.47Å
334	F	38	Very low	38.6	Very low	85 Å²	85	99.9 Å²	99.9	37%	0.373	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-8	-158.1	-163.4	-99.6	0	0	0	113.6	K69 T332 M348 R352	K69-F334 HydrophobicContact CD-CE1 4.3Å; K69-F334 HydrophobicContact CG-CE1 3.89Å; K69-F334 HydrophobicContact CG-CZ 4.33Å; T332-F334 VanDerWaalsContact O-CA 3.31Å; T332-F334 WeakPolarHBondContact O-CA 3.44Å; T332-F334 PolarHBondContact O-N 2.51Å; F334-M348 HydrophobicContact CE1-CE 4.08Å; F334-M348 HydrophobicContact CE1-CG 4.46Å; F334-R352 PolarHBondContact O-NH2 3.13Å
335	F	34.8	Very low	38	Very low	82 Å²	82	100.2 Å²	100.2	36%	0.36	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-15	175	-66.5	-98.9	0	0	0	118.2	H65 N333 M348 R352	H65-F335 AromaticContact CE1-CE1 3.84Å; H65-F335 AromaticContact CE1-CZ 3.24Å; H65-F335 WeakPolarHBondContact CE1-CZ 3.18Å; H65-F335 AromaticContact NE2-CE2 3.83Å; H65-F335 AromaticContact NE2-CZ 3.31Å; H65-F335 VanDerWaalsContact NE2-CZ 3.31Å; H65-F335 WeakPolarHBondContact NE2-CZ 3.3Å; N333-F335 CarbonylContact O-C 3.53Å; N333-F335 WeakPolarHBondContact O-CA 3.31Å; N333-F335 PolarHBondContact O-N 2.81Å; F335-M348 HydrophobicContact CE1-CE 4.26Å; F335-M348 HydrophobicContact CZ-CE 3.75Å; F335-R352 VanDerWaalsContact CA-NH1 3.34Å; F335-R352 VanDerWaalsContact CA-NH2 3.33Å; F335-R352 HydrophobicContact CD1-CG 4.03Å; F335-R352 HydrophobicContact CE1-CG 3.77Å; F335-R352 PolarHBondContact O-NH1 3.38Å
336	E	31	Very low	38.2	Very low	158 Å²	158	97.9 Å²	97.9	74%	0.738	51%	0.507	S	S	*	.	S	Bend	trans	-145.7	64.3	-168.5	-65.5	-173.2	170.9	0	0	114.5	N333	N333-E336 PolarHBondContact O-N 3.47Å
337	K	26.4	Very low	38.7	Very low	174 Å²	174	98.4 Å²	98.4	76%	0.757	51%	0.511	S	S	*	.			trans	167.6	144.4	136.9	-99.6	176.2	175.6	178.3	0	109.5	T332 V339	T332-K337 HydrophobicContact CG2-CB 3.81Å; T332-K337 PolarHBondContact OG1-O 2.85Å; K337-V339 PolarHBondContact O-N 3.15Å
338	R	32.8	Very low	39.9	Very low	258 Å²	258	96.6 Å²	96.6	97%	0.974	50%	0.498	S	S	*	.			trans	-71.8	95.3	172	-70.2	179.5	179.5	178.2	-0.3	108.8
339	V	32.9	Very low	41.4	Very low	85 Å²	85	93.1 Å²	93.1	52%	0.515	48%	0.482	S	S	.	.			trans	-112.9	135.9	161.4	179.9	0	0	0	0	106.8	T332 K337 E341	T332-V339 HydrophobicContact CG2-CB 3.78Å; T332-V339 HydrophobicContact CG2-CG2 3.31Å; K337-V339 PolarHBondContact O-N 3.15Å; V339-E341 PolarHBondContact O-N 3.39Å
340	G	40.9	Very low	42.6	Very low	80 Å²	80	96.2 Å²	96.2	83%	0.825	49%	0.489	S	S	*	.			trans	-72.3	96.2	-164.7	0	0	0	0	0	111.7
341	E	36.7	Very low	43.6	Very low	85 Å²	85	97.3 Å²	97.3	40%	0.397	50%	0.495	S	S	.	.	S	Bend	trans	-146.3	144.9	166.6	-96.2	168.5	-149.7	0	0	108.2	E329 G330 V339 Q343	E329-E341 VanDerWaalsContact C-OE1 3.25Å; G330-E341 WeakPolarHBondContact CA-OE2 3.26Å; G330-E341 PolarHBondContact N-OE2 2.7Å; V339-E341 PolarHBondContact O-N 3.39Å; E341-Q343 PolarHBondContact O-N 3.23Å
342	Y	47.8	Very low	44.8	Very low	98 Å²	98	95.1 Å²	95.1	38%	0.384	48%	0.483	S	S	.	.			trans	-52.5	98.2	-158.6	-156.6	-102.4	0	0	0	113.9	W75 E79	W75-Y342 HydrophobicContact CB-CD1 4.34Å; W75-Y342 HydrophobicContact CB-CE1 3.98Å; E79-Y342 VanDerWaalsContact CD-CZ 3.49Å; E79-Y342 PolarHBondContact OE1-OH 2.78Å; E79-Y342 WeakPolarHBondContact OE2-CE1 3.43Å; E79-Y342 PolarHBondContact OE2-OH 2.87Å
343	Q	50	Low	45.9	Very low	84 Å²	84	96.4 Å²	96.4	39%	0.393	50%	0.504	S	S	.	.			trans	-137.5	120.4	175	-168.2	-178.9	13.5	0	0	109.8	A72 E341 A345	A72-Q343 HydrophobicContact CB-CG 3.93Å; E341-Q343 PolarHBondContact O-N 3.23Å; Q343-A345 PolarHBondContact O-N 2.99Å; Q343-A345 VanDerWaalsContact O-N 3.16Å
344	R	51.9	Low	46.4	Very low	128 Å²	128	95.4 Å²	95.4	48%	0.483	50%	0.495	S	S	.	.			trans	-63.6	121.7	179.3	-72	-169.3	-174.7	-173.1	3.1	110.4	A72 G346 V347	A72-R344 PolarHBondContact O-N 3.21Å; R344-G346 PolarHBondContact O-N 3.24Å; R344-V347 HydrophobicContact CB-CG2 4.41Å
345	A	55.8	Low	46.9	Very low	105 Å²	105	96.4 Å²	96.4	87%	0.868	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	136.4	-176.5	0	0	0	0	0	111.8	Q343	Q343-A345 PolarHBondContact O-N 2.99Å; Q343-A345 VanDerWaalsContact O-N 3.16Å
346	G	56.9	Low	47.6	Very low	31 Å²	31	95.6 Å²	95.6	32%	0.32	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	-27.3	172.6	0	0	0	0	0	115.9	R344 M348 S349 R350	R344-G346 PolarHBondContact O-N 3.24Å; G346-M348 PolarHBondContact O-N 3.01Å; G346-S349 WeakPolarHBondContact CA-OG 3.31Å; G346-S349 PolarHBondContact O-N 2.86Å; G346-S349 PolarHBondContact O-OG 3.17Å; G346-R350 PolarHBondContact O-N 3.32Å
347	V	57.5	Low	48.4	Very low	41 Å²	41	94.2 Å²	94.2	25%	0.248	51%	0.508	C	S	.	.	H	α-helix	trans	-61.7	-47.4	-174	-178.2	0	0	0	0	112.1	V71 A72 R344	V71-V347 HydrophobicContact CB-CG1 4.44Å; V71-V347 HydrophobicContact CG1-CG1 4.1Å; A72-V347 HydrophobicContact CB-CB 4.03Å; A72-V347 HydrophobicContact CB-CG1 3.94Å; R344-V347 HydrophobicContact CB-CG2 4.41Å
348	M	62	Low	49.2	Very low	7 Å²	7	93 Å²	93	3%	0.034	51%	0.51	C	S	.	.	H	α-helix	trans	-84.3	-26.9	-178.4	-68.4	-57.6	-71.2	0	0	114.2	H65 K68 K69 A72 F334 F335 G346 R350 A351 R352	H65-M348 VanDerWaalsContact CE1-CE 3.46Å; H65-M348 WeakPolarHBondContact CE1-CE 3.46Å; K68-M348 HydrophobicContact CB-SD 4.02Å; K69-M348 HydrophobicContact CG-CE 4.18Å; K69-M348 HydrophobicContact CG-SD 4.48Å; A72-M348 HydrophobicContact CB-CG 4.12Å; F334-M348 HydrophobicContact CE1-CE 4.08Å; F334-M348 HydrophobicContact CE1-CG 4.46Å; F335-M348 HydrophobicContact CE1-CE 4.26Å; F335-M348 HydrophobicContact CZ-CE 3.75Å; G346-M348 PolarHBondContact O-N 3.01Å; M348-R350 VanDerWaalsContact C-N 3.34Å; M348-R350 PolarHBondContact O-N 2.8Å; M348-A351 WeakPolarHBondContact O-CB 3.49Å; M348-A351 PolarHBondContact O-N 2.91Å; M348-A351 VanDerWaalsContact O-N 3.15Å; M348-R352 WeakPolarHBondContact O-CG 3.28Å; M348-R352 PolarHBondContact O-N 3.12Å; M348-R352 VanDerWaalsContact O-N 3.08Å
349	S	56.4	Low	49.8	Very low	18 Å²	18	89.6 Å²	89.6	13%	0.126	50%	0.503	C	S	.	.	H	α-helix	trans	-61.4	-41.9	179.4	63.4	0	0	0	0	112.3	G346 A351 R352 G353 E354 T356	G346-S349 WeakPolarHBondContact CA-OG 3.31Å; G346-S349 PolarHBondContact O-N 2.86Å; G346-S349 PolarHBondContact O-OG 3.17Å; S349-A351 PolarHBondContact O-N 3.21Å; S349-R352 PolarHBondContact O-N 3.22Å; S349-G353 PolarHBondContact O-N 2.85Å; S349-E354 PolarHBondContact O-N 3Å; S349-T356 VanDerWaalsContact CB-CG2 3.41Å; S349-T356 WeakPolarHBondContact OG-CG2 2.92Å; S349-T356 PolarHBondContact OG-OG1 3.19Å; S349-T356 VanDerWaalsContact OG-OG1 3.14Å
350	R	55.9	Low	50.6	Low	171 Å²	171	89.2 Å²	89.2	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-68.1	-34.8	174.9	-69.7	-173.9	-178	-176.1	2.2	112.5	G346 M348 R352 G353 H357	G346-R350 PolarHBondContact O-N 3.32Å; M348-R350 VanDerWaalsContact C-N 3.34Å; M348-R350 PolarHBondContact O-N 2.8Å; R350-R352 PolarHBondContact O-N 2.82Å; R350-G353 PolarHBondContact O-N 3.46Å; R350-G353 VanDerWaalsContact O-N 3.13Å; R350-H357 PolarHBondContact NH2-CD2 2.68Å; R350-H357 VanDerWaalsContact NH2-CD2 3.32Å; R350-H357 PolarHBondContact NH2-NE2 3.2Å
351	A	54.3	Low	51.3	Low	54 Å²	54	90.9 Å²	90.9	45%	0.446	50%	0.498	S	S	.	.	H	α-helix	trans	-66.6	-27.6	176.6	0	0	0	0	0	112.6	M348 S349	M348-A351 WeakPolarHBondContact O-CB 3.49Å; M348-A351 PolarHBondContact O-N 2.91Å; M348-A351 VanDerWaalsContact O-N 3.15Å; S349-A351 PolarHBondContact O-N 3.21Å
352	R	55.6	Low	52.1	Low	82 Å²	82	93.5 Å²	93.5	31%	0.309	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.6	173.2	-65	175	-159.7	-163.2	-5.6	114	F334 F335 M348 S349 R350 E354	F334-R352 PolarHBondContact O-NH2 3.13Å; F335-R352 VanDerWaalsContact CA-NH1 3.34Å; F335-R352 VanDerWaalsContact CA-NH2 3.33Å; F335-R352 HydrophobicContact CD1-CG 4.03Å; F335-R352 HydrophobicContact CE1-CG 3.77Å; F335-R352 PolarHBondContact O-NH1 3.38Å; M348-R352 WeakPolarHBondContact O-CG 3.28Å; M348-R352 PolarHBondContact O-N 3.12Å; M348-R352 VanDerWaalsContact O-N 3.08Å; S349-R352 PolarHBondContact O-N 3.22Å; R350-R352 PolarHBondContact O-N 2.82Å; R352-E354 HydrophobicContact CB-CG 4.37Å
353	G	51.8	Low	52.3	Low	68 Å²	68	96.6 Å²	96.6	70%	0.701	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	18	-175	0	0	0	0	0	114.6	S349 R350	S349-G353 PolarHBondContact O-N 2.85Å; R350-G353 PolarHBondContact O-N 3.46Å; R350-G353 VanDerWaalsContact O-N 3.13Å
354	E	45.4	Very low	52.3	Low	109 Å²	109	100.4 Å²	100.4	51%	0.509	56%	0.555	S	S	.	*			trans	-82.2	126.8	177.1	-69.7	173.1	-171.9	0	0	110.9	S349 R352 T356	S349-E354 PolarHBondContact O-N 3Å; R352-E354 HydrophobicContact CB-CG 4.37Å; E354-T356 PolarHBondContact O-N 3.41Å
355	S	47.1	Very low	52.3	Low	106 Å²	106	107.6 Å²	107.6	74%	0.741	59%	0.591	S	S	*	*			trans	-74.7	87.2	177.8	53.4	0	0	0	0	111
356	T	50.3	Low	52.2	Low	65 Å²	65	107.8 Å²	107.8	40%	0.399	58%	0.577	S	S	.	*			trans	-87.5	6.9	-176.5	44	0	0	0	0	115.8	S349 E354	S349-T356 VanDerWaalsContact CB-CG2 3.41Å; S349-T356 WeakPolarHBondContact OG-CG2 2.92Å; S349-T356 PolarHBondContact OG-OG1 3.19Å; S349-T356 VanDerWaalsContact OG-OG1 3.14Å; E354-T356 PolarHBondContact O-N 3.41Å
357	H	48.2	Very low	51.9	Low	129 Å²	129	111.8 Å²	111.8	60%	0.597	59%	0.591	S	S	*	*			trans	-127.5	65.9	-179.9	-59.8	-62.6	0	0	0	112.2	R350 F359	R350-H357 PolarHBondContact NH2-CD2 2.68Å; R350-H357 VanDerWaalsContact NH2-CD2 3.32Å; R350-H357 PolarHBondContact NH2-NE2 3.2Å; H357-F359 VanDerWaalsContact C-N 3.32Å; H357-F359 PolarHBondContact O-N 3.01Å
358	N	43.3	Very low	51.6	Low	150 Å²	150	115.7 Å²	115.7	80%	0.802	61%	0.61	S	S	*	*			trans	-82.6	89.7	154	-79.9	-4.9	0	0	0	107.2	S360	N358-S360 PolarHBondContact O-N 2.7Å
359	F	44.7	Very low	51	Low	185 Å²	185	122.1 Å²	122.1	81%	0.811	64%	0.643	S	S	*	*			trans	-68.4	109	168.2	-175.6	-96.7	0	0	0	107.7	H357 V361	H357-F359 VanDerWaalsContact C-N 3.32Å; H357-F359 PolarHBondContact O-N 3.01Å; F359-V361 HydrophobicContact CD1-CG1 4.43Å; F359-V361 HydrophobicContact CE1-CG1 3.64Å; F359-V361 HydrophobicContact CZ-CG1 4.16Å
360	S	49.3	Very low	50.7	Low	77 Å²	77	128.6 Å²	128.6	54%	0.538	68%	0.676	S	S	.	*			trans	-107.1	134.2	173.9	179.2	0	0	0	0	108.8	N358 D362	N358-S360 PolarHBondContact O-N 2.7Å; S360-D362 PolarHBondContact OG-N 3.47Å
361	V	57.3	Low	50.3	Low	115 Å²	115	125.8 Å²	125.8	70%	0.697	68%	0.678	S	S	*	*			trans	-101.8	2.7	178.2	-95	0	0	0	0	112.9	F359 E363	F359-V361 HydrophobicContact CD1-CG1 4.43Å; F359-V361 HydrophobicContact CE1-CG1 3.64Å; F359-V361 HydrophobicContact CZ-CG1 4.16Å; V361-E363 PolarHBondContact O-N 3.15Å
362	D	53.7	Low	50	Low	140 Å²	140	130.9 Å²	130.9	75%	0.749	69%	0.694	S	S	*	*			trans	-97.4	32	-176.7	-61.9	-32	0	0	0	112.9	S360 D364	S360-D362 PolarHBondContact OG-N 3.47Å; D362-D364 PolarHBondContact O-N 3.02Å
363	E	51.5	Low	49.6	Very low	163 Å²	163	134.7 Å²	134.7	76%	0.762	72%	0.724	S	S	*	*			trans	-84.9	101.5	167.9	-73.2	-94.8	156.7	0	0	108.1	V361 F365	V361-E363 PolarHBondContact O-N 3.15Å; E363-F365 PolarHBondContact O-N 3.17Å
364	D	49.3	Very low	49.4	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	73%	0.726	S	S	*	*			trans	-63.1	115.8	171.1	-75.4	-36.1	0	0	0	109.3	D362	D362-D364 PolarHBondContact O-N 3.02Å
365	F	52.9	Low	49.8	Very low	280 Å²	280	143.1 Å²	143.1	100%	1.228	75%	0.746	S	S	*	*			trans	-62.8	0	-179.2	-77.1	-86.1	0	0	0	114.4	E363	E363-F365 PolarHBondContact O-N 3.17Å

Retrieved 365 of 365 residues in 132.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).