A0A5K4F1Y5_SCHMA Loading...

DUF4456 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1Y5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	47	Very low	242 Å²	242	132.7 Å²	132.7	100%	1.192	68%	0.675	S	S	*	*				0	134.7	0	-75.2	169	161.1	0	0	108.4
2	N	45.6	Very low	47.1	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	67%	0.668	S	S	*	*			trans	105.3	-11.4	174.5	-70.4	-0.7	0	0	0	122.4
3	Q	44.3	Very low	47.4	Very low	184 Å²	184	130 Å²	130	86%	0.86	66%	0.663	S	S	*	*	S	Bend	trans	-97	-27	176.6	-74.6	-172.1	-4.8	0	0	115.4
4	S	44.9	Very low	47.5	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	67%	0.667	S	S	*	*	H	α-helix	trans	-73.3	-31.6	179.8	-171.5	0	0	0	0	113	N6	S4-N6 PolarHBondContact O-N 3.48Å
5	S	47.8	Very low	47.3	Very low	70 Å²	70	122.7 Å²	122.7	49%	0.49	64%	0.643	S	S	.	*	H	α-helix	trans	-68.1	-33.4	-175.9	-30.6	0	0	0	0	113.6
6	N	47.1	Very low	47.1	Very low	110 Å²	110	126.6 Å²	126.6	59%	0.588	65%	0.653	S	S	*	*	H	α-helix	trans	-78.2	-26	-176.4	-79.5	-5.4	0	0	0	113.2	S4 Q9 S10	S4-N6 PolarHBondContact O-N 3.48Å; N6-Q9 PolarHBondContact O-N 3.3Å; N6-S10 PolarHBondContact O-N 3.07Å
7	K	50	Low	47.4	Very low	151 Å²	151	125.1 Å²	125.1	66%	0.657	66%	0.656	S	S	*	*	H	α-helix	trans	-74.2	-34.5	179.3	-149.4	174.1	-176.7	-177.7	0	112	Q9 S10	K7-Q9 VanDerWaalsContact C-N 3.34Å; K7-Q9 PolarHBondContact O-N 3.35Å; K7-S10 PolarHBondContact O-N 3.44Å; K7-S10 PolarHBondContact O-OG 3.33Å; K7-S10 VanDerWaalsContact O-OG 3.09Å
8	R	48.7	Very low	47.4	Very low	135 Å²	135	123.8 Å²	123.8	51%	0.509	65%	0.65	S	S	.	*	H	α-helix	trans	-71	-25.3	174.6	-70.3	-173	178.5	-178	0.6	113.1	E36	R8-E36 IonicContact NH2-OE1 3.09Å; R8-E36 PolarHBondContact NH2-OE1 3.41Å
9	Q	51.9	Low	47.5	Very low	138 Å²	138	121.2 Å²	121.2	65%	0.645	66%	0.656	S	S	*	*	H	α-helix	trans	-77.8	-31.2	175.4	-82	-174.5	-15.6	0	0	113.7	N6 K7	N6-Q9 PolarHBondContact O-N 3.3Å; K7-Q9 VanDerWaalsContact C-N 3.34Å; K7-Q9 PolarHBondContact O-N 3.35Å
10	S	49.9	Very low	47.6	Very low	79 Å²	79	124.6 Å²	124.6	55%	0.552	66%	0.664	S	S	*	*	H	α-helix	trans	-72.2	-29.9	178.1	64.9	0	0	0	0	113	N6 K7 A13	N6-S10 PolarHBondContact O-N 3.07Å; K7-S10 PolarHBondContact O-N 3.44Å; K7-S10 PolarHBondContact O-OG 3.33Å; K7-S10 VanDerWaalsContact O-OG 3.09Å; S10-A13 PolarHBondContact O-N 2.97Å
11	E	48.3	Very low	47.5	Very low	130 Å²	130	121 Å²	121	61%	0.607	65%	0.649	S	S	*	*	H	α-helix	trans	-74.4	-31.9	177.2	-72.1	175	174.8	0	0	112.3	A13 C14	E11-A13 PolarHBondContact O-N 3.1Å; E11-C14 PolarHBondContact O-N 3.42Å
12	R	48.3	Very low	47.9	Very low	157 Å²	157	111.3 Å²	111.3	59%	0.592	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-19.5	173.8	-82	-177.6	176.1	-172.1	-2.3	114.3	E29	R12-E29 IonicContact CZ-OE2 3.19Å; R12-E29 IonicContact NE-OE1 2.67Å; R12-E29 IonicContact NE-OE2 3.3Å; R12-E29 IonicContact NH2-OE1 2.75Å; R12-E29 IonicContact NH2-OE2 3.46Å; R12-E29 PolarHBondContact NH2-OE2 3.39Å
13	A	51	Low	48.1	Very low	73 Å²	73	106.7 Å²	106.7	60%	0.603	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-21.6	178.1	0	0	0	0	0	113.1	S10 E11	S10-A13 PolarHBondContact O-N 2.97Å; E11-A13 PolarHBondContact O-N 3.1Å
14	C	48.1	Very low	48.2	Very low	105 Å²	105	106.8 Å²	106.8	71%	0.709	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-15.4	-171.8	-151	0	0	0	0	113.8	E11	E11-C14 PolarHBondContact O-N 3.42Å
15	C	45.1	Very low	48.3	Very low	45 Å²	45	108 Å²	108	30%	0.304	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.9	22.6	-172.7	-63	0	0	0	0	115.2	S17	C15-S17 VanDerWaalsContact C-N 3.28Å; C15-S17 PolarHBondContact O-N 3.2Å
16	K	44.3	Very low	48.9	Very low	185 Å²	185	110 Å²	110	80%	0.804	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-0.5	179	-75.4	-172.4	177.3	180	0	115.1
17	S	51.5	Low	49.7	Very low	102 Å²	102	109.3 Å²	109.3	71%	0.713	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-9.8	-170.7	54	0	0	0	0	115.8	C15	C15-S17 VanDerWaalsContact C-N 3.28Å; C15-S17 PolarHBondContact O-N 3.2Å
18	D	48.5	Very low	50	Low	101 Å²	101	106.5 Å²	106.5	54%	0.54	56%	0.564	S	S	.	*			trans	-144.6	109.6	176.4	-82.6	-45.8	0	0	0	110.5	K20 S21 A22	D18-K20 PolarHBondContact O-N 3.41Å; D18-S21 WeakPolarHBondContact CB-OG 3.43Å; D18-S21 WeakPolarHBondContact O-CA 3.5Å; D18-S21 WeakPolarHBondContact O-CB 3.48Å; D18-S21 PolarHBondContact O-N 3.32Å; D18-A22 PolarHBondContact O-N 3.15Å
19	G	47.6	Very low	50.6	Low	74 Å²	74	103 Å²	103	76%	0.763	55%	0.553	S	S	*	*	H	α-helix	trans	-57.6	-20.6	-176.5	0	0	0	0	0	114.9
20	K	50.1	Low	51.5	Low	189 Å²	189	103.7 Å²	103.7	82%	0.822	55%	0.55	S	S	*	.	H	α-helix	trans	-76.4	-31.3	172.4	-74.4	-178.5	178.2	175.8	0	113	D18 R24	D18-K20 PolarHBondContact O-N 3.41Å; K20-R24 PolarHBondContact O-N 3.24Å
21	S	45.3	Very low	52.4	Low	50 Å²	50	105.4 Å²	105.4	35%	0.35	55%	0.547	S	S	.	.	H	α-helix	trans	-75.9	-40.7	179.8	-45.9	0	0	0	0	110.9	D18 G23 R24 F25	D18-S21 WeakPolarHBondContact CB-OG 3.43Å; D18-S21 WeakPolarHBondContact O-CA 3.5Å; D18-S21 WeakPolarHBondContact O-CB 3.48Å; D18-S21 PolarHBondContact O-N 3.32Å; S21-G23 PolarHBondContact O-N 2.91Å; S21-R24 PolarHBondContact O-N 3.47Å; S21-F25 PolarHBondContact O-N 2.93Å
22	A	47	Very low	53.2	Low	38 Å²	38	102.9 Å²	102.9	31%	0.314	54%	0.537	S	S	.	.	H	α-helix	trans	-58.9	-45.4	175.8	0	0	0	0	0	111.9	D18 R24 F25 E26	D18-A22 PolarHBondContact O-N 3.15Å; A22-R24 VanDerWaalsContact C-N 3.33Å; A22-R24 PolarHBondContact O-N 2.92Å; A22-F25 PolarHBondContact O-N 3.33Å; A22-E26 PolarHBondContact O-N 3.31Å
23	G	49.8	Very low	54.1	Low	35 Å²	35	101.6 Å²	101.6	36%	0.361	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-34.3	177.6	0	0	0	0	0	113.9	S21 E27	S21-G23 PolarHBondContact O-N 2.91Å; G23-E27 PolarHBondContact O-N 3.32Å; G23-E27 VanDerWaalsContact O-N 3.11Å
24	R	46.6	Very low	55.1	Low	186 Å²	186	105 Å²	105	70%	0.702	54%	0.539	S	S	*	.	H	α-helix	trans	-69.7	-39.4	174.9	-78.6	-176.7	168.6	-174.9	-3.1	112.3	K20 S21 A22 E27 I28	K20-R24 PolarHBondContact O-N 3.24Å; S21-R24 PolarHBondContact O-N 3.47Å; A22-R24 VanDerWaalsContact C-N 3.33Å; A22-R24 PolarHBondContact O-N 2.92Å; R24-E27 PolarHBondContact O-N 2.98Å; R24-I28 VanDerWaalsContact O-CG1 3.32Å; R24-I28 WeakPolarHBondContact O-CG1 3.32Å; R24-I28 PolarHBondContact O-N 3.29Å
25	F	48.3	Very low	55.8	Low	114 Å²	114	104.7 Å²	104.7	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-63.1	-45.1	174.9	-101.5	-85.8	0	0	0	111.7	S21 A22 E27 I28 E29	S21-F25 PolarHBondContact O-N 2.93Å; A22-F25 PolarHBondContact O-N 3.33Å; F25-E27 VanDerWaalsContact C-N 3.27Å; F25-E27 PolarHBondContact O-N 3.02Å; F25-I28 PolarHBondContact O-N 3.01Å; F25-I28 VanDerWaalsContact O-N 3.16Å; F25-E29 PolarHBondContact O-N 3.44Å
26	E	59.6	Low	56.7	Low	113 Å²	113	106.9 Å²	106.9	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-31.9	175.2	-76	-177.9	175.5	0	0	113.2	A22 R30	A22-E26 PolarHBondContact O-N 3.31Å; E26-R30 WeakPolarHBondContact O-CB 3.34Å; E26-R30 WeakPolarHBondContact O-CG 3.4Å; E26-R30 PolarHBondContact O-N 2.94Å; E26-R30 PolarHBondContact O-NE 3.13Å
27	E	62.7	Low	57.9	Low	95 Å²	95	104.9 Å²	104.9	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-70.7	-39.3	174.2	-163.8	-168.9	149.9	0	0	111.8	G23 R24 F25 K31	G23-E27 PolarHBondContact O-N 3.32Å; G23-E27 VanDerWaalsContact O-N 3.11Å; R24-E27 PolarHBondContact O-N 2.98Å; F25-E27 VanDerWaalsContact C-N 3.27Å; F25-E27 PolarHBondContact O-N 3.02Å; E27-K31 WeakPolarHBondContact O-CG 3.17Å; E27-K31 PolarHBondContact O-N 2.8Å; E27-K31 VanDerWaalsContact O-N 3.14Å; E27-K31 VanDerWaalsContact OE1-CE 3.32Å; E27-K31 WeakPolarHBondContact OE1-CE 3.27Å; E27-K31 IonicContact OE1-NZ 3.64Å; E27-K31 PolarHBondContact OE1-NZ 3.25Å
28	I	56.9	Low	58.8	Low	92 Å²	92	107.4 Å²	107.4	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-67.9	-45.6	177.1	-68.1	166.7	0	0	0	110.6	R24 F25 R30 K31 I32	R24-I28 VanDerWaalsContact O-CG1 3.32Å; R24-I28 WeakPolarHBondContact O-CG1 3.32Å; R24-I28 PolarHBondContact O-N 3.29Å; F25-I28 PolarHBondContact O-N 3.01Å; F25-I28 VanDerWaalsContact O-N 3.16Å; I28-R30 VanDerWaalsContact C-N 3.32Å; I28-R30 PolarHBondContact O-N 3.09Å; I28-K31 PolarHBondContact O-N 3.13Å; I28-I32 HydrophobicContact CG2-CD1 3.98Å; I28-I32 HydrophobicContact CG2-CG1 4.47Å; I28-I32 WeakPolarHBondContact O-CG1 3.15Å; I28-I32 PolarHBondContact O-N 3.27Å
29	E	62.4	Low	59.3	Low	62 Å²	62	107.8 Å²	107.8	29%	0.29	53%	0.528	S	S	.	.	H	α-helix	trans	-56.8	-45.1	176.1	-76.1	-173.6	160.5	0	0	111.2	R12 F25 K31 I32 E33	R12-E29 IonicContact CZ-OE2 3.19Å; R12-E29 IonicContact NE-OE1 2.67Å; R12-E29 IonicContact NE-OE2 3.3Å; R12-E29 IonicContact NH2-OE1 2.75Å; R12-E29 IonicContact NH2-OE2 3.46Å; R12-E29 PolarHBondContact NH2-OE2 3.39Å; F25-E29 PolarHBondContact O-N 3.44Å; E29-K31 VanDerWaalsContact C-N 3.29Å; E29-K31 PolarHBondContact O-N 3.12Å; E29-I32 PolarHBondContact O-N 2.97Å; E29-E33 PolarHBondContact O-N 3.35Å
30	R	69.5	Low	60.1	Low	152 Å²	152	107.4 Å²	107.4	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-30.4	175.6	-81.9	-173.9	-79.9	170.8	-10.9	113.8	E26 I28 K34	E26-R30 WeakPolarHBondContact O-CB 3.34Å; E26-R30 WeakPolarHBondContact O-CG 3.4Å; E26-R30 PolarHBondContact O-N 2.94Å; E26-R30 PolarHBondContact O-NE 3.13Å; I28-R30 VanDerWaalsContact C-N 3.32Å; I28-R30 PolarHBondContact O-N 3.09Å; R30-K34 WeakPolarHBondContact O-CG 3.27Å; R30-K34 PolarHBondContact O-N 3.11Å
31	K	69	Low	60.8	Low	115 Å²	115	105.3 Å²	105.3	50%	0.5	51%	0.505	S	S	.	.	H	α-helix	trans	-74.2	-40.4	175.2	-75.9	175.4	-173.8	165.9	0	111.4	E27 I28 E29 K34 I35	E27-K31 WeakPolarHBondContact O-CG 3.17Å; E27-K31 PolarHBondContact O-N 2.8Å; E27-K31 VanDerWaalsContact O-N 3.14Å; E27-K31 VanDerWaalsContact OE1-CE 3.32Å; E27-K31 WeakPolarHBondContact OE1-CE 3.27Å; E27-K31 IonicContact OE1-NZ 3.64Å; E27-K31 PolarHBondContact OE1-NZ 3.25Å; I28-K31 PolarHBondContact O-N 3.13Å; E29-K31 VanDerWaalsContact C-N 3.29Å; E29-K31 PolarHBondContact O-N 3.12Å; K31-K34 PolarHBondContact O-N 2.53Å; K31-I35 WeakPolarHBondContact O-CG1 3.41Å; K31-I35 PolarHBondContact O-N 3Å; K31-I35 VanDerWaalsContact O-N 3.13Å
32	I	65	Low	61.4	Low	77 Å²	77	109.4 Å²	109.4	40%	0.395	52%	0.519	S	S	.	.	H	α-helix	trans	-61.6	-47.6	175.6	-67.8	170	0	0	0	110.1	I28 E29 K34 I35 E36	I28-I32 HydrophobicContact CG2-CD1 3.98Å; I28-I32 HydrophobicContact CG2-CG1 4.47Å; I28-I32 WeakPolarHBondContact O-CG1 3.15Å; I28-I32 PolarHBondContact O-N 3.27Å; E29-I32 PolarHBondContact O-N 2.97Å; I32-K34 VanDerWaalsContact C-N 3.31Å; I32-K34 PolarHBondContact O-N 2.78Å; I32-I35 PolarHBondContact O-N 3.36Å; I32-E36 HydrophobicContact CG2-CG 4.25Å; I32-E36 PolarHBondContact O-N 3.45Å
33	E	67.4	Low	61.8	Low	131 Å²	131	111 Å²	111	61%	0.612	53%	0.527	S	S	*	.	H	α-helix	trans	-59.4	-40.7	-179.9	-163.1	170.1	-154.2	0	0	111.9	E29 I35 E36 E37	E29-E33 PolarHBondContact O-N 3.35Å; E33-I35 VanDerWaalsContact C-N 3.35Å; E33-I35 PolarHBondContact O-N 3.04Å; E33-E36 PolarHBondContact O-N 2.99Å; E33-E37 WeakPolarHBondContact O-CB 3.39Å; E33-E37 PolarHBondContact O-N 3.32Å
34	K	71.4	Confident	62.5	Low	143 Å²	143	114 Å²	114	62%	0.622	54%	0.535	S	S	*	.	H	α-helix	trans	-65.9	-31	173.2	-78.4	-177.6	177.9	-177	0	114.3	R30 K31 I32 K38	R30-K34 WeakPolarHBondContact O-CG 3.27Å; R30-K34 PolarHBondContact O-N 3.11Å; K31-K34 PolarHBondContact O-N 2.53Å; I32-K34 VanDerWaalsContact C-N 3.31Å; I32-K34 PolarHBondContact O-N 2.78Å; K34-K38 WeakPolarHBondContact O-CG 3.48Å; K34-K38 PolarHBondContact O-N 3.43Å
35	I	63.8	Low	63.4	Low	99 Å²	99	111.5 Å²	111.5	51%	0.508	53%	0.529	S	S	.	.	H	α-helix	trans	-75.8	-43.6	177.1	-69	166.6	0	0	0	109.7	K31 I32 E33 E37 K38 L39	K31-I35 WeakPolarHBondContact O-CG1 3.41Å; K31-I35 PolarHBondContact O-N 3Å; K31-I35 VanDerWaalsContact O-N 3.13Å; I32-I35 PolarHBondContact O-N 3.36Å; E33-I35 VanDerWaalsContact C-N 3.35Å; E33-I35 PolarHBondContact O-N 3.04Å; I35-E37 VanDerWaalsContact C-N 3.31Å; I35-E37 PolarHBondContact O-N 3.07Å; I35-K38 PolarHBondContact O-N 2.9Å; I35-L39 HydrophobicContact CG2-CD1 3.93Å; I35-L39 HydrophobicContact CG2-CG 4.45Å; I35-L39 WeakPolarHBondContact O-CG 3.35Å; I35-L39 PolarHBondContact O-N 3.4Å
36	E	64.7	Low	63.6	Low	92 Å²	92	112.8 Å²	112.8	43%	0.43	54%	0.537	S	S	.	.	H	α-helix	trans	-58.4	-42.7	174.2	-71.2	178	169	0	0	110.9	R8 I32 E33 L39 S40	R8-E36 IonicContact NH2-OE1 3.09Å; R8-E36 PolarHBondContact NH2-OE1 3.41Å; I32-E36 HydrophobicContact CG2-CG 4.25Å; I32-E36 PolarHBondContact O-N 3.45Å; E33-E36 PolarHBondContact O-N 2.99Å; E36-L39 PolarHBondContact O-N 3.1Å; E36-S40 WeakPolarHBondContact O-CB 3.46Å; E36-S40 PolarHBondContact O-N 3.03Å
37	E	69.6	Low	63.8	Low	142 Å²	142	111 Å²	111	66%	0.664	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-40.4	176.6	-163	177.7	-159.8	0	0	112.5	E33 I35 S40 F41	E33-E37 WeakPolarHBondContact O-CB 3.39Å; E33-E37 PolarHBondContact O-N 3.32Å; I35-E37 VanDerWaalsContact C-N 3.31Å; I35-E37 PolarHBondContact O-N 3.07Å; E37-S40 PolarHBondContact O-N 3.41Å; E37-F41 WeakPolarHBondContact O-CB 3.46Å; E37-F41 PolarHBondContact O-N 3.33Å
38	K	68.8	Low	63.6	Low	156 Å²	156	113 Å²	113	68%	0.678	54%	0.543	S	S	*	.	H	α-helix	trans	-66.3	-42.8	174.5	-80	-177.9	178	-174.6	0	112.9	K34 I35 S40 F41 E42	K34-K38 WeakPolarHBondContact O-CG 3.48Å; K34-K38 PolarHBondContact O-N 3.43Å; I35-K38 PolarHBondContact O-N 2.9Å; K38-S40 VanDerWaalsContact C-N 3.35Å; K38-F41 PolarHBondContact O-N 3.34Å; K38-E42 PolarHBondContact O-N 3.15Å
39	L	59	Low	63.4	Low	109 Å²	109	112.7 Å²	112.7	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-63.5	-41.6	176.7	-76.6	167.3	0	0	0	111.2	I35 E36 F41 E42 S43	I35-L39 HydrophobicContact CG2-CD1 3.93Å; I35-L39 HydrophobicContact CG2-CG 4.45Å; I35-L39 WeakPolarHBondContact O-CG 3.35Å; I35-L39 PolarHBondContact O-N 3.4Å; E36-L39 PolarHBondContact O-N 3.1Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.3Å; L39-E42 PolarHBondContact O-N 3.44Å; L39-S43 WeakPolarHBondContact O-CB 3.49Å; L39-S43 PolarHBondContact O-N 2.89Å
40	S	65.3	Low	63	Low	66 Å²	66	113.9 Å²	113.9	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-60.5	-40.7	172.9	179.1	0	0	0	0	112	E36 E37 K38 N44	E36-S40 WeakPolarHBondContact O-CB 3.46Å; E36-S40 PolarHBondContact O-N 3.03Å; E37-S40 PolarHBondContact O-N 3.41Å; K38-S40 VanDerWaalsContact C-N 3.35Å; S40-N44 VanDerWaalsContact O-CG 3.27Å; S40-N44 PolarHBondContact O-N 3.28Å; S40-N44 VanDerWaalsContact O-N 3.16Å; S40-N44 PolarHBondContact O-ND2 3.05Å
41	F	64.1	Low	62.6	Low	144 Å²	144	111.3 Å²	111.3	63%	0.632	55%	0.548	S	S	*	.	H	α-helix	trans	-68.2	-42.6	179.5	-175	-95.5	0	0	0	112.5	E37 K38 L39 N44 K45	E37-F41 WeakPolarHBondContact O-CB 3.46Å; E37-F41 PolarHBondContact O-N 3.33Å; K38-F41 PolarHBondContact O-N 3.34Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.3Å; F41-N44 PolarHBondContact O-N 3.44Å; F41-K45 PolarHBondContact O-N 3.21Å; F41-K45 VanDerWaalsContact O-N 3.11Å
42	E	58.5	Low	61.8	Low	137 Å²	137	109.5 Å²	109.5	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-67.8	-39.1	176.8	-75.5	-162.9	160.9	0	0	112.7	K38 L39 N44 K45 Q46	K38-E42 PolarHBondContact O-N 3.15Å; L39-E42 PolarHBondContact O-N 3.44Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.39Å; E42-K45 PolarHBondContact O-N 3.17Å; E42-K45 VanDerWaalsContact O-N 3.16Å; E42-Q46 PolarHBondContact O-N 3.24Å
43	S	56.6	Low	60.8	Low	70 Å²	70	111 Å²	111	49%	0.49	56%	0.555	S	S	.	*	H	α-helix	trans	-59.6	-42.6	174.9	-175.4	0	0	0	0	111.9	L39 K45 Q46 T47	L39-S43 WeakPolarHBondContact O-CB 3.49Å; L39-S43 PolarHBondContact O-N 2.89Å; S43-K45 PolarHBondContact O-N 3.44Å; S43-Q46 PolarHBondContact O-N 3.21Å; S43-T47 PolarHBondContact O-N 3.29Å; S43-T47 VanDerWaalsContact O-N 3.09Å; S43-T47 PolarHBondContact O-OG1 3.22Å
44	N	63.9	Low	60.4	Low	99 Å²	99	112 Å²	112	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-38.1	175.2	-74.1	-17.1	0	0	0	112.6	S40 F41 E42 T47 E48	S40-N44 VanDerWaalsContact O-CG 3.27Å; S40-N44 PolarHBondContact O-N 3.28Å; S40-N44 VanDerWaalsContact O-N 3.16Å; S40-N44 PolarHBondContact O-ND2 3.05Å; F41-N44 PolarHBondContact O-N 3.44Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.39Å; N44-T47 VanDerWaalsContact CA-OG1 3.25Å; N44-T47 WeakPolarHBondContact CA-OG1 3.49Å; N44-T47 PolarHBondContact O-N 3.37Å; N44-T47 PolarHBondContact O-OG1 3.02Å; N44-E48 PolarHBondContact O-N 3.38Å; N44-E48 VanDerWaalsContact O-N 3.11Å
45	K	64.5	Low	59.9	Low	133 Å²	133	111.4 Å²	111.4	58%	0.578	55%	0.551	S	S	*	*	H	α-helix	trans	-68.2	-38.8	177.3	-166.5	177.9	-177.8	-179.6	0	111.9	F41 E42 S43 E48 T49	F41-K45 PolarHBondContact O-N 3.21Å; F41-K45 VanDerWaalsContact O-N 3.11Å; E42-K45 PolarHBondContact O-N 3.17Å; E42-K45 VanDerWaalsContact O-N 3.16Å; S43-K45 PolarHBondContact O-N 3.44Å; K45-E48 PolarHBondContact O-N 3.49Å; K45-T49 PolarHBondContact O-N 3.38Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 3.35Å
46	Q	52.8	Low	59.1	Low	142 Å²	142	111.3 Å²	111.3	66%	0.664	55%	0.551	S	S	*	*	H	α-helix	trans	-63.5	-43.7	176.8	-167.8	173	0.2	0	0	111.2	E42 S43 E48 T49 E50	E42-Q46 PolarHBondContact O-N 3.24Å; S43-Q46 PolarHBondContact O-N 3.21Å; Q46-E48 VanDerWaalsContact C-N 3.33Å; Q46-E48 PolarHBondContact O-N 2.95Å; Q46-T49 WeakPolarHBondContact CA-OG1 3.46Å; Q46-T49 PolarHBondContact O-N 3.11Å; Q46-T49 PolarHBondContact O-OG1 3.43Å; Q46-E50 PolarHBondContact O-N 2.93Å
47	T	64.1	Low	58.4	Low	74 Å²	74	111.6 Å²	111.6	45%	0.454	55%	0.554	S	S	.	*	H	α-helix	trans	-61.4	-39	174.7	19.6	0	0	0	0	112.1	S43 N44 E50 L51	S43-T47 PolarHBondContact O-N 3.29Å; S43-T47 VanDerWaalsContact O-N 3.09Å; S43-T47 PolarHBondContact O-OG1 3.22Å; N44-T47 VanDerWaalsContact CA-OG1 3.25Å; N44-T47 WeakPolarHBondContact CA-OG1 3.49Å; N44-T47 PolarHBondContact O-N 3.37Å; N44-T47 PolarHBondContact O-OG1 3.02Å; T47-E50 PolarHBondContact O-N 3.48Å; T47-L51 VanDerWaalsContact O-CB 3.29Å; T47-L51 WeakPolarHBondContact O-CB 3.44Å; T47-L51 PolarHBondContact O-N 3.5Å
48	E	59.2	Low	57.8	Low	138 Å²	138	109.6 Å²	109.6	65%	0.645	55%	0.548	S	S	*	.	H	α-helix	trans	-66	-41.1	177.3	-160.6	175.5	-160.6	0	0	112.7	N44 K45 Q46 L51 T52	N44-E48 PolarHBondContact O-N 3.38Å; N44-E48 VanDerWaalsContact O-N 3.11Å; K45-E48 PolarHBondContact O-N 3.49Å; Q46-E48 VanDerWaalsContact C-N 3.33Å; Q46-E48 PolarHBondContact O-N 2.95Å; E48-L51 PolarHBondContact O-N 3.22Å; E48-T52 PolarHBondContact O-N 2.86Å; E48-T52 PolarHBondContact O-OG1 3.46Å
49	T	52.9	Low	56.8	Low	85 Å²	85	108 Å²	108	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-40.7	172.8	28.7	0	0	0	0	113	K45 Q46 L51 T52 L53	K45-T49 PolarHBondContact O-N 3.38Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 3.35Å; Q46-T49 WeakPolarHBondContact CA-OG1 3.46Å; Q46-T49 PolarHBondContact O-N 3.11Å; Q46-T49 PolarHBondContact O-OG1 3.43Å; T49-L51 VanDerWaalsContact C-N 3.35Å; T49-T52 PolarHBondContact O-N 3.34Å; T49-L53 PolarHBondContact O-N 3.03Å
50	E	52.7	Low	56	Low	87 Å²	87	106.2 Å²	106.2	41%	0.407	54%	0.536	S	S	.	.	H	α-helix	trans	-64.6	-41.8	177.2	-164.7	-171.4	151.9	0	0	111	Q46 T47 T52 L53 R54	Q46-E50 PolarHBondContact O-N 2.93Å; T47-E50 PolarHBondContact O-N 3.48Å; E50-T52 VanDerWaalsContact C-N 3.27Å; E50-T52 PolarHBondContact O-N 3.3Å; E50-L53 PolarHBondContact O-N 3.33Å; E50-R54 WeakPolarHBondContact O-CG 3.34Å; E50-R54 PolarHBondContact O-N 3.01Å; E50-R54 IonicContact OE1-CZ 3.4Å; E50-R54 IonicContact OE1-NE 3.2Å; E50-R54 PolarHBondContact OE1-NE 2.98Å; E50-R54 IonicContact OE1-NH2 2.77Å; E50-R54 PolarHBondContact OE1-NH2 3.48Å
51	L	61.7	Low	55.4	Low	99 Å²	99	108.6 Å²	108.6	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-32.4	177.8	-151.8	137.1	0	0	0	111.9	T47 E48 T49 K55	T47-L51 VanDerWaalsContact O-CB 3.29Å; T47-L51 WeakPolarHBondContact O-CB 3.44Å; T47-L51 PolarHBondContact O-N 3.5Å; E48-L51 PolarHBondContact O-N 3.22Å; T49-L51 VanDerWaalsContact C-N 3.35Å; L51-K55 HydrophobicContact CD2-CD 4.4Å; L51-K55 WeakPolarHBondContact O-CG 3.43Å; L51-K55 PolarHBondContact O-N 3.06Å
52	T	52.3	Low	54.8	Low	77 Å²	77	107.2 Å²	107.2	47%	0.472	54%	0.539	S	S	.	.	H	α-helix	trans	-70.3	-41.9	173.2	-53.1	0	0	0	0	111.9	E48 T49 E50 K55 L56	E48-T52 PolarHBondContact O-N 2.86Å; E48-T52 PolarHBondContact O-OG1 3.46Å; T49-T52 PolarHBondContact O-N 3.34Å; E50-T52 VanDerWaalsContact C-N 3.27Å; E50-T52 PolarHBondContact O-N 3.3Å; T52-K55 PolarHBondContact O-N 3.35Å; T52-L56 PolarHBondContact O-N 3.36Å
53	L	44.7	Very low	54	Low	107 Å²	107	106.3 Å²	106.3	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-64.3	-42.7	175.4	-81.9	162.9	0	0	0	111.9	T49 E50 K55 L56 I57	T49-L53 PolarHBondContact O-N 3.03Å; E50-L53 PolarHBondContact O-N 3.33Å; L53-K55 PolarHBondContact O-N 3.26Å; L53-L56 WeakPolarHBondContact O-CB 3.42Å; L53-L56 PolarHBondContact O-N 2.92Å; L53-I57 WeakPolarHBondContact O-CG1 3.42Å; L53-I57 PolarHBondContact O-N 3.13Å
54	R	57.4	Low	53.4	Low	154 Å²	154	109.7 Å²	109.7	58%	0.581	54%	0.542	S	S	*	.	H	α-helix	trans	-59.7	-45.8	175.5	-73.5	-179.9	-175.7	-139	5.4	112	E50 L56 I57 D58	E50-R54 WeakPolarHBondContact O-CG 3.34Å; E50-R54 PolarHBondContact O-N 3.01Å; E50-R54 IonicContact OE1-CZ 3.4Å; E50-R54 IonicContact OE1-NE 3.2Å; E50-R54 PolarHBondContact OE1-NE 2.98Å; E50-R54 IonicContact OE1-NH2 2.77Å; E50-R54 PolarHBondContact OE1-NH2 3.48Å; R54-L56 VanDerWaalsContact C-N 3.28Å; R54-L56 PolarHBondContact O-N 2.95Å; R54-I57 PolarHBondContact O-N 3.35Å; R54-I57 VanDerWaalsContact O-N 3.11Å; R54-D58 PolarHBondContact O-N 3.17Å
55	K	62.5	Low	52.4	Low	130 Å²	130	110 Å²	110	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-58.2	-37.4	175	-76.5	175.5	178.2	174.3	0	113.2	L51 T52 L53 Q59	L51-K55 HydrophobicContact CD2-CD 4.4Å; L51-K55 WeakPolarHBondContact O-CG 3.43Å; L51-K55 PolarHBondContact O-N 3.06Å; T52-K55 PolarHBondContact O-N 3.35Å; L53-K55 PolarHBondContact O-N 3.26Å; K55-Q59 WeakPolarHBondContact O-CG 3.34Å; K55-Q59 PolarHBondContact O-N 3.47Å
56	L	46.3	Very low	51.3	Low	97 Å²	97	108.2 Å²	108.2	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-69.1	-39.5	176	-81.3	164	0	0	0	111.9	T52 L53 R54 Q59 V60	T52-L56 PolarHBondContact O-N 3.36Å; L53-L56 WeakPolarHBondContact O-CB 3.42Å; L53-L56 PolarHBondContact O-N 2.92Å; R54-L56 VanDerWaalsContact C-N 3.28Å; R54-L56 PolarHBondContact O-N 2.95Å; L56-Q59 PolarHBondContact O-N 3.49Å; L56-V60 WeakPolarHBondContact O-CG2 3.35Å; L56-V60 PolarHBondContact O-N 3.26Å; L56-V60 VanDerWaalsContact O-N 3.13Å
57	I	50.4	Low	50.5	Low	98 Å²	98	103.8 Å²	103.8	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-46.6	175.5	-67.7	166.3	0	0	0	110.4	L53 R54 Q59 V60 E61	L53-I57 WeakPolarHBondContact O-CG1 3.42Å; L53-I57 PolarHBondContact O-N 3.13Å; R54-I57 PolarHBondContact O-N 3.35Å; R54-I57 VanDerWaalsContact O-N 3.11Å; I57-Q59 VanDerWaalsContact C-N 3.3Å; I57-Q59 PolarHBondContact O-N 2.98Å; I57-V60 WeakPolarHBondContact O-CA 3.45Å; I57-V60 WeakPolarHBondContact O-CB 3.18Å; I57-V60 PolarHBondContact O-N 3.3Å; I57-E61 PolarHBondContact O-N 3.41Å
58	D	56.5	Low	49.3	Very low	100 Å²	100	103.2 Å²	103.2	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-39.8	178	-65.6	-19.1	0	0	0	112	R54 V60 E61 L62	R54-D58 PolarHBondContact O-N 3.17Å; D58-V60 VanDerWaalsContact C-N 3.34Å; D58-V60 PolarHBondContact O-N 3.36Å; D58-E61 PolarHBondContact O-N 3.26Å; D58-L62 WeakPolarHBondContact O-CB 3.29Å; D58-L62 PolarHBondContact O-N 3.05Å
59	Q	47.9	Very low	48.4	Very low	122 Å²	122	100.4 Å²	100.4	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-40.2	174	-78.1	-176.3	-3.2	0	0	112.2	K55 L56 I57 L62 M63	K55-Q59 WeakPolarHBondContact O-CG 3.34Å; K55-Q59 PolarHBondContact O-N 3.47Å; L56-Q59 PolarHBondContact O-N 3.49Å; I57-Q59 VanDerWaalsContact C-N 3.3Å; I57-Q59 PolarHBondContact O-N 2.98Å; Q59-L62 PolarHBondContact O-N 3.3Å; Q59-M63 WeakPolarHBondContact O-CE 3.29Å; Q59-M63 WeakPolarHBondContact O-CG 3.47Å; Q59-M63 PolarHBondContact O-N 2.99Å; Q59-M63 VanDerWaalsContact O-N 3.08Å
60	V	41.3	Very low	47.5	Very low	71 Å²	71	102.7 Å²	102.7	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-40.4	177	171.7	0	0	0	0	111.2	L56 I57 D58 M63 K64	L56-V60 WeakPolarHBondContact O-CG2 3.35Å; L56-V60 PolarHBondContact O-N 3.26Å; L56-V60 VanDerWaalsContact O-N 3.13Å; I57-V60 WeakPolarHBondContact O-CA 3.45Å; I57-V60 WeakPolarHBondContact O-CB 3.18Å; I57-V60 PolarHBondContact O-N 3.3Å; D58-V60 VanDerWaalsContact C-N 3.34Å; D58-V60 PolarHBondContact O-N 3.36Å; V60-M63 HydrophobicContact CG2-CE 4.2Å; V60-M63 PolarHBondContact O-N 3.07Å; V60-K64 WeakPolarHBondContact O-CG 3.42Å; V60-K64 PolarHBondContact O-N 3.27Å
61	E	52.8	Low	46.6	Very low	117 Å²	117	103.7 Å²	103.7	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-42.9	175.5	-69.5	-159.5	157.8	0	0	112.7	I57 D58 M63 K64 L65	I57-E61 PolarHBondContact O-N 3.41Å; D58-E61 PolarHBondContact O-N 3.26Å; E61-M63 VanDerWaalsContact C-N 3.28Å; E61-M63 PolarHBondContact O-N 3.49Å; E61-K64 WeakPolarHBondContact O-CB 3.33Å; E61-K64 PolarHBondContact O-N 3.04Å; E61-K64 VanDerWaalsContact O-N 3.11Å; E61-L65 PolarHBondContact O-N 3.46Å
62	L	53	Low	45.4	Very low	114 Å²	114	106.2 Å²	106.2	60%	0.597	54%	0.539	S	S	*	.	H	α-helix	trans	-59.3	-40.9	175.8	-164	81	0	0	0	111.5	D58 Q59 L65 N66	D58-L62 WeakPolarHBondContact O-CB 3.29Å; D58-L62 PolarHBondContact O-N 3.05Å; Q59-L62 PolarHBondContact O-N 3.3Å; L62-L65 PolarHBondContact O-N 3.09Å; L62-N66 WeakPolarHBondContact O-CB 3.5Å; L62-N66 PolarHBondContact O-N 3.28Å; L62-N66 PolarHBondContact O-ND2 2.83Å
63	M	41.2	Very low	44.6	Very low	118 Å²	118	108 Å²	108	58%	0.581	55%	0.55	S	S	*	*	H	α-helix	trans	-64.5	-40.9	174.8	-74	-172.9	-73.2	0	0	112.3	Q59 V60 E61 A67	Q59-M63 WeakPolarHBondContact O-CE 3.29Å; Q59-M63 WeakPolarHBondContact O-CG 3.47Å; Q59-M63 PolarHBondContact O-N 2.99Å; Q59-M63 VanDerWaalsContact O-N 3.08Å; V60-M63 HydrophobicContact CG2-CE 4.2Å; V60-M63 PolarHBondContact O-N 3.07Å; E61-M63 VanDerWaalsContact C-N 3.28Å; E61-M63 PolarHBondContact O-N 3.49Å; M63-A67 WeakPolarHBondContact O-CB 3.46Å; M63-A67 PolarHBondContact O-N 3.18Å
64	K	42.5	Very low	44	Very low	142 Å²	142	107 Å²	107	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-61.4	-42.6	174.3	-75.3	177.3	178.2	-179.8	0	111.9	V60 E61 A67 S68	V60-K64 WeakPolarHBondContact O-CG 3.42Å; V60-K64 PolarHBondContact O-N 3.27Å; E61-K64 WeakPolarHBondContact O-CB 3.33Å; E61-K64 PolarHBondContact O-N 3.04Å; E61-K64 VanDerWaalsContact O-N 3.11Å; K64-A67 PolarHBondContact O-N 3.41Å; K64-S68 WeakPolarHBondContact O-CB 3.5Å; K64-S68 PolarHBondContact O-N 3.11Å
65	L	43.8	Very low	42.6	Very low	105 Å²	105	108.9 Å²	108.9	55%	0.55	56%	0.564	S	S	.	*	H	α-helix	trans	-67.6	-42.8	-178	-139.1	145	0	0	0	111.3	E61 L62 A67 S68 N69	E61-L65 PolarHBondContact O-N 3.46Å; L62-L65 PolarHBondContact O-N 3.09Å; L65-A67 PolarHBondContact O-N 3.47Å; L65-S68 PolarHBondContact O-N 3.46Å; L65-N69 PolarHBondContact O-N 2.9Å
66	N	41.8	Very low	41.2	Very low	96 Å²	96	108.8 Å²	108.8	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-61.7	-41	172.9	-74.2	-22.4	0	0	0	112.4	L62 S68 L70	L62-N66 WeakPolarHBondContact O-CB 3.5Å; L62-N66 PolarHBondContact O-N 3.28Å; L62-N66 PolarHBondContact O-ND2 2.83Å; N66-S68 VanDerWaalsContact C-N 3.35Å; N66-L70 PolarHBondContact O-N 3.37Å; N66-L70 VanDerWaalsContact O-N 3.15Å
67	A	36	Very low	40.3	Very low	49 Å²	49	111.7 Å²	111.7	41%	0.405	59%	0.592	S	S	.	*	H	α-helix	trans	-65.6	-37.1	175.6	0	0	0	0	0	112.5	M63 K64 L65 M71	M63-A67 WeakPolarHBondContact O-CB 3.46Å; M63-A67 PolarHBondContact O-N 3.18Å; K64-A67 PolarHBondContact O-N 3.41Å; L65-A67 PolarHBondContact O-N 3.47Å; A67-M71 PolarHBondContact O-N 3.08Å
68	S	38.2	Very low	39.2	Very low	61 Å²	61	112.4 Å²	112.4	43%	0.427	61%	0.605	S	S	.	*	H	α-helix	trans	-66.9	-45.7	176.5	-168.7	0	0	0	0	112.1	K64 L65 N66 L70 M71 Q72	K64-S68 WeakPolarHBondContact O-CB 3.5Å; K64-S68 PolarHBondContact O-N 3.11Å; L65-S68 PolarHBondContact O-N 3.46Å; N66-S68 VanDerWaalsContact C-N 3.35Å; S68-L70 VanDerWaalsContact C-N 3.29Å; S68-L70 PolarHBondContact O-N 3.2Å; S68-M71 PolarHBondContact O-N 3.06Å; S68-M71 VanDerWaalsContact O-N 3.1Å; S68-Q72 PolarHBondContact O-N 3.41Å
69	N	40.4	Very low	37.9	Very low	79 Å²	79	113.5 Å²	113.5	42%	0.422	62%	0.615	S	S	.	*	H	α-helix	trans	-62.2	-35.9	177.4	-72.9	-18.5	0	0	0	112.3	L65 M71 Q72	L65-N69 PolarHBondContact O-N 2.9Å; N69-M71 VanDerWaalsContact C-N 3.28Å; N69-M71 PolarHBondContact O-N 3.11Å; N69-Q72 PolarHBondContact O-N 3.24Å
70	L	33.2	Very low	37	Very low	134 Å²	134	117.1 Å²	117.1	70%	0.702	63%	0.629	S	S	*	*	H	α-helix	trans	-62	-37	175.7	-144.5	83.6	0	0	0	111.7	N66 S68 T73	N66-L70 PolarHBondContact O-N 3.37Å; N66-L70 VanDerWaalsContact O-N 3.15Å; S68-L70 VanDerWaalsContact C-N 3.29Å; S68-L70 PolarHBondContact O-N 3.2Å; L70-T73 PolarHBondContact O-OG1 3.23Å; L70-T73 VanDerWaalsContact O-OG1 3.07Å
71	M	35.6	Very low	36.5	Very low	107 Å²	107	125.7 Å²	125.7	53%	0.527	65%	0.654	S	S	.	*	H	α-helix	trans	-77.3	-19.8	-179.4	-68.1	-142.7	153.5	0	0	114.4	A67 S68 N69 S74 K142	A67-M71 PolarHBondContact O-N 3.08Å; S68-M71 PolarHBondContact O-N 3.06Å; S68-M71 VanDerWaalsContact O-N 3.1Å; N69-M71 VanDerWaalsContact C-N 3.28Å; N69-M71 PolarHBondContact O-N 3.11Å; M71-S74 PolarHBondContact O-OG 3.43Å; M71-K142 HydrophobicContact CE-CD 4.07Å
72	Q	36.5	Very low	35.4	Very low	153 Å²	153	129.7 Å²	129.7	72%	0.715	67%	0.672	S	S	*	*	H	α-helix	trans	-80.5	-16.4	176.9	-69.7	-173.5	3.8	0	0	113.6	S68 N69	S68-Q72 PolarHBondContact O-N 3.41Å; N69-Q72 PolarHBondContact O-N 3.24Å
73	T	34.2	Very low	34.2	Very low	114 Å²	114	127.7 Å²	127.7	70%	0.699	68%	0.679	S	S	*	*	S	Bend	trans	-89.2	-8.9	-175.7	60.1	0	0	0	0	114.7	L70	L70-T73 PolarHBondContact O-OG1 3.23Å; L70-T73 VanDerWaalsContact O-OG1 3.07Å
74	S	31.7	Very low	33.6	Very low	86 Å²	86	128.1 Å²	128.1	60%	0.601	69%	0.693	S	S	*	*	S	Bend	trans	-93.2	100.6	175.7	54.4	0	0	0	0	111.6	M71	M71-S74 PolarHBondContact O-OG 3.43Å
75	K	29.4	Very low	32.9	Very low	193 Å²	193	132.7 Å²	132.7	84%	0.839	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-58.5	135.8	172.9	-77.8	179.5	177.3	175.9	0	111.1	I77	K75-I77 PolarHBondContact O-N 3.12Å
76	P	32.4	Very low	32.2	Very low	128 Å²	128	137 Å²	137	83%	0.831	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-72.7	128	178.6	27.9	-30.8	0	0	0	111.1
77	I	27.9	Very low	31.5	Very low	159 Å²	159	138.8 Å²	138.8	82%	0.815	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-75.1	122.1	177.2	-59.8	170.3	0	0	0	109.2	K75 V79	K75-I77 PolarHBondContact O-N 3.12Å; I77-V79 HydrophobicContact CG2-CG2 3.77Å
78	S	26.5	Very low	31	Very low	112 Å²	112	141.4 Å²	141.4	78%	0.783	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-85.9	122	171.1	156.3	0	0	0	0	109.8
79	V	30.2	Very low	30.4	Very low	123 Å²	123	145.8 Å²	145.8	75%	0.745	77%	0.768	S	S	*	*			trans	-131.9	114.9	171.5	-168.5	0	0	0	0	110.9	I77	I77-V79 HydrophobicContact CG2-CG2 3.77Å
80	K	28.9	Very low	29.8	Very low	198 Å²	198	147.6 Å²	147.6	86%	0.861	78%	0.782	S	S	*	*			trans	-63.5	133.7	171.9	-71.5	175.2	174.4	176.1	0	111
81	R	30.7	Very low	29.6	Very low	252 Å²	252	146.2 Å²	146.2	95%	0.951	78%	0.779	S	S	*	*			trans	-91.1	108.8	167.7	-77.8	-173.7	173.7	-166.1	-1.5	110.6
82	Q	30.3	Very low	29.2	Very low	200 Å²	200	151.1 Å²	151.1	94%	0.935	80%	0.798	S	S	*	*			trans	-90.7	137.4	159.8	-97.5	176.7	-21.3	0	0	109.4
83	G	27.2	Very low	28.7	Very low	72 Å²	72	147 Å²	147	74%	0.742	80%	0.796	S	S	*	*			trans	-92.4	-179.5	-172.5	0	0	0	0	0	115.8
84	C	28.6	Very low	28.5	Very low	128 Å²	128	147.9 Å²	147.9	87%	0.865	80%	0.801	S	S	*	*			trans	-159.7	109.5	160.1	-97.8	0	0	0	0	113.8
85	R	26.9	Very low	28.2	Very low	238 Å²	238	149.5 Å²	149.5	90%	0.898	81%	0.81	S	S	*	*			trans	40.9	127.2	137.8	-70.8	-178.5	170.8	179.9	-2.3	123.2
86	K	28.7	Very low	28.2	Very low	196 Å²	196	150.9 Å²	150.9	85%	0.852	81%	0.811	S	S	*	*				-179.9	122.1	96.8	-88.3	174.6	-177.4	179.3	0	106
87	T	27	Very low	27.9	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	80%	0.802	S	S	*	*				-173.1	160	80.4	35.7	0	0	0	0	112.1
88	S	26.1	Very low	28.1	Very low	105 Å²	105	149.7 Å²	149.7	73%	0.734	80%	0.801	S	S	*	*			trans	73.6	123.7	159	63.1	0	0	0	0	122
89	L	25.4	Very low	28.2	Very low	153 Å²	153	151.1 Å²	151.1	80%	0.801	80%	0.8	S	S	*	*			trans	86.7	118.4	152.6	-90.9	81.7	0	0	0	120.4
90	T	28.8	Very low	28.2	Very low	116 Å²	116	149.1 Å²	149.1	71%	0.712	81%	0.805	S	S	*	*			trans	76.3	99	141.7	55.3	0	0	0	0	120.7
91	T	28	Very low	28.3	Very low	105 Å²	105	146.1 Å²	146.1	64%	0.644	80%	0.798	S	S	*	*				71.2	121.4	122.5	-12	0	0	0	0	121.1
92	F	27.7	Very low	28.2	Very low	211 Å²	211	142 Å²	142	93%	0.925	79%	0.789	S	S	*	*			trans	60.7	131.9	161.9	-63.5	-75.5	0	0	0	116.9
93	G	27.1	Very low	28.1	Very low	65 Å²	65	140.3 Å²	140.3	67%	0.67	78%	0.784	S	S	*	*			cis	167.1	151.4	4.6	0	0	0	0	0	108
94	V	29	Very low	28.3	Very low	133 Å²	133	142.4 Å²	142.4	81%	0.806	79%	0.787	S	S	*	*			trans	82.2	115.9	161.6	-161.1	0	0	0	0	119.6	Y96	V94-Y96 HydrophobicContact CG1-CD2 4.44Å
95	P	26.1	Very low	28.2	Very low	121 Å²	121	143 Å²	143	79%	0.786	78%	0.782	S	S	*	*			trans	-110.5	149.4	159.3	36.7	-24.7	0	0	0	112.4
96	Y	28.2	Very low	28.3	Very low	222 Å²	222	137.7 Å²	137.7	87%	0.871	78%	0.778	S	S	*	*			trans	-135.9	133.5	162.3	-106.7	-87.4	0	0	0	111.7	V94	V94-Y96 HydrophobicContact CG1-CD2 4.44Å
97	S	27.4	Very low	28.3	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	77%	0.77	S	S	*	*			trans	-91.3	152.4	175.6	155.3	0	0	0	0	109.8
98	Q	31.9	Very low	28.2	Very low	169 Å²	169	128.8 Å²	128.8	79%	0.79	76%	0.761	S	S	*	*				168	120.4	122.5	-91	175.5	1.1	0	0	113.2
99	N	28.7	Very low	28.2	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	77%	0.771	S	S	*	*				47.5	128.1	129.6	-58.8	-9.8	0	0	0	121.9
100	G	29.5	Very low	28.1	Very low	82 Å²	82	132.4 Å²	132.4	85%	0.845	77%	0.767	S	S	*	*			trans	-157.8	87.5	159.7	0	0	0	0	0	109.3
101	D	30.8	Very low	28	Very low	135 Å²	135	132.3 Å²	132.3	72%	0.722	77%	0.77	S	S	*	*			trans	-63.1	165.1	-178	-89.9	-46.7	0	0	0	115.8
102	Q	28.9	Very low	27.8	Very low	164 Å²	164	132.4 Å²	132.4	77%	0.766	78%	0.775	S	S	*	*			trans	80.8	130.4	154.7	-72.3	161.9	40.1	0	0	117.4
103	M	28.8	Very low	27.7	Very low	165 Å²	165	129.9 Å²	129.9	81%	0.813	77%	0.771	S	S	*	*			cis	-151.8	151.6	27.6	-74.6	-165.6	159.4	0	0	114
104	S	30.4	Very low	27.6	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	78%	0.779	S	S	*	*			trans	74	91.5	146	42.5	0	0	0	0	121.4
105	N	27.9	Very low	27.4	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	77%	0.774	S	S	*	*			trans	-84.8	166.6	147.3	-131.4	-3.3	0	0	0	108.7
106	P	28.8	Very low	27.4	Very low	127 Å²	127	133 Å²	133	83%	0.825	77%	0.772	S	S	*	*				-147.5	167.9	66.1	37.2	-16.3	0	0	0	113.8
107	G	28	Very low	27.4	Very low	67 Å²	67	127 Å²	127	69%	0.691	76%	0.763	S	S	*	*			cis	-159.3	144.8	14.1	0	0	0	0	0	110.9
108	A	24.6	Very low	27.2	Very low	74 Å²	74	129.5 Å²	129.5	61%	0.612	77%	0.769	S	S	*	*			trans	-76	152.3	172.7	0	0	0	0	0	111.2
109	F	25.6	Very low	27.1	Very low	217 Å²	217	129.4 Å²	129.4	95%	0.952	77%	0.773	S	S	*	*			trans	-138	107	140.9	-101.2	-82.2	0	0	0	108.6
110	T	23.8	Very low	26.9	Very low	117 Å²	117	131 Å²	131	72%	0.718	78%	0.781	S	S	*	*			trans	-85.5	155.8	155.7	48	0	0	0	0	109.1
111	C	26.2	Very low	26.8	Very low	113 Å²	113	132.2 Å²	132.2	76%	0.764	77%	0.774	S	S	*	*			trans	160.9	109.4	140.6	-84.4	0	0	0	0	107.8
112	S	25.5	Very low	26.5	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	78%	0.78	S	S	*	*				74.8	108.5	83.9	-55.2	0	0	0	0	113.3
113	D	24.5	Very low	26.5	Very low	157 Å²	157	133.9 Å²	133.9	84%	0.84	79%	0.787	S	S	*	*			trans	37.3	136.3	142.5	-70	-23.6	0	0	0	123.2
114	E	25.5	Very low	26.3	Very low	178 Å²	178	133 Å²	133	83%	0.832	79%	0.785	S	S	*	*			trans	80.6	117.3	152.7	-69.7	-169.9	-179.2	0	0	120.7
115	S	25.5	Very low	26	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	79%	0.789	S	S	*	*			trans	89.3	123.5	134.9	69.8	0	0	0	0	119.8
116	S	25.6	Very low	26	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	79%	0.789	S	S	*	*			trans	77.9	121.5	144.6	64.9	0	0	0	0	121.1
117	S	27.1	Very low	25.8	Very low	98 Å²	98	138.6 Å²	138.6	69%	0.685	79%	0.792	S	S	*	*			trans	66	122.6	136.9	61.3	0	0	0	0	119.9
118	D	24.7	Very low	25.7	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	80%	0.8	S	S	*	*			trans	44.6	97.5	132.1	-59.2	-28.6	0	0	0	116.2
119	N	28.7	Very low	25.7	Very low	166 Å²	166	147.6 Å²	147.6	89%	0.888	80%	0.8	S	S	*	*			trans	-175.3	99.7	135.3	-87.3	-39.5	0	0	0	110.2
120	L	24.3	Very low	25.7	Very low	175 Å²	175	141.7 Å²	141.7	92%	0.916	78%	0.784	S	S	*	*			trans	-69.2	128.2	161	-102.4	146.1	0	0	0	109.1
121	P	28.3	Very low	25.8	Very low	109 Å²	109	142 Å²	142	71%	0.708	78%	0.781	S	S	*	*			trans	-89.3	125.1	164.4	23.4	-11.8	0	0	0	110.5	L123	P121-L123 PolarHBondContact O-N 3.34Å
122	N	24	Very low	25.8	Very low	158 Å²	158	141.9 Å²	141.9	85%	0.845	78%	0.777	S	S	*	*			trans	-54.9	114.4	165.1	-82.8	-39	0	0	0	110.7
123	L	29.3	Very low	25.7	Very low	175 Å²	175	142.1 Å²	142.1	92%	0.916	77%	0.773	S	S	*	*			trans	-106.3	99.9	160.7	-88.5	163.5	0	0	0	109.5	P121	P121-L123 PolarHBondContact O-N 3.34Å
124	L	24.6	Very low	25.7	Very low	147 Å²	147	142.4 Å²	142.4	77%	0.77	76%	0.764	S	S	*	*			trans	-56.9	136.3	170.9	-77.1	142.2	0	0	0	112	S126	L124-S126 PolarHBondContact O-N 3.22Å
125	K	24.5	Very low	25.7	Very low	206 Å²	206	138 Å²	138	90%	0.896	75%	0.749	S	S	*	*			trans	16.9	98	148.8	-64.6	178.9	178.4	179.2	0	116.3
126	S	27.1	Very low	25.5	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	75%	0.752	S	S	*	*			trans	-140	112.8	144.4	74.5	0	0	0	0	109.9	L124 R128	L124-S126 PolarHBondContact O-N 3.22Å; S126-R128 PolarHBondContact O-N 2.86Å
127	E	23.7	Very low	25.5	Very low	188 Å²	188	141.3 Å²	141.3	88%	0.879	74%	0.74	S	S	*	*			trans	-47.3	123.3	158.8	-69.1	168.6	134.6	0	0	109
128	R	26.1	Very low	25.5	Very low	230 Å²	230	141.1 Å²	141.1	87%	0.868	73%	0.732	S	S	*	*			trans	-174.8	107	152.4	-100.4	149.4	-165.5	-154.7	4.9	112.1	S126	S126-R128 PolarHBondContact O-N 2.86Å
129	T	24.8	Very low	25.7	Very low	100 Å²	100	138.8 Å²	138.8	61%	0.613	72%	0.719	S	S	*	*			trans	66.8	110.2	146	48.5	0	0	0	0	120.2	N131	T129-N131 PolarHBondContact O-N 3.24Å
130	P	26.6	Very low	25.5	Very low	93 Å²	93	135 Å²	135	60%	0.604	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-19.2	174.2	-18.6	30.6	0	0	0	114.9	V132 Y134	P130-V132 PolarHBondContact O-N 3.08Å; P130-Y134 HydrophobicContact CB-CE2 3.95Å; P130-Y134 WeakPolarHBondContact O-CD2 3.4Å; P130-Y134 WeakPolarHBondContact O-CE2 3.45Å
131	N	25.8	Very low	25.7	Very low	123 Å²	123	128.8 Å²	128.8	66%	0.658	66%	0.66	S	S	*	*	H	α-helix	trans	-73.5	-17.2	-162.4	-78.8	-9.1	0	0	0	116.7	T129 T135	T129-N131 PolarHBondContact O-N 3.24Å; N131-T135 PolarHBondContact O-OG1 2.89Å
132	V	24.8	Very low	25.8	Very low	112 Å²	112	128.5 Å²	128.5	68%	0.679	65%	0.648	S	S	*	*	H	α-helix	trans	-80.9	-29.3	-175	-176.2	0	0	0	0	112.2	P130 T135	P130-V132 PolarHBondContact O-N 3.08Å; V132-T135 PolarHBondContact O-OG1 3.48Å
133	V	23.4	Very low	26	Very low	113 Å²	113	124.3 Å²	124.3	69%	0.685	64%	0.635	S	S	*	*	H	α-helix	trans	-77	-32.8	-178	-176.2	0	0	0	0	111.5	T135 Y136 T137	V133-T135 PolarHBondContact O-N 3.11Å; V133-Y136 PolarHBondContact O-N 3.41Å; V133-T137 PolarHBondContact O-OG1 3.23Å
134	Y	24.9	Very low	25.8	Very low	162 Å²	162	118.4 Å²	118.4	64%	0.635	61%	0.608	S	S	*	*	H	α-helix	trans	-66.6	-36.3	-179.2	-73.2	-77.8	0	0	0	114	P130 Y136	P130-Y134 HydrophobicContact CB-CE2 3.95Å; P130-Y134 WeakPolarHBondContact O-CD2 3.4Å; P130-Y134 WeakPolarHBondContact O-CE2 3.45Å; Y134-Y136 VanDerWaalsContact C-N 3.3Å; Y134-Y136 PolarHBondContact O-N 3.45Å
135	T	25	Very low	26.2	Very low	86 Å²	86	114.1 Å²	114.1	53%	0.528	59%	0.585	S	S	.	*	H	α-helix	trans	-69.5	-22.2	-179.3	16.6	0	0	0	0	114.5	N131 V132 V133 N139	N131-T135 PolarHBondContact O-OG1 2.89Å; V132-T135 PolarHBondContact O-OG1 3.48Å; V133-T135 PolarHBondContact O-N 3.11Å; T135-N139 PolarHBondContact O-ND2 3.08Å
136	Y	22.2	Very low	26.9	Very low	196 Å²	196	106.6 Å²	106.6	77%	0.769	56%	0.558	S	S	*	*	H	α-helix	trans	-80.1	-36.9	-177.5	-149.8	-90.8	0	0	0	111.6	V133 Y134 Y140	V133-Y136 PolarHBondContact O-N 3.41Å; Y134-Y136 VanDerWaalsContact C-N 3.3Å; Y134-Y136 PolarHBondContact O-N 3.45Å; Y136-Y140 PolarHBondContact O-N 3.29Å
137	T	24.7	Very low	27.3	Very low	80 Å²	80	107.4 Å²	107.4	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-72.6	-40.9	-175.9	-24.9	0	0	0	0	112.1	V133 Y140 L141	V133-T137 PolarHBondContact O-OG1 3.23Å; T137-Y140 WeakPolarHBondContact O-CB 3.35Å; T137-Y140 PolarHBondContact O-N 3.5Å; T137-L141 WeakPolarHBondContact O-CD1 3.23Å; T137-L141 PolarHBondContact O-N 3.13Å
138	D	28	Very low	27.7	Very low	94 Å²	94	100.3 Å²	100.3	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-70.3	-34.5	-177	-155.5	39.2	0	0	0	112.8	L141 K142	D138-L141 PolarHBondContact O-N 3.18Å; D138-K142 PolarHBondContact O-N 3.09Å
139	N	28.1	Very low	28.2	Very low	94 Å²	94	91.9 Å²	91.9	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-72.2	-33	174.3	-75.8	-41.9	0	0	0	112.8	T135 L141	T135-N139 PolarHBondContact O-ND2 3.08Å; N139-L141 VanDerWaalsContact C-N 3.26Å
140	Y	25.6	Very low	29	Very low	88 Å²	88	90.8 Å²	90.8	35%	0.345	48%	0.481	S	S	.	.	H	α-helix	trans	-63.6	-39.2	170.5	-160.4	-119	0	0	0	109.4	Y136 T137 K142 A143 Q423 K424 L426	Y136-Y140 PolarHBondContact O-N 3.29Å; T137-Y140 WeakPolarHBondContact O-CB 3.35Å; T137-Y140 PolarHBondContact O-N 3.5Å; Y140-K142 PolarHBondContact O-N 3.33Å; Y140-A143 WeakPolarHBondContact O-CB 3.39Å; Y140-A143 PolarHBondContact O-N 3.43Å; Y140-Q423 PolarHBondContact OH-O 2.93Å; Y140-K424 WeakPolarHBondContact OH-CB 3.43Å; Y140-K424 PolarHBondContact OH-O 3.02Å; Y140-L426 HydrophobicContact CD1-CD1 3.2Å; Y140-L426 HydrophobicContact CE1-CD1 3.82Å; Y140-L426 HydrophobicContact CG-CD1 3.83Å; Y140-L426 WeakPolarHBondContact O-CD1 3.41Å
141	L	27.7	Very low	29.6	Very low	43 Å²	43	92.6 Å²	92.6	23%	0.225	48%	0.479	C	S	.	.	H	α-helix	trans	-62.2	-43.9	-176.6	-89.5	133.5	0	0	0	114.9	T137 D138 N139 A143 L426	T137-L141 WeakPolarHBondContact O-CD1 3.23Å; T137-L141 PolarHBondContact O-N 3.13Å; D138-L141 PolarHBondContact O-N 3.18Å; N139-L141 VanDerWaalsContact C-N 3.26Å; L141-A143 PolarHBondContact O-N 2.87Å; L141-L426 HydrophobicContact CB-CD1 4.05Å; L141-L426 HydrophobicContact CB-CD2 3.56Å; L141-L426 HydrophobicContact CB-CG 3.92Å; L141-L426 HydrophobicContact CD2-CD1 4.47Å; L141-L426 HydrophobicContact CD2-CD2 3.12Å; L141-L426 HydrophobicContact CD2-CG 3.5Å; L141-L426 HydrophobicContact CG-CD1 3.77Å; L141-L426 HydrophobicContact CG-CD2 3.32Å; L141-L426 HydrophobicContact CG-CG 3.34Å; L141-L426 WeakPolarHBondContact O-CD2 3.33Å
142	K	31.5	Very low	30.1	Very low	104 Å²	104	88.1 Å²	88.1	45%	0.452	46%	0.455	S	S	.	.	H	α-helix	trans	-66.7	-21.1	174.1	-74.8	173	178.7	167.5	0	113.5	M71 D138 Y140 K150	M71-K142 HydrophobicContact CE-CD 4.07Å; D138-K142 PolarHBondContact O-N 3.09Å; Y140-K142 PolarHBondContact O-N 3.33Å; K142-K150 WeakPolarHBondContact O-CE 3.23Å; K142-K150 PolarHBondContact O-NZ 3.36Å
143	A	27.6	Very low	30.8	Very low	70 Å²	70	89 Å²	89	58%	0.579	45%	0.45	S	S	*	.	H	α-helix	trans	-79.9	-27.6	-177.4	0	0	0	0	0	113.7	Y140 L141	Y140-A143 WeakPolarHBondContact O-CB 3.39Å; Y140-A143 PolarHBondContact O-N 3.43Å; L141-A143 PolarHBondContact O-N 2.87Å
144	C	26.1	Very low	31.6	Very low	50 Å²	50	85.3 Å²	85.3	34%	0.338	43%	0.434	S	S	.	.	S	Bend	trans	-93.5	-8.2	-168.6	-66	0	0	0	0	116.8	L426	C144-L426 HydrophobicContact CB-CB 3.71Å; C144-L426 HydrophobicContact CB-CD1 4.07Å; C144-L426 HydrophobicContact CB-CD2 4Å; C144-L426 HydrophobicContact CB-CG 4.18Å
145	M	31.3	Very low	32.4	Very low	58 Å²	58	79.3 Å²	79.3	29%	0.286	41%	0.412	S	S	.	.	S	Bend	trans	-69.1	138.9	174	-68.3	-164.2	-65.3	0	0	111.7	K150 F428	M145-K150 HydrophobicContact CB-CD 4.24Å; M145-K150 HydrophobicContact CB-CG 3.7Å; M145-K150 HydrophobicContact CE-CD 4.37Å; M145-K150 HydrophobicContact CE-CG 3.5Å; M145-K150 WeakPolarHBondContact O-CE 3.08Å; M145-K150 HydrophobicContact SD-CG 4.37Å; M145-F428 HydrophobicContact CG-CE1 3.86Å; M145-F428 HydrophobicContact CG-CZ 3.48Å; M145-F428 VanDerWaalsContact CG-CZ 3.48Å; M145-F428 HydrophobicContact SD-CE1 4.33Å
146	S	39.1	Very low	33	Very low	47 Å²	47	78.7 Å²	78.7	33%	0.329	40%	0.404	S	S	.	.			trans	-57	144.5	169.8	162.6	0	0	0	0	110.3	V148 E149 K150	S146-V148 PolarHBondContact O-N 3.05Å; S146-V148 VanDerWaalsContact O-N 3.12Å; S146-V148 PolarHBondContact OG-N 3.1Å; S146-V148 VanDerWaalsContact OG-N 3.11Å; S146-E149 WeakPolarHBondContact CB-OE2 3.45Å; S146-E149 PolarHBondContact N-OE2 2.84Å; S146-E149 VanDerWaalsContact N-OE2 3.09Å; S146-E149 PolarHBondContact O-N 3.22Å; S146-E149 VanDerWaalsContact O-N 3.13Å; S146-K150 PolarHBondContact O-N 3.41Å
147	N	36.6	Very low	33.9	Very low	125 Å²	125	74 Å²	74	67%	0.668	39%	0.393	S	S	*	.	H	α-helix	trans	-56.7	-27.2	173.5	-110.9	-6.3	0	0	0	112.5	K151	N147-K151 VanDerWaalsContact O-CG 3.27Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 2.93Å
148	V	32.6	Very low	34.7	Very low	38 Å²	38	74.2 Å²	74.2	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-76	-42.1	178.4	-175.5	0	0	0	0	110.8	S146 K151 L152 I343 E344 L347	S146-V148 PolarHBondContact O-N 3.05Å; S146-V148 VanDerWaalsContact O-N 3.12Å; S146-V148 PolarHBondContact OG-N 3.1Å; S146-V148 VanDerWaalsContact OG-N 3.11Å; V148-K151 WeakPolarHBondContact O-CB 3.45Å; V148-K151 PolarHBondContact O-N 3.36Å; V148-L152 PolarHBondContact O-N 2.93Å; V148-I343 HydrophobicContact CG1-CG2 3.59Å; V148-E344 HydrophobicContact CG1-CG 4.47Å; V148-L347 HydrophobicContact CG1-CD1 3.65Å
149	E	36.3	Very low	35.2	Very low	53 Å²	53	70.7 Å²	70.7	25%	0.248	37%	0.372	C	S	.	.	H	α-helix	trans	-67	-44.1	177.9	-67.7	166.5	163.2	0	0	111	S146 K151 L152 F153	S146-E149 WeakPolarHBondContact CB-OE2 3.45Å; S146-E149 PolarHBondContact N-OE2 2.84Å; S146-E149 VanDerWaalsContact N-OE2 3.09Å; S146-E149 PolarHBondContact O-N 3.22Å; S146-E149 VanDerWaalsContact O-N 3.13Å; E149-K151 PolarHBondContact O-N 3.15Å; E149-L152 PolarHBondContact O-N 3.43Å; E149-L152 VanDerWaalsContact O-N 3.13Å; E149-F153 HydrophobicContact CB-CD2 4.49Å; E149-F153 VanDerWaalsContact O-CD2 3.29Å; E149-F153 WeakPolarHBondContact O-CD2 3.37Å; E149-F153 PolarHBondContact O-N 3.49Å
150	K	41.3	Very low	35.7	Very low	78 Å²	78	70.5 Å²	70.5	34%	0.339	37%	0.371	S	S	.	.	H	α-helix	trans	-53.1	-41.8	172.5	-74.8	179.9	-178.7	-174.2	0	112.2	K142 M145 S146 G154	K142-K150 WeakPolarHBondContact O-CE 3.23Å; K142-K150 PolarHBondContact O-NZ 3.36Å; M145-K150 HydrophobicContact CB-CD 4.24Å; M145-K150 HydrophobicContact CB-CG 3.7Å; M145-K150 HydrophobicContact CE-CD 4.37Å; M145-K150 HydrophobicContact CE-CG 3.5Å; M145-K150 WeakPolarHBondContact O-CE 3.08Å; M145-K150 HydrophobicContact SD-CG 4.37Å; S146-K150 PolarHBondContact O-N 3.41Å; K150-G154 PolarHBondContact O-N 3.04Å
151	K	38	Very low	36.5	Very low	131 Å²	131	70.4 Å²	70.4	57%	0.57	38%	0.377	S	S	*	.	H	α-helix	trans	-69.4	-42	178	-77.5	176.3	179.8	-173.4	0	112.4	N147 V148 E149 K155 L347	N147-K151 VanDerWaalsContact O-CG 3.27Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 2.93Å; V148-K151 WeakPolarHBondContact O-CB 3.45Å; V148-K151 PolarHBondContact O-N 3.36Å; E149-K151 PolarHBondContact O-N 3.15Å; K151-K155 WeakPolarHBondContact O-CG 3.4Å; K151-K155 PolarHBondContact O-N 3.46Å; K151-K155 VanDerWaalsContact O-N 3.13Å; K151-L347 HydrophobicContact CB-CD2 4.34Å
152	L	36.9	Very low	37.2	Very low	28 Å²	28	71 Å²	71	15%	0.147	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-50.3	179.3	-176.8	73.1	0	0	0	110.9	V148 E149 G154 K155 L156 I343 L347 I350	V148-L152 PolarHBondContact O-N 2.93Å; E149-L152 PolarHBondContact O-N 3.43Å; E149-L152 VanDerWaalsContact O-N 3.13Å; L152-G154 PolarHBondContact O-N 3.11Å; L152-K155 PolarHBondContact O-N 2.98Å; L152-L156 HydrophobicContact CD1-CD1 4.32Å; L152-L156 HydrophobicContact CD2-CD1 4.4Å; L152-L156 HydrophobicContact CG-CD1 3.92Å; L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 3.14Å; L152-I343 HydrophobicContact CB-CG2 4.44Å; L152-I343 HydrophobicContact CD2-CG1 4.45Å; L152-I343 HydrophobicContact CD2-CG2 4.05Å; L152-L347 HydrophobicContact CB-CD2 3.96Å; L152-L347 HydrophobicContact CB-CG 4.3Å; L152-L347 HydrophobicContact CD1-CD2 3.86Å; L152-L347 HydrophobicContact CD1-CG 3.97Å; L152-I350 HydrophobicContact CD1-CD1 3.72Å
153	F	39	Very low	37.5	Very low	131 Å²	131	69.4 Å²	69.4	58%	0.575	37%	0.373	S	S	*	.	H	α-helix	trans	-61.2	-44.5	178.4	-81.7	-71.1	0	0	0	111.9	E149 K155 L156 D157	E149-F153 HydrophobicContact CB-CD2 4.49Å; E149-F153 VanDerWaalsContact O-CD2 3.29Å; E149-F153 WeakPolarHBondContact O-CD2 3.37Å; E149-F153 PolarHBondContact O-N 3.49Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 3.09Å; F153-L156 PolarHBondContact O-N 3.43Å; F153-D157 WeakPolarHBondContact O-CB 3.32Å; F153-D157 PolarHBondContact O-N 3.35Å
154	G	41	Very low	38.1	Very low	35 Å²	35	71.2 Å²	71.2	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-38	177.3	0	0	0	0	0	113.4	K150 L152 I158	K150-G154 PolarHBondContact O-N 3.04Å; L152-G154 PolarHBondContact O-N 3.11Å; G154-I158 WeakPolarHBondContact O-CD1 3.42Å; G154-I158 VanDerWaalsContact O-CG1 3.27Å; G154-I158 WeakPolarHBondContact O-CG1 3.42Å; G154-I158 PolarHBondContact O-N 2.93Å
155	K	40.8	Very low	38.8	Very low	37 Å²	37	70.9 Å²	70.9	16%	0.161	37%	0.368	C	S	.	.	H	α-helix	trans	-76.4	-38.7	177.7	-70.4	-174.1	-175.4	179.1	0	113.5	K151 L152 F153 D157 I158 C159 L347 I350 D351	K151-K155 WeakPolarHBondContact O-CG 3.4Å; K151-K155 PolarHBondContact O-N 3.46Å; K151-K155 VanDerWaalsContact O-N 3.13Å; L152-K155 PolarHBondContact O-N 2.98Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 3.09Å; K155-D157 VanDerWaalsContact C-N 3.29Å; K155-D157 PolarHBondContact O-N 3.39Å; K155-I158 PolarHBondContact O-N 2.9Å; K155-C159 PolarHBondContact O-N 3.24Å; K155-C159 PolarHBondContact O-SG 2.89Å; K155-C159 VanDerWaalsContact O-SG 3.36Å; K155-L347 HydrophobicContact CD-CD2 4.18Å; K155-I350 HydrophobicContact CB-CG2 3.82Å; K155-I350 HydrophobicContact CD-CG2 3.96Å; K155-I350 HydrophobicContact CG-CG2 4.49Å; K155-D351 IonicContact NZ-OD1 2.53Å; K155-D351 PolarHBondContact NZ-OD1 3.01Å; K155-D351 IonicContact NZ-OD2 2.78Å; K155-D351 PolarHBondContact NZ-OD2 3.44Å
156	L	38.8	Very low	39.1	Very low	72 Å²	72	69.7 Å²	69.7	38%	0.377	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-41.7	175	-78.5	168.6	0	0	0	111.2	L152 F153 C159 L160 I350	L152-L156 HydrophobicContact CD1-CD1 4.32Å; L152-L156 HydrophobicContact CD2-CD1 4.4Å; L152-L156 HydrophobicContact CG-CD1 3.92Å; L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 3.14Å; F153-L156 PolarHBondContact O-N 3.43Å; L156-C159 PolarHBondContact O-N 3Å; L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 PolarHBondContact O-N 2.94Å; L156-I350 HydrophobicContact CD2-CD1 4.19Å; L156-I350 HydrophobicContact CG-CD1 4.3Å
157	D	41.2	Very low	39	Very low	99 Å²	99	73 Å²	73	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-41.2	177.9	-157.9	29.9	0	0	0	111.8	F153 K155 L160 N161	F153-D157 WeakPolarHBondContact O-CB 3.32Å; F153-D157 PolarHBondContact O-N 3.35Å; K155-D157 VanDerWaalsContact C-N 3.29Å; K155-D157 PolarHBondContact O-N 3.39Å; D157-L160 PolarHBondContact O-N 2.95Å; D157-N161 WeakPolarHBondContact O-CB 3.43Å; D157-N161 VanDerWaalsContact O-CG 3.28Å; D157-N161 PolarHBondContact O-N 3.46Å; D157-N161 PolarHBondContact O-ND2 3Å
158	I	41.1	Very low	39	Very low	83 Å²	83	69.7 Å²	69.7	43%	0.426	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-46.5	173.5	-67.6	164.2	0	0	0	111.3	G154 K155 K162	G154-I158 WeakPolarHBondContact O-CD1 3.42Å; G154-I158 VanDerWaalsContact O-CG1 3.27Å; G154-I158 WeakPolarHBondContact O-CG1 3.42Å; G154-I158 PolarHBondContact O-N 2.93Å; K155-I158 PolarHBondContact O-N 2.9Å; I158-K162 PolarHBondContact O-N 3.06Å
159	C	38.2	Very low	39.3	Very low	20 Å²	20	71.3 Å²	71.3	14%	0.135	37%	0.367	C	S	.	.	H	α-helix	trans	-63.8	-44.6	179.1	-68.1	0	0	0	0	112	K155 L156 K162 I163 L357	K155-C159 PolarHBondContact O-N 3.24Å; K155-C159 PolarHBondContact O-SG 2.89Å; K155-C159 VanDerWaalsContact O-SG 3.36Å; L156-C159 PolarHBondContact O-N 3Å; C159-K162 PolarHBondContact O-N 3.13Å; C159-I163 WeakPolarHBondContact O-CG1 3.49Å; C159-I163 PolarHBondContact O-N 2.7Å; C159-L357 HydrophobicContact CB-CD1 4.32Å
160	L	39	Very low	39.1	Very low	91 Å²	91	70.6 Å²	70.6	48%	0.476	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-47.1	178.6	-101.6	138.3	0	0	0	112.2	L156 D157 K162 I163 Q164	L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 PolarHBondContact O-N 2.94Å; D157-L160 PolarHBondContact O-N 2.95Å; L160-K162 VanDerWaalsContact C-N 3.28Å; L160-K162 PolarHBondContact O-N 2.85Å; L160-I163 PolarHBondContact O-N 3.24Å; L160-Q164 WeakPolarHBondContact O-CG 3.33Å; L160-Q164 PolarHBondContact O-N 3.16Å
161	N	41.9	Very low	38.8	Very low	86 Å²	86	71.8 Å²	71.8	46%	0.46	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-37.3	177.8	-73.2	-45	0	0	0	111.9	D157 S165	D157-N161 WeakPolarHBondContact O-CB 3.43Å; D157-N161 VanDerWaalsContact O-CG 3.28Å; D157-N161 PolarHBondContact O-N 3.46Å; D157-N161 PolarHBondContact O-ND2 3Å; N161-S165 WeakPolarHBondContact O-CB 3.42Å; N161-S165 PolarHBondContact O-N 3.42Å
162	K	41.8	Very low	38.8	Very low	56 Å²	56	71.4 Å²	71.4	24%	0.243	38%	0.381	C	S	.	.	H	α-helix	trans	-69.8	-40.4	176.6	-170.5	66.2	175.5	-179.4	0	112.1	I158 C159 L160 S165 L166	I158-K162 PolarHBondContact O-N 3.06Å; C159-K162 PolarHBondContact O-N 3.13Å; L160-K162 VanDerWaalsContact C-N 3.28Å; L160-K162 PolarHBondContact O-N 2.85Å; K162-S165 PolarHBondContact O-N 2.92Å; K162-L166 HydrophobicContact CG-CD1 4.49Å; K162-L166 WeakPolarHBondContact O-CG 3.45Å; K162-L166 PolarHBondContact O-N 3.3Å
163	I	38.9	Very low	38.8	Very low	70 Å²	70	75.7 Å²	75.7	36%	0.359	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-47.6	175.5	-68.8	166.3	0	0	0	110.6	C159 L160 S165 L166 E167	C159-I163 WeakPolarHBondContact O-CG1 3.49Å; C159-I163 PolarHBondContact O-N 2.7Å; L160-I163 PolarHBondContact O-N 3.24Å; I163-S165 VanDerWaalsContact C-N 3.29Å; I163-S165 PolarHBondContact O-N 3.39Å; I163-L166 WeakPolarHBondContact O-CB 3.35Å; I163-L166 PolarHBondContact O-N 3.25Å; I163-L166 VanDerWaalsContact O-N 3.09Å; I163-E167 HydrophobicContact CG2-CG 4.46Å; I163-E167 PolarHBondContact O-N 3.12Å
164	Q	39.6	Very low	38.6	Very low	107 Å²	107	76.3 Å²	76.3	50%	0.5	41%	0.407	S	S	.	.	H	α-helix	trans	-60.6	-38.5	177.5	-73	178.4	-14.3	0	0	112.3	L160 E167 A168	L160-Q164 WeakPolarHBondContact O-CG 3.33Å; L160-Q164 PolarHBondContact O-N 3.16Å; Q164-E167 PolarHBondContact O-N 3.3Å; Q164-A168 WeakPolarHBondContact O-CB 3.46Å; Q164-A168 PolarHBondContact O-N 2.9Å
165	S	40.5	Very low	38.4	Very low	44 Å²	44	79.8 Å²	79.8	31%	0.308	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-42.2	173.3	173.5	0	0	0	0	112.1	N161 K162 I163 A168 H169	N161-S165 WeakPolarHBondContact O-CB 3.42Å; N161-S165 PolarHBondContact O-N 3.42Å; K162-S165 PolarHBondContact O-N 2.92Å; I163-S165 VanDerWaalsContact C-N 3.29Å; I163-S165 PolarHBondContact O-N 3.39Å; S165-A168 PolarHBondContact O-N 2.97Å; S165-H169 PolarHBondContact O-CD2 2.71Å; S165-H169 PolarHBondContact O-N 2.7Å; S165-H169 VanDerWaalsContact O-N 3.11Å
166	L	37.9	Very low	38.2	Very low	33 Å²	33	86 Å²	86	17%	0.173	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-40.7	176.5	-70.7	168.7	0	0	0	112.1	K162 I163 H169 A170 L360 I362 L388	K162-L166 HydrophobicContact CG-CD1 4.49Å; K162-L166 WeakPolarHBondContact O-CG 3.45Å; K162-L166 PolarHBondContact O-N 3.3Å; I163-L166 WeakPolarHBondContact O-CB 3.35Å; I163-L166 PolarHBondContact O-N 3.25Å; I163-L166 VanDerWaalsContact O-N 3.09Å; L166-H169 PolarHBondContact O-N 3.46Å; L166-A170 WeakPolarHBondContact O-CB 3.45Å; L166-A170 PolarHBondContact O-N 2.95Å; L166-L360 HydrophobicContact CD1-CD1 4.12Å; L166-I362 HydrophobicContact CD2-CD1 4.48Å; L166-I362 HydrophobicContact CD2-CG1 4.21Å; L166-L388 HydrophobicContact CD1-CD1 4.34Å
167	E	37.5	Very low	38.1	Very low	116 Å²	116	88.8 Å²	88.8	54%	0.542	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-41	175.7	-74	178.7	168	0	0	112.3	I163 Q164 H169 A170 N171	I163-E167 HydrophobicContact CG2-CG 4.46Å; I163-E167 PolarHBondContact O-N 3.12Å; Q164-E167 PolarHBondContact O-N 3.3Å; E167-H169 PolarHBondContact O-N 2.87Å; E167-A170 PolarHBondContact O-N 3.37Å; E167-N171 PolarHBondContact O-N 3.27Å; E167-N171 VanDerWaalsContact O-N 3.09Å; E167-N171 PolarHBondContact O-ND2 3.4Å
168	A	36.9	Very low	38.1	Very low	55 Å²	55	91.2 Å²	91.2	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-61.6	-42.5	175.8	0	0	0	0	0	111.9	Q164 S165 N171 Q172	Q164-A168 WeakPolarHBondContact O-CB 3.46Å; Q164-A168 PolarHBondContact O-N 2.9Å; S165-A168 PolarHBondContact O-N 2.97Å; A168-N171 PolarHBondContact O-N 2.55Å; A168-Q172 PolarHBondContact O-N 3.44Å
169	H	38.3	Very low	37.9	Very low	72 Å²	72	94.3 Å²	94.3	33%	0.333	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-37.8	175.5	-79.3	-64.9	0	0	0	113	S165 L166 E167 N171 Q172 N173	S165-H169 PolarHBondContact O-CD2 2.71Å; S165-H169 PolarHBondContact O-N 2.7Å; S165-H169 VanDerWaalsContact O-N 3.11Å; L166-H169 PolarHBondContact O-N 3.46Å; E167-H169 PolarHBondContact O-N 2.87Å; H169-N171 VanDerWaalsContact C-N 3.29Å; H169-N171 PolarHBondContact O-N 3.04Å; H169-Q172 PolarHBondContact O-N 2.77Å; H169-N173 PolarHBondContact O-N 3Å
170	A	32.1	Very low	37.5	Very low	39 Å²	39	102.9 Å²	102.9	32%	0.322	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-31.4	177.3	0	0	0	0	0	113	L166 E167	L166-A170 WeakPolarHBondContact O-CB 3.45Å; L166-A170 PolarHBondContact O-N 2.95Å; E167-A170 PolarHBondContact O-N 3.37Å
171	N	35.2	Very low	37.1	Very low	103 Å²	103	104 Å²	104	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-82.1	-24.4	178.4	-70.8	-26.9	0	0	0	113.4	E167 A168 H169 T175	E167-N171 PolarHBondContact O-N 3.27Å; E167-N171 VanDerWaalsContact O-N 3.09Å; E167-N171 PolarHBondContact O-ND2 3.4Å; A168-N171 PolarHBondContact O-N 2.55Å; H169-N171 VanDerWaalsContact C-N 3.29Å; H169-N171 PolarHBondContact O-N 3.04Å; N171-T175 PolarHBondContact O-OG1 3.41Å
172	Q	39	Very low	36.7	Very low	123 Å²	123	105.7 Å²	105.7	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-70.6	-39.8	172.1	-77.2	179.9	-18.8	0	0	112.2	A168 H169 K174 T175	A168-Q172 PolarHBondContact O-N 3.44Å; H169-Q172 PolarHBondContact O-N 2.77Å; Q172-K174 VanDerWaalsContact C-N 3.25Å; Q172-K174 PolarHBondContact O-N 3.5Å; Q172-T175 PolarHBondContact O-N 2.9Å; Q172-T175 PolarHBondContact O-OG1 3.47Å; Q172-T175 VanDerWaalsContact O-OG1 3.1Å
173	N	35.3	Very low	36	Very low	117 Å²	117	110.5 Å²	110.5	63%	0.626	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-16.1	179.8	-69.5	-4.3	0	0	0	113.8	H169	H169-N173 PolarHBondContact O-N 3Å
174	K	36.4	Very low	36	Very low	144 Å²	144	112.8 Å²	112.8	63%	0.626	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-16	176	-79.5	-177.7	176.5	179.3	0	113.9	Q172	Q172-K174 VanDerWaalsContact C-N 3.25Å; Q172-K174 PolarHBondContact O-N 3.5Å
175	T	36.3	Very low	35.6	Very low	109 Å²	109	115.9 Å²	115.9	67%	0.669	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-9	-177.5	12.3	0	0	0	0	113.8	N171 Q172	N171-T175 PolarHBondContact O-OG1 3.41Å; Q172-T175 PolarHBondContact O-N 2.9Å; Q172-T175 PolarHBondContact O-OG1 3.47Å; Q172-T175 VanDerWaalsContact O-OG1 3.1Å
176	E	36.8	Very low	35	Very low	168 Å²	168	121.9 Å²	121.9	79%	0.785	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-20.7	179	-72	-175	157.9	0	0	114.5
177	D	36.9	Very low	34.6	Very low	130 Å²	130	126.3 Å²	126.3	70%	0.695	67%	0.669	S	S	*	*	S	Bend	trans	-98	-7.7	-175	-121.2	-13.1	0	0	0	114.9	N179	D177-N179 PolarHBondContact O-N 3.02Å; D177-N179 VanDerWaalsContact O-N 3.14Å
178	D	39.6	Very low	34.1	Very low	149 Å²	149	126.3 Å²	126.3	80%	0.797	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	7.8	-179.4	-98	-10.7	0	0	0	114.2
179	N	38.1	Very low	33.8	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	14.2	179.4	-77.3	-44.1	0	0	0	114.7	D177	D177-N179 PolarHBondContact O-N 3.02Å; D177-N179 VanDerWaalsContact O-N 3.14Å
180	R	30.4	Very low	33.3	Very low	201 Å²	201	133.6 Å²	133.6	76%	0.758	72%	0.72	S	S	*	*			trans	-100.9	113.8	179.1	-155.5	173.2	-173.8	176.1	1.2	111.7	T182	R180-T182 PolarHBondContact O-N 3.34Å
181	P	29.4	Very low	33.1	Very low	114 Å²	114	140.6 Å²	140.6	74%	0.74	75%	0.746	S	S	*	*			trans	-79.7	109.1	176.5	30.8	-29.2	0	0	0	109.1
182	T	34	Very low	32.6	Very low	122 Å²	122	144.7 Å²	144.7	75%	0.748	76%	0.762	S	S	*	*			trans	-109.7	103.3	167	31.5	0	0	0	0	110.1	R180	R180-T182 PolarHBondContact O-N 3.34Å
183	N	27.8	Very low	32.1	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	78%	0.775	S	S	*	*			trans	-61	127.1	162.4	-55	-39.1	0	0	0	109.4
184	S	37	Very low	31.6	Very low	117 Å²	117	150.1 Å²	150.1	82%	0.818	79%	0.789	S	S	*	*			trans	-171.7	134.7	147.9	44.1	0	0	0	0	111.2
185	E	31.8	Very low	31	Very low	173 Å²	173	148.5 Å²	148.5	81%	0.808	80%	0.796	S	S	*	*			trans	-66.1	155	-171.6	-71.6	157.5	143.1	0	0	116.1
186	E	28.6	Very low	30.5	Very low	169 Å²	169	149.1 Å²	149.1	79%	0.79	80%	0.804	S	S	*	*			trans	54.9	128.5	141.7	-66.1	-179.5	171.5	0	0	119.9
187	T	29.4	Very low	30	Very low	126 Å²	126	150.2 Å²	150.2	77%	0.773	81%	0.809	S	S	*	*				-167.5	154.4	67.4	3.6	0	0	0	0	111.3
188	P	27.1	Very low	29.4	Very low	117 Å²	117	152.7 Å²	152.7	76%	0.76	82%	0.819	S	S	*	*			trans	-92.6	143.5	-177.9	35.4	-27.8	0	0	0	112
189	I	30.2	Very low	28.7	Very low	167 Å²	167	148.2 Å²	148.2	86%	0.856	80%	0.799	S	S	*	*			trans	-129	132.9	163.8	-57.9	178.4	0	0	0	109.4
190	S	27.1	Very low	28.1	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	79%	0.792	S	S	*	*			trans	-75.7	168	-167.6	45.5	0	0	0	0	116.1
191	Q	27.9	Very low	27.8	Very low	186 Å²	186	146.2 Å²	146.2	87%	0.869	79%	0.794	S	S	*	*			trans	-51.4	148.3	177	-64.1	168	-61.4	0	0	116.4
192	E	25.2	Very low	27.5	Very low	189 Å²	189	143.3 Å²	143.3	88%	0.883	78%	0.776	S	S	*	*			trans	150.3	127.4	148.7	-88	176	176.6	0	0	105.9
193	E	28.5	Very low	27.1	Very low	185 Å²	185	144.2 Å²	144.2	86%	0.864	77%	0.772	S	S	*	*			cis	-152.1	153	35.9	-71.4	179	131.9	0	0	111.5
194	N	24.6	Very low	27	Very low	170 Å²	170	144.1 Å²	144.1	91%	0.909	76%	0.761	S	S	*	*			trans	-65.4	130.1	169.3	-71.9	-47.6	0	0	0	112
195	S	24.4	Very low	26.4	Very low	110 Å²	110	145 Å²	145	77%	0.769	75%	0.752	S	S	*	*			trans	-148.3	132.8	147.2	67	0	0	0	0	111.2	E197	S195-E197 PolarHBondContact O-N 2.91Å; S195-E197 VanDerWaalsContact O-N 3.09Å
196	S	26.2	Very low	26	Very low	121 Å²	121	141.2 Å²	141.2	85%	0.846	74%	0.74	S	S	*	*			trans	-60	93.5	-170.9	54.4	0	0	0	0	115.1	M198	S196-M198 VanDerWaalsContact C-N 3.33Å; S196-M198 PolarHBondContact O-N 3.14Å
197	E	24.9	Very low	25.8	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	74%	0.736	S	S	*	*			trans	-91.2	64.7	159.6	-77.6	-174.3	150.8	0	0	110	S195 S199	S195-E197 PolarHBondContact O-N 2.91Å; S195-E197 VanDerWaalsContact O-N 3.09Å; E197-S199 PolarHBondContact O-N 2.96Å
198	M	24.2	Very low	25.7	Very low	183 Å²	183	142.9 Å²	142.9	90%	0.901	73%	0.731	S	S	*	*			trans	-77	83.7	166.9	-132.8	-173.2	-128.1	0	0	108.8	S196	S196-M198 VanDerWaalsContact C-N 3.33Å; S196-M198 PolarHBondContact O-N 3.14Å
199	S	26.1	Very low	25.7	Very low	54 Å²	54	141.5 Å²	141.5	38%	0.378	72%	0.721	S	S	.	*			trans	40.8	76.3	153.7	71.5	0	0	0	0	118.6	E197 Y201 S202	E197-S199 PolarHBondContact O-N 2.96Å; S199-Y201 PolarHBondContact O-N 3.5Å; S199-Y201 VanDerWaalsContact O-N 3.08Å; S199-S202 PolarHBondContact O-N 3.42Å; S199-S202 PolarHBondContact O-OG 3.01Å; S199-S202 VanDerWaalsContact O-OG 3.07Å; S199-S202 WeakPolarHBondContact OG-CB 3.34Å; S199-S202 PolarHBondContact OG-OG 3.05Å
200	V	24.9	Very low	25.4	Very low	107 Å²	107	137.4 Å²	137.4	65%	0.648	70%	0.703	S	S	*	*	H	α-helix	trans	-52.3	-24.1	154.7	179.7	0	0	0	0	110.7	S202 Y204	V200-S202 PolarHBondContact O-N 3.36Å; V200-Y204 HydrophobicContact CG1-CD2 4.01Å; V200-Y204 HydrophobicContact CG1-CE2 3.6Å; V200-Y204 WeakPolarHBondContact O-CD2 3.22Å
201	Y	23.6	Very low	25.6	Very low	201 Å²	201	135.8 Å²	135.8	79%	0.788	69%	0.688	S	S	*	*	H	α-helix	trans	-67	-23.9	174.5	-93.5	-88.1	0	0	0	115.9	S199	S199-Y201 PolarHBondContact O-N 3.5Å; S199-Y201 VanDerWaalsContact O-N 3.08Å
202	S	24.8	Very low	25.6	Very low	53 Å²	53	129.5 Å²	129.5	37%	0.371	67%	0.668	S	S	.	*	H	α-helix	trans	-87.8	-37.4	-173.9	68.3	0	0	0	0	113.2	S199 V200 Y204 Q205 V206	S199-S202 PolarHBondContact O-N 3.42Å; S199-S202 PolarHBondContact O-OG 3.01Å; S199-S202 VanDerWaalsContact O-OG 3.07Å; S199-S202 WeakPolarHBondContact OG-CB 3.34Å; S199-S202 PolarHBondContact OG-OG 3.05Å; V200-S202 PolarHBondContact O-N 3.36Å; S202-Y204 VanDerWaalsContact C-N 3.34Å; S202-Y204 PolarHBondContact O-N 3.49Å; S202-Q205 PolarHBondContact O-N 3.26Å; S202-V206 WeakPolarHBondContact O-CG2 3.49Å; S202-V206 PolarHBondContact O-N 3.32Å
203	E	24.6	Very low	25.7	Very low	141 Å²	141	124.4 Å²	124.4	66%	0.659	65%	0.649	S	S	*	*	H	α-helix	trans	-65.8	-36	175.9	-76.4	-173.7	151.6	0	0	112.3	V206 Y207	E203-V206 PolarHBondContact O-N 3.04Å; E203-Y207 PolarHBondContact O-N 3.42Å; E203-Y207 VanDerWaalsContact O-N 3.07Å
204	Y	25.4	Very low	25.6	Very low	154 Å²	154	124.3 Å²	124.3	60%	0.604	64%	0.641	S	S	*	*	H	α-helix	trans	-71.6	-31.9	178.6	-77.2	-102.4	0	0	0	112.4	V200 S202 F208	V200-Y204 HydrophobicContact CG1-CD2 4.01Å; V200-Y204 HydrophobicContact CG1-CE2 3.6Å; V200-Y204 WeakPolarHBondContact O-CD2 3.22Å; S202-Y204 VanDerWaalsContact C-N 3.34Å; S202-Y204 PolarHBondContact O-N 3.49Å; Y204-F208 WeakPolarHBondContact O-CB 3.28Å; Y204-F208 PolarHBondContact O-N 3.47Å
205	Q	25.7	Very low	26	Very low	136 Å²	136	120 Å²	120	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-67.7	-36.6	171.6	-84	-177.5	-9.6	0	0	112.6	S202 F208 T209	S202-Q205 PolarHBondContact O-N 3.26Å; Q205-F208 PolarHBondContact O-N 2.96Å; Q205-T209 PolarHBondContact O-N 3.48Å; Q205-T209 VanDerWaalsContact O-N 3.09Å; Q205-T209 PolarHBondContact O-OG1 3.37Å
206	V	23.4	Very low	26.3	Very low	94 Å²	94	118 Å²	118	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-66.9	-44.5	175.9	175.6	0	0	0	0	110.7	S202 E203 F208 T209 V210	S202-V206 WeakPolarHBondContact O-CG2 3.49Å; S202-V206 PolarHBondContact O-N 3.32Å; E203-V206 PolarHBondContact O-N 3.04Å; V206-F208 VanDerWaalsContact C-N 3.34Å; V206-F208 PolarHBondContact O-N 2.95Å; V206-T209 PolarHBondContact O-N 3.24Å; V206-V210 WeakPolarHBondContact O-CG2 3.42Å; V206-V210 PolarHBondContact O-N 3.42Å
207	Y	24.5	Very low	26.5	Very low	178 Å²	178	117 Å²	117	70%	0.698	59%	0.588	S	S	*	*	H	α-helix	trans	-60.8	-41.3	175.1	-104.9	-84.7	0	0	0	112.6	E203 T209 V210 V211	E203-Y207 PolarHBondContact O-N 3.42Å; E203-Y207 VanDerWaalsContact O-N 3.07Å; Y207-T209 VanDerWaalsContact C-N 3.31Å; Y207-T209 PolarHBondContact O-N 2.9Å; Y207-V210 PolarHBondContact O-N 3.49Å; Y207-V211 WeakPolarHBondContact O-CG2 3.47Å; Y207-V211 PolarHBondContact O-N 2.93Å; Y207-V211 VanDerWaalsContact O-N 3.11Å
208	F	27.6	Very low	26.8	Very low	152 Å²	152	112.5 Å²	112.5	67%	0.667	57%	0.569	S	S	*	*	H	α-helix	trans	-61.8	-39.6	176.8	-155.7	-91.2	0	0	0	112.2	Y204 Q205 V206 A212	Y204-F208 WeakPolarHBondContact O-CB 3.28Å; Y204-F208 PolarHBondContact O-N 3.47Å; Q205-F208 PolarHBondContact O-N 2.96Å; V206-F208 VanDerWaalsContact C-N 3.34Å; V206-F208 PolarHBondContact O-N 2.95Å; F208-A212 WeakPolarHBondContact O-CB 3.29Å; F208-A212 PolarHBondContact O-N 3.4Å; F208-A212 VanDerWaalsContact O-N 3.16Å
209	T	26.5	Very low	27.2	Very low	88 Å²	88	106.8 Å²	106.8	54%	0.54	54%	0.538	S	S	.	.	H	α-helix	trans	-67.7	-41.3	178	-52.5	0	0	0	0	111.6	Q205 V206 Y207 A212 V213	Q205-T209 PolarHBondContact O-N 3.48Å; Q205-T209 VanDerWaalsContact O-N 3.09Å; Q205-T209 PolarHBondContact O-OG1 3.37Å; V206-T209 PolarHBondContact O-N 3.24Å; Y207-T209 VanDerWaalsContact C-N 3.31Å; Y207-T209 PolarHBondContact O-N 2.9Å; T209-A212 PolarHBondContact O-N 3.32Å; T209-V213 VanDerWaalsContact O-CG2 3.28Å; T209-V213 WeakPolarHBondContact O-CG2 3.24Å; T209-V213 PolarHBondContact O-N 2.92Å; T209-V213 VanDerWaalsContact O-N 3.09Å
210	V	24.3	Very low	27.4	Very low	81 Å²	81	108.9 Å²	108.9	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-39.3	178.9	173.6	0	0	0	0	112.2	V206 Y207 V213 R214	V206-V210 WeakPolarHBondContact O-CG2 3.42Å; V206-V210 PolarHBondContact O-N 3.42Å; Y207-V210 PolarHBondContact O-N 3.49Å; V210-V213 PolarHBondContact O-N 3.21Å; V210-R214 WeakPolarHBondContact O-CG 3.16Å; V210-R214 PolarHBondContact O-N 3.48Å; V210-R214 VanDerWaalsContact O-N 3.1Å
211	V	30.6	Very low	27.8	Very low	78 Å²	78	108.7 Å²	108.7	47%	0.473	54%	0.538	S	S	.	.	H	α-helix	trans	-67.1	-41.1	177	173.3	0	0	0	0	111.3	Y207 M215	Y207-V211 WeakPolarHBondContact O-CG2 3.47Å; Y207-V211 PolarHBondContact O-N 2.93Å; Y207-V211 VanDerWaalsContact O-N 3.11Å; V211-M215 WeakPolarHBondContact O-CB 3.5Å; V211-M215 VanDerWaalsContact O-CG 3.31Å; V211-M215 WeakPolarHBondContact O-CG 3.46Å; V211-M215 PolarHBondContact O-N 2.89Å; V211-M215 VanDerWaalsContact O-N 3.14Å
212	A	28.9	Very low	28.1	Very low	53 Å²	53	101.5 Å²	101.5	44%	0.438	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-38.3	176.6	0	0	0	0	0	113.1	F208 T209 S216	F208-A212 WeakPolarHBondContact O-CB 3.29Å; F208-A212 PolarHBondContact O-N 3.4Å; F208-A212 VanDerWaalsContact O-N 3.16Å; T209-A212 PolarHBondContact O-N 3.32Å; A212-S216 PolarHBondContact O-N 3.29Å; A212-S216 PolarHBondContact O-OG 2.9Å
213	V	26.7	Very low	28.4	Very low	82 Å²	82	99.3 Å²	99.3	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-67.7	-47.5	176.8	172	0	0	0	0	111.5	T209 V210 M215 S216 D217	T209-V213 VanDerWaalsContact O-CG2 3.28Å; T209-V213 WeakPolarHBondContact O-CG2 3.24Å; T209-V213 PolarHBondContact O-N 2.92Å; T209-V213 VanDerWaalsContact O-N 3.09Å; V210-V213 PolarHBondContact O-N 3.21Å; V213-M215 VanDerWaalsContact C-N 3.33Å; V213-M215 PolarHBondContact O-N 3.2Å; V213-S216 WeakPolarHBondContact O-CB 3.29Å; V213-S216 PolarHBondContact O-N 2.88Å; V213-S216 VanDerWaalsContact O-N 3.09Å; V213-D217 PolarHBondContact O-N 3.22Å
214	R	26.4	Very low	28.8	Very low	184 Å²	184	96.3 Å²	96.3	69%	0.694	49%	0.488	S	S	*	.	H	α-helix	trans	-60.8	-38.3	178.3	-78.3	-82.2	-163	162.9	3.5	113.2	V210 S216 D217 I218	V210-R214 WeakPolarHBondContact O-CG 3.16Å; V210-R214 PolarHBondContact O-N 3.48Å; V210-R214 VanDerWaalsContact O-N 3.1Å; R214-S216 VanDerWaalsContact C-N 3.29Å; R214-S216 PolarHBondContact O-N 2.94Å; R214-D217 PolarHBondContact O-N 2.8Å; R214-I218 WeakPolarHBondContact O-CG1 3.46Å; R214-I218 PolarHBondContact O-N 3.19Å
215	M	32.9	Very low	29.2	Very low	78 Å²	78	96.1 Å²	96.1	38%	0.384	49%	0.493	S	S	.	.	H	α-helix	trans	-66	-32	176	-76.9	-74	-153	0	0	112.4	V211 V213 Y219	V211-M215 WeakPolarHBondContact O-CB 3.5Å; V211-M215 VanDerWaalsContact O-CG 3.31Å; V211-M215 WeakPolarHBondContact O-CG 3.46Å; V211-M215 PolarHBondContact O-N 2.89Å; V211-M215 VanDerWaalsContact O-N 3.14Å; V213-M215 VanDerWaalsContact C-N 3.33Å; V213-M215 PolarHBondContact O-N 3.2Å; M215-Y219 WeakPolarHBondContact O-CB 3.3Å; M215-Y219 PolarHBondContact O-N 3.11Å; M215-Y219 VanDerWaalsContact O-N 3.11Å
216	S	30.2	Very low	29.3	Very low	70 Å²	70	98.2 Å²	98.2	49%	0.49	50%	0.496	S	S	.	.	H	α-helix	trans	-70.6	-35.6	176.6	-61.7	0	0	0	0	112.7	A212 V213 R214 Y219 M220	A212-S216 PolarHBondContact O-N 3.29Å; A212-S216 PolarHBondContact O-OG 2.9Å; V213-S216 WeakPolarHBondContact O-CB 3.29Å; V213-S216 PolarHBondContact O-N 2.88Å; V213-S216 VanDerWaalsContact O-N 3.09Å; R214-S216 VanDerWaalsContact C-N 3.29Å; R214-S216 PolarHBondContact O-N 2.94Å; S216-Y219 WeakPolarHBondContact O-CB 3.44Å; S216-Y219 PolarHBondContact O-N 3.01Å; S216-M220 WeakPolarHBondContact O-CG 3.49Å; S216-M220 PolarHBondContact O-N 3.19Å; S216-M220 VanDerWaalsContact O-N 3.09Å
217	D	30.8	Very low	29.7	Very low	98 Å²	98	97.4 Å²	97.4	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-69.8	-38.1	175.6	-74	-25.2	0	0	0	112.4	V213 R214 Y219 M220 N221	V213-D217 PolarHBondContact O-N 3.22Å; R214-D217 PolarHBondContact O-N 2.8Å; D217-Y219 VanDerWaalsContact C-N 3.31Å; D217-M220 PolarHBondContact O-N 3.2Å; D217-N221 PolarHBondContact O-N 3.47Å; D217-N221 VanDerWaalsContact O-N 3.16Å
218	I	31.8	Very low	30.1	Very low	97 Å²	97	96.5 Å²	96.5	50%	0.497	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-40.5	174	-65.3	167.4	0	0	0	110.2	R214 T222	R214-I218 WeakPolarHBondContact O-CG1 3.46Å; R214-I218 PolarHBondContact O-N 3.19Å; I218-T222 WeakPolarHBondContact O-CB 3.3Å; I218-T222 PolarHBondContact O-N 3.12Å; I218-T222 PolarHBondContact O-OG1 3.38Å
219	Y	31.4	Very low	30.3	Very low	64 Å²	64	96.5 Å²	96.5	25%	0.251	49%	0.488	S	S	.	.	H	α-helix	trans	-58.4	-51.3	174.7	167.5	-92	0	0	0	112.3	M215 S216 D217 N221 T222 V223 H239 C243	M215-Y219 WeakPolarHBondContact O-CB 3.3Å; M215-Y219 PolarHBondContact O-N 3.11Å; M215-Y219 VanDerWaalsContact O-N 3.11Å; S216-Y219 WeakPolarHBondContact O-CB 3.44Å; S216-Y219 PolarHBondContact O-N 3.01Å; D217-Y219 VanDerWaalsContact C-N 3.31Å; Y219-N221 PolarHBondContact O-N 2.9Å; Y219-T222 PolarHBondContact O-N 3.43Å; Y219-V223 HydrophobicContact CD2-CG2 4.39Å; Y219-V223 HydrophobicContact CE1-CG2 4.49Å; Y219-V223 HydrophobicContact CE2-CG2 4.07Å; Y219-V223 WeakPolarHBondContact O-CG2 3.35Å; Y219-V223 PolarHBondContact O-N 3.32Å; Y219-H239 PolarHBondContact OH-CD2 3.44Å; Y219-H239 VanDerWaalsContact OH-CD2 3.27Å; Y219-C243 WeakPolarHBondContact CE2-SG 3.49Å; Y219-C243 PolarHBondContact OH-SG 3.29Å
220	M	30.4	Very low	30.7	Very low	98 Å²	98	96.4 Å²	96.4	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-63.2	-39.5	-178.7	-71.4	-63.9	-113.1	0	0	112.8	S216 D217 N224	S216-M220 WeakPolarHBondContact O-CG 3.49Å; S216-M220 PolarHBondContact O-N 3.19Å; S216-M220 VanDerWaalsContact O-N 3.09Å; D217-M220 PolarHBondContact O-N 3.2Å; M220-N224 WeakPolarHBondContact O-CB 3.32Å; M220-N224 PolarHBondContact O-N 2.88Å; M220-N224 PolarHBondContact O-ND2 3.49Å
221	N	33.1	Very low	31.1	Very low	102 Å²	102	95.5 Å²	95.5	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-68.9	-38.1	177.1	-82	-29.5	0	0	0	112.8	D217 Y219 Q225	D217-N221 PolarHBondContact O-N 3.47Å; D217-N221 VanDerWaalsContact O-N 3.16Å; Y219-N221 PolarHBondContact O-N 2.9Å; N221-Q225 WeakPolarHBondContact O-CB 3.43Å; N221-Q225 WeakPolarHBondContact O-CG 3.37Å; N221-Q225 PolarHBondContact O-N 3.45Å; N221-Q225 VanDerWaalsContact O-N 3.07Å
222	T	31.4	Very low	31.2	Very low	50 Å²	50	97 Å²	97	31%	0.307	50%	0.498	S	S	.	.	H	α-helix	trans	-70.2	-41.2	-179.6	-50.3	0	0	0	0	111.3	I218 Y219 N224 Q225 Y226	I218-T222 WeakPolarHBondContact O-CB 3.3Å; I218-T222 PolarHBondContact O-N 3.12Å; I218-T222 PolarHBondContact O-OG1 3.38Å; Y219-T222 PolarHBondContact O-N 3.43Å; T222-N224 PolarHBondContact O-N 2.77Å; T222-Q225 PolarHBondContact O-N 3.2Å; T222-Y226 HydrophobicContact CG2-CD2 3.71Å; T222-Y226 HydrophobicContact CG2-CE2 3.83Å; T222-Y226 WeakPolarHBondContact O-CD2 3.45Å; T222-Y226 PolarHBondContact O-N 3.3Å
223	V	30.3	Very low	31.1	Very low	7 Å²	7	97 Å²	97	4%	0.042	50%	0.498	C	S	.	.	H	α-helix	trans	-64	-41.3	176.6	172.8	0	0	0	0	111.4	Y219 Q225 F227 T231 L234	Y219-V223 HydrophobicContact CD2-CG2 4.39Å; Y219-V223 HydrophobicContact CE1-CG2 4.49Å; Y219-V223 HydrophobicContact CE2-CG2 4.07Å; Y219-V223 WeakPolarHBondContact O-CG2 3.35Å; Y219-V223 PolarHBondContact O-N 3.32Å; V223-Q225 PolarHBondContact O-N 2.44Å; V223-F227 PolarHBondContact O-N 3.4Å; V223-T231 HydrophobicContact CG1-CG2 4.22Å; V223-L234 HydrophobicContact CG1-CD1 4.48Å
224	N	32	Very low	31.2	Very low	79 Å²	79	94 Å²	94	42%	0.422	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-36.3	175.9	-76.8	-25.1	0	0	0	112.7	M220 T222	M220-N224 WeakPolarHBondContact O-CB 3.32Å; M220-N224 PolarHBondContact O-N 2.88Å; M220-N224 PolarHBondContact O-ND2 3.49Å; T222-N224 PolarHBondContact O-N 2.77Å
225	Q	35.1	Very low	31.1	Very low	150 Å²	150	89 Å²	89	70%	0.701	47%	0.466	S	S	*	.	H	α-helix	trans	-72.7	-37.9	178.8	-78	179.6	2.1	0	0	113.7	N221 T222 V223	N221-Q225 WeakPolarHBondContact O-CB 3.43Å; N221-Q225 WeakPolarHBondContact O-CG 3.37Å; N221-Q225 PolarHBondContact O-N 3.45Å; N221-Q225 VanDerWaalsContact O-N 3.07Å; T222-Q225 PolarHBondContact O-N 3.2Å; V223-Q225 PolarHBondContact O-N 2.44Å
226	Y	28.4	Very low	30.7	Very low	180 Å²	180	92.5 Å²	92.5	71%	0.706	49%	0.485	S	S	*	.	H	α-helix	trans	-85	-25.8	-173.7	-88.6	-86.7	0	0	0	114.5	T222	T222-Y226 HydrophobicContact CG2-CD2 3.71Å; T222-Y226 HydrophobicContact CG2-CE2 3.83Å; T222-Y226 WeakPolarHBondContact O-CD2 3.45Å; T222-Y226 PolarHBondContact O-N 3.3Å
227	F	30.7	Very low	30.5	Very low	76 Å²	76	97.6 Å²	97.6	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-110	-7.5	-168.8	-72.2	-81.5	0	0	0	115.7	V223 R229 L234 I242	V223-F227 PolarHBondContact O-N 3.4Å; F227-R229 WeakPolarHBondContact O-CB 3.35Å; F227-R229 VanDerWaalsContact O-CG 3.29Å; F227-R229 WeakPolarHBondContact O-CG 3.27Å; F227-R229 PolarHBondContact O-N 2.9Å; F227-L234 HydrophobicContact CB-CD1 3.96Å; F227-L234 HydrophobicContact CD1-CD2 4.07Å; F227-L234 HydrophobicContact CG-CD1 4.22Å; F227-L234 HydrophobicContact CG-CD2 4.35Å; F227-I242 HydrophobicContact CD2-CD1 4.11Å; F227-I242 HydrophobicContact CE1-CD1 4.02Å; F227-I242 HydrophobicContact CE2-CD1 3.31Å; F227-I242 HydrophobicContact CE2-CG1 4.16Å; F227-I242 HydrophobicContact CZ-CD1 3.26Å; F227-I242 HydrophobicContact CZ-CG1 4Å
228	N	33.9	Very low	30.2	Very low	160 Å²	160	99.9 Å²	99.9	86%	0.856	50%	0.496	S	S	*	.			trans	42.5	30.3	178.1	-108.2	1	0	0	0	113.6
229	R	30.4	Very low	29.9	Very low	151 Å²	151	97.3 Å²	97.3	57%	0.57	48%	0.482	S	S	*	.	S	Bend	trans	-134.7	137.2	-173	-82.5	-175.3	-177.2	-157.9	2.7	107.8	F227 T231	F227-R229 WeakPolarHBondContact O-CB 3.35Å; F227-R229 VanDerWaalsContact O-CG 3.29Å; F227-R229 WeakPolarHBondContact O-CG 3.27Å; F227-R229 PolarHBondContact O-N 2.9Å; R229-T231 PolarHBondContact O-N 2.79Å
230	P	35	Very low	29.7	Very low	86 Å²	86	100.7 Å²	100.7	56%	0.558	50%	0.495	S	S	*	.			trans	-55.8	134.4	168.7	24.9	-31.6	0	0	0	108.4	S232 A233	P230-S232 PolarHBondContact O-N 2.89Å; P230-A233 HydrophobicContact CG-CB 4.35Å; P230-A233 PolarHBondContact O-N 3.27Å
231	T	33.8	Very low	29.4	Very low	62 Å²	62	102.4 Å²	102.4	38%	0.38	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-50.5	-19	178	18.2	0	0	0	0	113.1	V223 R229 A233	V223-T231 HydrophobicContact CG1-CG2 4.22Å; R229-T231 PolarHBondContact O-N 2.79Å; T231-A233 VanDerWaalsContact C-N 3.34Å; T231-A233 PolarHBondContact O-N 2.87Å
232	S	31.3	Very low	29	Very low	110 Å²	110	99.2 Å²	99.2	77%	0.769	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-73.4	-12.8	173.5	56.5	0	0	0	0	115.7	P230	P230-S232 PolarHBondContact O-N 2.89Å
233	A	27.8	Very low	28.7	Very low	54 Å²	54	98.9 Å²	98.9	45%	0.446	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-112.3	3.9	-176	0	0	0	0	0	114.3	P230 T231	P230-A233 HydrophobicContact CG-CB 4.35Å; P230-A233 PolarHBondContact O-N 3.27Å; T231-A233 VanDerWaalsContact C-N 3.34Å; T231-A233 PolarHBondContact O-N 2.87Å
234	L	27.6	Very low	28.5	Very low	19 Å²	19	99.8 Å²	99.8	10%	0.099	49%	0.486	C	S	.	.	S	Bend	trans	-91.2	108.4	169.8	-85.7	143.5	0	0	0	107.8	V223 F227 L236 Y238	V223-L234 HydrophobicContact CG1-CD1 4.48Å; F227-L234 HydrophobicContact CB-CD1 3.96Å; F227-L234 HydrophobicContact CD1-CD2 4.07Å; F227-L234 HydrophobicContact CG-CD1 4.22Å; F227-L234 HydrophobicContact CG-CD2 4.35Å; L234-L236 PolarHBondContact O-N 3.49Å; L234-Y238 HydrophobicContact CD2-CG 4.47Å
235	D	25.3	Very low	28.2	Very low	77 Å²	77	96.9 Å²	96.9	41%	0.412	47%	0.474	S	S	.	.			trans	-43.3	130.6	170.9	-173.9	-19	0	0	0	108.2	R237 Y238 H239	D235-R237 PolarHBondContact O-N 3.1Å; D235-R237 IonicContact OD1-NE 3.3Å; D235-R237 PolarHBondContact OD1-NE 3.3Å; D235-R237 IonicContact OD1-NH2 3.81Å; D235-R237 IonicContact OD2-CZ 3.57Å; D235-R237 IonicContact OD2-NE 3.35Å; D235-R237 PolarHBondContact OD2-NE 3.37Å; D235-R237 IonicContact OD2-NH2 3Å; D235-R237 PolarHBondContact OD2-NH2 3.24Å; D235-Y238 HydrophobicContact CB-CD2 4.21Å; D235-Y238 WeakPolarHBondContact O-CB 2.91Å; D235-Y238 PolarHBondContact O-N 3.4Å; D235-H239 PolarHBondContact O-N 3.32Å
236	L	24.8	Very low	27.8	Very low	152 Å²	152	93 Å²	93	80%	0.796	46%	0.458	S	S	*	.	H	α-helix	trans	-47.1	-28.1	-175.1	-104.9	95.6	0	0	0	112.5	L234 H239 Y240	L234-L236 PolarHBondContact O-N 3.49Å; L236-H239 PolarHBondContact O-N 3.33Å; L236-Y240 VanDerWaalsContact O-CB 3.32Å; L236-Y240 WeakPolarHBondContact O-CB 3.43Å; L236-Y240 PolarHBondContact O-N 3.34Å
237	R	24.7	Very low	27.7	Very low	177 Å²	177	85.2 Å²	85.2	67%	0.668	43%	0.432	S	S	*	.	H	α-helix	trans	-65.8	-33.7	176.1	-70.1	178.7	-82.4	-168	-1.4	114.1	D235 F241	D235-R237 PolarHBondContact O-N 3.1Å; D235-R237 IonicContact OD1-NE 3.3Å; D235-R237 PolarHBondContact OD1-NE 3.3Å; D235-R237 IonicContact OD1-NH2 3.81Å; D235-R237 IonicContact OD2-CZ 3.57Å; D235-R237 IonicContact OD2-NE 3.35Å; D235-R237 PolarHBondContact OD2-NE 3.37Å; D235-R237 IonicContact OD2-NH2 3Å; D235-R237 PolarHBondContact OD2-NH2 3.24Å; R237-F241 WeakPolarHBondContact O-CD2 3.16Å; R237-F241 PolarHBondContact O-N 3.32Å; R237-F241 VanDerWaalsContact O-N 3.11Å
238	Y	25	Very low	27.5	Very low	147 Å²	147	81.7 Å²	81.7	58%	0.576	42%	0.417	S	S	*	.	H	α-helix	trans	-75.5	-38.3	173.9	-84	-87.5	0	0	0	112.1	L234 D235 Y240 F241 I242	L234-Y238 HydrophobicContact CD2-CG 4.47Å; D235-Y238 HydrophobicContact CB-CD2 4.21Å; D235-Y238 WeakPolarHBondContact O-CB 2.91Å; D235-Y238 PolarHBondContact O-N 3.4Å; Y238-Y240 VanDerWaalsContact C-N 3.31Å; Y238-F241 PolarHBondContact O-N 3.46Å; Y238-I242 VanDerWaalsContact O-CD1 3.3Å; Y238-I242 WeakPolarHBondContact O-CD1 3.48Å; Y238-I242 VanDerWaalsContact O-CG1 3.28Å; Y238-I242 WeakPolarHBondContact O-CG1 3.34Å; Y238-I242 PolarHBondContact O-N 3.09Å
239	H	26.6	Very low	27.2	Very low	43 Å²	43	78.1 Å²	78.1	20%	0.199	40%	0.395	C	S	.	.	H	α-helix	trans	-60.3	-43.4	170.1	-103.4	54	0	0	0	111.1	Y219 D235 L236 F241 I242 C243	Y219-H239 PolarHBondContact OH-CD2 3.44Å; Y219-H239 VanDerWaalsContact OH-CD2 3.27Å; D235-H239 PolarHBondContact O-N 3.32Å; L236-H239 PolarHBondContact O-N 3.33Å; H239-F241 PolarHBondContact O-N 3.21Å; H239-I242 PolarHBondContact O-N 2.7Å; H239-C243 VanDerWaalsContact O-CB 3.29Å; H239-C243 WeakPolarHBondContact O-CB 3.39Å; H239-C243 PolarHBondContact O-N 2.72Å; H239-C243 PolarHBondContact O-SG 2.84Å
240	Y	25.5	Very low	27.1	Very low	134 Å²	134	74.1 Å²	74.1	53%	0.525	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-40.3	177.8	-164.2	-99.6	0	0	0	112.6	L236 Y238 Q244	L236-Y240 VanDerWaalsContact O-CB 3.32Å; L236-Y240 WeakPolarHBondContact O-CB 3.43Å; L236-Y240 PolarHBondContact O-N 3.34Å; Y238-Y240 VanDerWaalsContact C-N 3.31Å; Y240-Q244 HydrophobicContact CD1-CG 4.25Å; Y240-Q244 HydrophobicContact CE1-CG 4.1Å; Y240-Q244 WeakPolarHBondContact O-CB 3.49Å; Y240-Q244 WeakPolarHBondContact O-CG 3.39Å; Y240-Q244 PolarHBondContact O-N 2.76Å
241	F	24.1	Very low	26.7	Very low	135 Å²	135	70.3 Å²	70.3	59%	0.592	36%	0.36	S	S	*	.	H	α-helix	trans	-72.5	-36.3	178.6	-105.2	-84.1	0	0	0	114	R237 Y238 H239 G245	R237-F241 WeakPolarHBondContact O-CD2 3.16Å; R237-F241 PolarHBondContact O-N 3.32Å; R237-F241 VanDerWaalsContact O-N 3.11Å; Y238-F241 PolarHBondContact O-N 3.46Å; H239-F241 PolarHBondContact O-N 3.21Å; F241-G245 PolarHBondContact O-N 2.89Å
242	I	25.6	Very low	26.5	Very low	34 Å²	34	72 Å²	72	17%	0.174	37%	0.367	C	S	.	.	H	α-helix	trans	-73.1	-38.8	176.3	-63.8	156.9	0	0	0	110.1	F227 Y238 H239 G245 L246	F227-I242 HydrophobicContact CD2-CD1 4.11Å; F227-I242 HydrophobicContact CE1-CD1 4.02Å; F227-I242 HydrophobicContact CE2-CD1 3.31Å; F227-I242 HydrophobicContact CE2-CG1 4.16Å; F227-I242 HydrophobicContact CZ-CD1 3.26Å; F227-I242 HydrophobicContact CZ-CG1 4Å; Y238-I242 VanDerWaalsContact O-CD1 3.3Å; Y238-I242 WeakPolarHBondContact O-CD1 3.48Å; Y238-I242 VanDerWaalsContact O-CG1 3.28Å; Y238-I242 WeakPolarHBondContact O-CG1 3.34Å; Y238-I242 PolarHBondContact O-N 3.09Å; H239-I242 PolarHBondContact O-N 2.7Å; I242-G245 PolarHBondContact O-N 3.11Å; I242-L246 HydrophobicContact CG2-CD1 4.04Å; I242-L246 WeakPolarHBondContact O-CB 2.81Å
243	C	24.7	Very low	26.5	Very low	44 Å²	44	67.7 Å²	67.7	30%	0.297	33%	0.334	S	S	.	.	H	α-helix	trans	-57.8	-54.6	170	-73.2	0	0	0	0	110.3	Y219 H239 G245 L246 G247 E433	Y219-C243 WeakPolarHBondContact CE2-SG 3.49Å; Y219-C243 PolarHBondContact OH-SG 3.29Å; H239-C243 VanDerWaalsContact O-CB 3.29Å; H239-C243 WeakPolarHBondContact O-CB 3.39Å; H239-C243 PolarHBondContact O-N 2.72Å; H239-C243 PolarHBondContact O-SG 2.84Å; C243-G245 PolarHBondContact O-N 3.21Å; C243-G245 VanDerWaalsContact O-N 3.14Å; C243-L246 WeakPolarHBondContact O-CA 2.91Å; C243-L246 PolarHBondContact O-N 3.47Å; C243-G247 PolarHBondContact O-N 2.86Å; C243-G247 VanDerWaalsContact O-N 3.09Å; C243-E433 VanDerWaalsContact O-OE1 3.14Å
244	Q	26.6	Very low	26.7	Very low	25 Å²	25	68 Å²	68	12%	0.117	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17	177.1	-83.9	-158.2	-12.2	0	0	115.3	Y240 R429 T430 E433 S434	Y240-Q244 HydrophobicContact CD1-CG 4.25Å; Y240-Q244 HydrophobicContact CE1-CG 4.1Å; Y240-Q244 WeakPolarHBondContact O-CB 3.49Å; Y240-Q244 WeakPolarHBondContact O-CG 3.39Å; Y240-Q244 PolarHBondContact O-N 2.76Å; Q244-R429 CarbonylContact O-C 3.4Å; Q244-T430 HydrophobicContact CB-CG2 3.85Å; Q244-T430 HydrophobicContact CG-CG2 4.44Å; Q244-T430 WeakPolarHBondContact O-CA 3.37Å; Q244-E433 VanDerWaalsContact C-CD 3.45Å; Q244-E433 WeakPolarHBondContact CA-OE1 3.44Å; Q244-E433 WeakPolarHBondContact CA-OE2 3.38Å; Q244-E433 PolarHBondContact N-OE2 3.43Å; Q244-S434 PolarHBondContact NE2-OG 2.82Å
245	G	24.8	Very low	26.8	Very low	18 Å²	18	71.5 Å²	71.5	19%	0.186	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	17	172.9	0	0	0	0	0	111.6	F241 I242 C243 R429	F241-G245 PolarHBondContact O-N 2.89Å; I242-G245 PolarHBondContact O-N 3.11Å; C243-G245 PolarHBondContact O-N 3.21Å; C243-G245 VanDerWaalsContact O-N 3.14Å; G245-R429 VanDerWaalsContact C-NE 3.34Å; G245-R429 WeakPolarHBondContact O-CD 3.39Å; G245-R429 PolarHBondContact O-NE 3.3Å; G245-R429 PolarHBondContact O-NH1 3.18Å
246	L	27	Very low	27.2	Very low	70 Å²	70	70.6 Å²	70.6	37%	0.366	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-48.9	-175.2	-96.6	148.3	0	0	0	112.8	I242 C243 S248 H249 R429 E433	I242-L246 HydrophobicContact CG2-CD1 4.04Å; I242-L246 WeakPolarHBondContact O-CB 2.81Å; C243-L246 WeakPolarHBondContact O-CA 2.91Å; C243-L246 PolarHBondContact O-N 3.47Å; L246-S248 VanDerWaalsContact C-N 3.3Å; L246-S248 PolarHBondContact O-N 3Å; L246-H249 PolarHBondContact O-N 3.05Å; L246-R429 VanDerWaalsContact CA-CZ 3.43Å; L246-R429 PolarHBondContact O-NE 3.1Å; L246-R429 VanDerWaalsContact O-NE 3.11Å; L246-R429 PolarHBondContact O-NH2 2.94Å; L246-E433 PolarHBondContact N-OE1 3.11Å; L246-E433 VanDerWaalsContact N-OE1 3.07Å
247	G	26	Very low	27.6	Very low	15 Å²	15	65.2 Å²	65.2	16%	0.155	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-7.7	175.8	0	0	0	0	0	118.3	C243 I250 A251 E433	C243-G247 PolarHBondContact O-N 2.86Å; C243-G247 VanDerWaalsContact O-N 3.09Å; G247-I250 CarbonylContact O-C 3.41Å; G247-I250 WeakPolarHBondContact O-CA 3.42Å; G247-I250 VanDerWaalsContact O-CB 3.23Å; G247-I250 WeakPolarHBondContact O-CB 3.3Å; G247-I250 PolarHBondContact O-N 3.06Å; G247-A251 PolarHBondContact O-N 2.81Å; G247-E433 WeakPolarHBondContact CA-OE1 3.36Å; G247-E433 WeakPolarHBondContact CA-OE2 3.44Å; G247-E433 PolarHBondContact N-OE1 3.33Å; G247-E433 PolarHBondContact N-OE2 3.23Å; G247-E433 WeakPolarHBondContact O-CG 3.49Å
248	S	26.4	Very low	28	Very low	3 Å²	3	62.5 Å²	62.5	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-98.6	-11.8	175	-71.2	0	0	0	0	112.2	L246 L252 R429 A432 E433	L246-S248 VanDerWaalsContact C-N 3.3Å; L246-S248 PolarHBondContact O-N 3Å; S248-L252 WeakPolarHBondContact O-CB 3.41Å; S248-L252 PolarHBondContact O-N 3.35Å; S248-R429 VanDerWaalsContact CB-CG 3.5Å; S248-R429 WeakPolarHBondContact CB-O 3.4Å; S248-R429 WeakPolarHBondContact OG-CA 3.48Å; S248-R429 PolarHBondContact OG-O 3.16Å; S248-A432 WeakPolarHBondContact OG-CB 3.4Å; S248-A432 PolarHBondContact OG-N 3.46Å; S248-E433 PolarHBondContact N-OE1 3.07Å; S248-E433 VanDerWaalsContact OG-CG 3.3Å; S248-E433 WeakPolarHBondContact OG-CG 3.26Å; S248-E433 PolarHBondContact OG-N 3.3Å
249	H	27.8	Very low	28.4	Very low	84 Å²	84	59.3 Å²	59.3	39%	0.389	31%	0.308	S	S	.	.	H	α-helix	trans	-66.3	-32.2	153.7	-73.3	-151.7	0	0	0	108.2	L246 L253 R429	L246-H249 PolarHBondContact O-N 3.05Å; H249-L253 WeakPolarHBondContact O-CB 3Å; H249-L253 PolarHBondContact O-N 2.93Å; H249-R429 VanDerWaalsContact CB-NH2 3.3Å; H249-R429 WeakPolarHBondContact CD2-CD 3.49Å; H249-R429 VanDerWaalsContact CD2-CG 3.43Å; H249-R429 WeakPolarHBondContact CD2-CG 3.46Å; H249-R429 PolarHBondContact CD2-NE 3.36Å; H249-R429 PolarHBondContact CE1-NH1 2.75Å; H249-R429 VanDerWaalsContact ND1-CZ 3.33Å; H249-R429 PolarHBondContact ND1-NH2 2.8Å; H249-R429 VanDerWaalsContact NE2-CD 3.26Å; H249-R429 WeakPolarHBondContact NE2-CD 3.31Å; H249-R429 PolarHBondContact NE2-NE 3.11Å
250	I	28.4	Very low	28.7	Very low	68 Å²	68	58 Å²	58	35%	0.349	30%	0.304	S	S	.	.	H	α-helix	trans	-71.6	-36.7	173.4	-52.2	178.2	0	0	0	111.8	G247 L253 N254	G247-I250 CarbonylContact O-C 3.41Å; G247-I250 WeakPolarHBondContact O-CA 3.42Å; G247-I250 VanDerWaalsContact O-CB 3.23Å; G247-I250 WeakPolarHBondContact O-CB 3.3Å; G247-I250 PolarHBondContact O-N 3.06Å; I250-L253 WeakPolarHBondContact O-CB 3.43Å; I250-L253 PolarHBondContact O-N 3.37Å; I250-N254 WeakPolarHBondContact O-CB 3.14Å; I250-N254 VanDerWaalsContact O-CG 3.28Å; I250-N254 PolarHBondContact O-N 2.82Å; I250-N254 PolarHBondContact O-ND2 3.04Å
251	A	26.7	Very low	29.1	Very low	5 Å²	5	56.4 Å²	56.4	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-75	-37.4	176.4	0	0	0	0	0	113	G247 L253 N254 V255 A432	G247-A251 PolarHBondContact O-N 2.81Å; A251-L253 VanDerWaalsContact C-N 3.31Å; A251-N254 PolarHBondContact O-N 3.43Å; A251-V255 WeakPolarHBondContact O-CG2 3.38Å; A251-V255 PolarHBondContact O-N 3.06Å; A251-A432 HydrophobicContact CB-CB 3.57Å
252	L	30.1	Very low	29.5	Very low	99 Å²	99	53.7 Å²	53.7	52%	0.518	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-39.8	170.4	-159.1	92	0	0	0	110.3	S248 V255 M256	S248-L252 WeakPolarHBondContact O-CB 3.41Å; S248-L252 PolarHBondContact O-N 3.35Å; L252-V255 PolarHBondContact O-N 3.44Å; L252-M256 HydrophobicContact CD2-SD 4.32Å; L252-M256 HydrophobicContact CG-SD 4.42Å; L252-M256 VanDerWaalsContact O-CB 3.25Å; L252-M256 WeakPolarHBondContact O-CB 3.39Å; L252-M256 WeakPolarHBondContact O-CG 3.15Å; L252-M256 PolarHBondContact O-N 2.9Å
253	L	30.8	Very low	29.7	Very low	18 Å²	18	55.3 Å²	55.3	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-41.6	171.6	-160.6	82.6	0	0	0	111.2	H249 I250 A251 V257 L283 F286	H249-L253 WeakPolarHBondContact O-CB 3Å; H249-L253 PolarHBondContact O-N 2.93Å; I250-L253 WeakPolarHBondContact O-CB 3.43Å; I250-L253 PolarHBondContact O-N 3.37Å; A251-L253 VanDerWaalsContact C-N 3.31Å; L253-V257 HydrophobicContact CG-CG2 4.45Å; L253-V257 WeakPolarHBondContact O-CA 3.27Å; L253-V257 WeakPolarHBondContact O-CB 3.31Å; L253-V257 WeakPolarHBondContact O-CG2 3.18Å; L253-V257 PolarHBondContact O-N 3.37Å; L253-L283 HydrophobicContact CD2-CD2 3.86Å; L253-F286 HydrophobicContact CD1-CD2 3.57Å; L253-F286 HydrophobicContact CD1-CE1 4.23Å; L253-F286 HydrophobicContact CD1-CE2 3.09Å; L253-F286 HydrophobicContact CD1-CG 4.33Å; L253-F286 HydrophobicContact CD1-CZ 3.47Å; L253-F286 VanDerWaalsContact CD1-CZ 3.47Å
254	N	31.7	Very low	30	Very low	61 Å²	61	53.8 Å²	53.8	33%	0.326	30%	0.298	S	S	.	.	H	α-helix	trans	-69.1	-34.8	177.7	-80.9	-21.6	0	0	0	113.4	I250 A251 V257 H258	I250-N254 WeakPolarHBondContact O-CB 3.14Å; I250-N254 VanDerWaalsContact O-CG 3.28Å; I250-N254 PolarHBondContact O-N 2.82Å; I250-N254 PolarHBondContact O-ND2 3.04Å; A251-N254 PolarHBondContact O-N 3.43Å; N254-V257 CarbonylContact O-C 3.59Å; N254-H258 VanDerWaalsContact O-CB 3.28Å; N254-H258 WeakPolarHBondContact O-CB 3.25Å; N254-H258 PolarHBondContact O-N 3.3Å
255	V	30.2	Very low	30.3	Very low	93 Å²	93	59.1 Å²	59.1	56%	0.564	32%	0.322	S	S	*	.	H	α-helix	trans	-76.3	-39.3	175	172.1	0	0	0	0	110.9	A251 L252 V257 H258 V259	A251-V255 WeakPolarHBondContact O-CG2 3.38Å; A251-V255 PolarHBondContact O-N 3.06Å; L252-V255 PolarHBondContact O-N 3.44Å; V255-V257 VanDerWaalsContact C-N 3.31Å; V255-H258 PolarHBondContact O-N 3.05Å; V255-V259 HydrophobicContact CG1-CG2 4.31Å; V255-V259 VanDerWaalsContact O-CB 3.31Å; V255-V259 WeakPolarHBondContact O-CB 3.33Å; V255-V259 VanDerWaalsContact O-CG2 3.27Å; V255-V259 WeakPolarHBondContact O-CG2 3.29Å; V255-V259 PolarHBondContact O-N 3.45Å
256	M	33.1	Very low	30.7	Very low	58 Å²	58	63 Å²	63	29%	0.286	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-36.8	171.5	-71.6	-178.1	79	0	0	111.2	L252 A260 L282 Y339	L252-M256 HydrophobicContact CD2-SD 4.32Å; L252-M256 HydrophobicContact CG-SD 4.42Å; L252-M256 VanDerWaalsContact O-CB 3.25Å; L252-M256 WeakPolarHBondContact O-CB 3.39Å; L252-M256 WeakPolarHBondContact O-CG 3.15Å; L252-M256 PolarHBondContact O-N 2.9Å; M256-A260 WeakPolarHBondContact O-CA 3.36Å; M256-A260 WeakPolarHBondContact O-CB 3Å; M256-A260 PolarHBondContact O-N 3.24Å; M256-L282 HydrophobicContact CE-CD2 4.13Å; M256-Y339 HydrophobicContact CE-CE2 4.23Å
257	V	33.4	Very low	30.7	Very low	39 Å²	39	61.7 Å²	61.7	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-69.8	-37.4	171.3	168.5	0	0	0	0	110.4	L253 N254 V255 A260 H261	L253-V257 HydrophobicContact CG-CG2 4.45Å; L253-V257 WeakPolarHBondContact O-CA 3.27Å; L253-V257 WeakPolarHBondContact O-CB 3.31Å; L253-V257 WeakPolarHBondContact O-CG2 3.18Å; L253-V257 PolarHBondContact O-N 3.37Å; N254-V257 CarbonylContact O-C 3.59Å; V255-V257 VanDerWaalsContact C-N 3.31Å; V257-A260 CarbonylContact O-C 3.47Å; V257-H261 VanDerWaalsContact O-CA 3.29Å; V257-H261 WeakPolarHBondContact O-CA 3.27Å; V257-H261 WeakPolarHBondContact O-CB 3.19Å; V257-H261 PolarHBondContact O-N 3.2Å
258	H	34.1	Very low	30.9	Very low	120 Å²	120	64.8 Å²	64.8	56%	0.556	34%	0.344	S	S	*	.	H	α-helix	trans	-71.6	-41.7	176.6	-122.4	48	0	0	0	112.8	N254 V255 H261 S262	N254-H258 VanDerWaalsContact O-CB 3.28Å; N254-H258 WeakPolarHBondContact O-CB 3.25Å; N254-H258 PolarHBondContact O-N 3.3Å; V255-H258 PolarHBondContact O-N 3.05Å; H258-H261 CarbonylContact O-C 3.53Å; H258-H261 PolarHBondContact O-N 2.97Å; H258-S262 WeakPolarHBondContact O-CB 3.3Å; H258-S262 PolarHBondContact O-N 3.01Å; H258-S262 PolarHBondContact O-OG 3.28Å
259	V	32.5	Very low	31.2	Very low	80 Å²	80	73.3 Å²	73.3	49%	0.485	38%	0.381	S	S	.	.	H	α-helix	trans	-68.7	-40.8	174.4	171.5	0	0	0	0	109.6	V255 H261 L263	V255-V259 HydrophobicContact CG1-CG2 4.31Å; V255-V259 VanDerWaalsContact O-CB 3.31Å; V255-V259 WeakPolarHBondContact O-CB 3.33Å; V255-V259 VanDerWaalsContact O-CG2 3.27Å; V255-V259 WeakPolarHBondContact O-CG2 3.29Å; V255-V259 PolarHBondContact O-N 3.45Å; V259-H261 VanDerWaalsContact C-N 3.3Å; V259-L263 HydrophobicContact CG1-CD1 3.84Å; V259-L263 WeakPolarHBondContact O-CB 3.48Å; V259-L263 WeakPolarHBondContact O-CD1 3.15Å; V259-L263 WeakPolarHBondContact O-CG 3.17Å; V259-L263 PolarHBondContact O-N 3.33Å
260	A	33.3	Very low	31.3	Very low	14 Å²	14	72.6 Å²	72.6	12%	0.116	38%	0.38	C	S	.	.	H	α-helix	trans	-65.7	-31.1	169	0	0	0	0	0	111.7	M256 V257 L263 V264 I278 L282	M256-A260 WeakPolarHBondContact O-CA 3.36Å; M256-A260 WeakPolarHBondContact O-CB 3Å; M256-A260 PolarHBondContact O-N 3.24Å; V257-A260 CarbonylContact O-C 3.47Å; A260-L263 CarbonylContact O-C 3.55Å; A260-V264 VanDerWaalsContact O-CA 3.29Å; A260-V264 WeakPolarHBondContact O-CA 3.37Å; A260-V264 WeakPolarHBondContact O-CB 3.35Å; A260-V264 WeakPolarHBondContact O-CG2 3.3Å; A260-V264 PolarHBondContact O-N 3.07Å; A260-I278 HydrophobicContact CB-CG2 4.39Å; A260-L282 HydrophobicContact CB-CD1 4.18Å
261	H	33.5	Very low	31.6	Very low	101 Å²	101	72.4 Å²	72.4	47%	0.468	38%	0.382	S	S	.	.	H	α-helix	trans	-79.4	-33.4	-179.7	-165.5	-97.7	0	0	0	111.2	V257 H258 V259 V264 H265	V257-H261 VanDerWaalsContact O-CA 3.29Å; V257-H261 WeakPolarHBondContact O-CA 3.27Å; V257-H261 WeakPolarHBondContact O-CB 3.19Å; V257-H261 PolarHBondContact O-N 3.2Å; H258-H261 CarbonylContact O-C 3.53Å; H258-H261 PolarHBondContact O-N 2.97Å; V259-H261 VanDerWaalsContact C-N 3.3Å; H261-V264 CarbonylContact O-C 3.56Å; H261-H265 WeakPolarHBondContact O-CB 3.09Å; H261-H265 PolarHBondContact O-N 3.3Å
262	S	32.3	Very low	31.9	Very low	78 Å²	78	77 Å²	77	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-75.9	-36.4	169.6	-68.5	0	0	0	0	111.8	H258 V264 H265 E266	H258-S262 WeakPolarHBondContact O-CB 3.3Å; H258-S262 PolarHBondContact O-N 3.01Å; H258-S262 PolarHBondContact O-OG 3.28Å; S262-V264 VanDerWaalsContact C-N 3.35Å; S262-H265 PolarHBondContact O-N 2.68Å; S262-E266 PolarHBondContact O-N 2.66Å; S262-E266 VanDerWaalsContact O-N 3.13Å
263	L	31.2	Very low	32.2	Very low	68 Å²	68	77.4 Å²	77.4	36%	0.356	41%	0.411	S	S	.	.	H	α-helix	trans	-67.4	-36.6	167.7	-84.8	157	0	0	0	111.2	V259 A260 E266 L267 F346	V259-L263 HydrophobicContact CG1-CD1 3.84Å; V259-L263 WeakPolarHBondContact O-CB 3.48Å; V259-L263 WeakPolarHBondContact O-CD1 3.15Å; V259-L263 WeakPolarHBondContact O-CG 3.17Å; V259-L263 PolarHBondContact O-N 3.33Å; A260-L263 CarbonylContact O-C 3.55Å; L263-E266 CarbonylContact O-C 3.45Å; L263-E266 PolarHBondContact O-N 3.14Å; L263-L267 HydrophobicContact CB-CD1 4.32Å; L263-L267 WeakPolarHBondContact O-CA 3.28Å; L263-L267 WeakPolarHBondContact O-CB 3.2Å; L263-L267 VanDerWaalsContact O-CD1 3.26Å; L263-L267 WeakPolarHBondContact O-CD1 3.45Å; L263-L267 WeakPolarHBondContact O-CG 3.29Å; L263-L267 PolarHBondContact O-N 3.09Å; L263-F346 HydrophobicContact CD1-CZ 4.07Å; L263-F346 HydrophobicContact CD2-CZ 4.1Å
264	V	29.8	Very low	32.4	Very low	13 Å²	13	78 Å²	78	8%	0.079	41%	0.412	C	S	.	.	H	α-helix	trans	-69.9	-39.5	174	156.3	0	0	0	0	109.5	A260 H261 S262 E266 L267 V268 A275	A260-V264 VanDerWaalsContact O-CA 3.29Å; A260-V264 WeakPolarHBondContact O-CA 3.37Å; A260-V264 WeakPolarHBondContact O-CB 3.35Å; A260-V264 WeakPolarHBondContact O-CG2 3.3Å; A260-V264 PolarHBondContact O-N 3.07Å; H261-V264 CarbonylContact O-C 3.56Å; S262-V264 VanDerWaalsContact C-N 3.35Å; V264-E266 VanDerWaalsContact C-N 3.26Å; V264-E266 PolarHBondContact O-N 3.33Å; V264-L267 CarbonylContact O-C 3.6Å; V264-L267 WeakPolarHBondContact O-CA 3.43Å; V264-L267 PolarHBondContact O-N 2.85Å; V264-V268 HydrophobicContact CG1-CG2 3.68Å; V264-V268 WeakPolarHBondContact O-CA 3.07Å; V264-V268 WeakPolarHBondContact O-CB 3.43Å; V264-V268 WeakPolarHBondContact O-CG2 3.5Å; V264-V268 PolarHBondContact O-N 2.95Å; V264-A275 HydrophobicContact CB-CB 4.4Å; V264-A275 HydrophobicContact CG1-CB 3.33Å; V264-A275 HydrophobicContact CG2-CB 4.12Å
265	H	33.4	Very low	32.7	Very low	137 Å²	137	75.9 Å²	75.9	63%	0.634	40%	0.404	S	S	*	.	H	α-helix	trans	-65.5	-29.9	176.7	-160.7	-84.3	0	0	0	112.1	H261 S262	H261-H265 WeakPolarHBondContact O-CB 3.09Å; H261-H265 PolarHBondContact O-N 3.3Å; S262-H265 PolarHBondContact O-N 2.68Å
266	E	32.8	Very low	33	Very low	100 Å²	100	74.4 Å²	74.4	47%	0.467	40%	0.401	S	S	.	.	H	α-helix	trans	-84.2	-33.7	169.5	-80.8	-73.4	150.1	0	0	112.8	S262 L263 V264 V268 H396	S262-E266 PolarHBondContact O-N 2.66Å; S262-E266 VanDerWaalsContact O-N 3.13Å; L263-E266 CarbonylContact O-C 3.45Å; L263-E266 PolarHBondContact O-N 3.14Å; V264-E266 VanDerWaalsContact C-N 3.26Å; V264-E266 PolarHBondContact O-N 3.33Å; E266-V268 PolarHBondContact O-N 3.23Å; E266-H396 IonicContact OE1-CE1 3.75Å; E266-H396 IonicContact OE1-ND1 2.72Å; E266-H396 IonicContact OE2-CE1 3.11Å; E266-H396 PolarHBondContact OE2-CE1 3.44Å; E266-H396 IonicContact OE2-ND1 3.21Å; E266-H396 PolarHBondContact OE2-ND1 3.44Å
267	L	28.2	Very low	33.1	Very low	42 Å²	42	72.7 Å²	72.7	22%	0.22	39%	0.392	C	S	.	.	H	α-helix	trans	-78.1	-0.5	169.5	-70.6	157.8	0	0	0	111.7	L263 V264 K269 L270	L263-L267 HydrophobicContact CB-CD1 4.32Å; L263-L267 WeakPolarHBondContact O-CA 3.28Å; L263-L267 WeakPolarHBondContact O-CB 3.2Å; L263-L267 VanDerWaalsContact O-CD1 3.26Å; L263-L267 WeakPolarHBondContact O-CD1 3.45Å; L263-L267 WeakPolarHBondContact O-CG 3.29Å; L263-L267 PolarHBondContact O-N 3.09Å; V264-L267 CarbonylContact O-C 3.6Å; V264-L267 WeakPolarHBondContact O-CA 3.43Å; V264-L267 PolarHBondContact O-N 2.85Å; L267-K269 PolarHBondContact O-N 3.21Å; L267-L270 HydrophobicContact CB-CD1 4.4Å; L267-L270 HydrophobicContact CD2-CD1 3.54Å; L267-L270 CarbonylContact O-C 3.15Å; L267-L270 WeakPolarHBondContact O-CA 3.32Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 2.85Å
268	V	28.6	Very low	33.4	Very low	79 Å²	79	73 Å²	73	48%	0.479	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.7	-174.1	141.7	0	0	0	0	111.3	V264 E266	V264-V268 HydrophobicContact CG1-CG2 3.68Å; V264-V268 WeakPolarHBondContact O-CA 3.07Å; V264-V268 WeakPolarHBondContact O-CB 3.43Å; V264-V268 WeakPolarHBondContact O-CG2 3.5Å; V264-V268 PolarHBondContact O-N 2.95Å; E266-V268 PolarHBondContact O-N 3.23Å
269	K	32.4	Very low	33.7	Very low	183 Å²	183	69.6 Å²	69.6	80%	0.796	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.5	152.9	-71.5	-179.2	178.1	172.4	0	113.2	L267	L267-K269 PolarHBondContact O-N 3.21Å
270	L	31.2	Very low	34	Very low	68 Å²	68	70.5 Å²	70.5	36%	0.356	38%	0.378	S	S	.	.	S	Bend	trans	-108	104.1	171.7	-62.6	139.4	0	0	0	107.7	L267	L267-L270 HydrophobicContact CB-CD1 4.4Å; L267-L270 HydrophobicContact CD2-CD1 3.54Å; L267-L270 CarbonylContact O-C 3.15Å; L267-L270 WeakPolarHBondContact O-CA 3.32Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 2.85Å
271	T	34.7	Very low	34.1	Very low	65 Å²	65	71.9 Å²	71.9	40%	0.399	39%	0.386	S	S	.	.			trans	5	135.2	177.9	49.8	0	0	0	0	119.9	E273 F274 F308	T271-E273 PolarHBondContact O-N 3.29Å; T271-F274 WeakPolarHBondContact O-CB 3Å; T271-F274 PolarHBondContact O-N 3.43Å; T271-F308 WeakPolarHBondContact OG1-CE1 3.2Å; T271-F308 WeakPolarHBondContact OG1-CZ 3.11Å
272	P	33.4	Very low	34.3	Very low	102 Å²	102	69 Å²	69	66%	0.662	37%	0.373	S	S	*	.	H	α-helix	trans	-48.1	-26	173.8	-27.1	32.6	0	0	0	115.4	A275 A276	P272-A275 PolarHBondContact O-N 3.5Å; P272-A276 PolarHBondContact O-N 2.98Å; P272-A276 VanDerWaalsContact O-N 3.15Å
273	E	34.7	Very low	34.3	Very low	107 Å²	107	68.8 Å²	68.8	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-63.8	-35.5	176	-63.2	168.6	172.7	0	0	112.6	T271 F277 F308	T271-E273 PolarHBondContact O-N 3.29Å; E273-F277 WeakPolarHBondContact O-CB 3.38Å; E273-F277 PolarHBondContact O-N 3.18Å; E273-F308 HydrophobicContact CB-CZ 4.45Å
274	F	35.8	Very low	34.3	Very low	29 Å²	29	66.2 Å²	66.2	13%	0.127	35%	0.354	C	S	.	.	H	α-helix	trans	-72.9	-36.2	178.8	-157.7	-114.5	0	0	0	112.5	T271 F277 I278 F308	T271-F274 WeakPolarHBondContact O-CB 3Å; T271-F274 PolarHBondContact O-N 3.43Å; F274-F277 HydrophobicContact CD2-CD1 4.34Å; F274-F277 HydrophobicContact CE2-CD1 4.38Å; F274-F277 WeakPolarHBondContact O-CB 3.46Å; F274-F277 PolarHBondContact O-N 3Å; F274-I278 HydrophobicContact CD1-CD1 4.03Å; F274-I278 HydrophobicContact CD1-CG1 4.5Å; F274-I278 HydrophobicContact CE1-CD1 3.63Å; F274-I278 HydrophobicContact CE1-CG1 4.31Å; F274-I278 HydrophobicContact CZ-CD1 4.22Å; F274-I278 PolarHBondContact O-N 3.46Å; F274-F308 HydrophobicContact CB-CE1 3.63Å; F274-F308 HydrophobicContact CB-CE2 4.3Å; F274-F308 HydrophobicContact CB-CZ 3.44Å; F274-F308 VanDerWaalsContact CB-CZ 3.44Å; F274-F308 AromaticContact CD2-CD1 3.77Å; F274-F308 HydrophobicContact CD2-CD1 3.77Å; F274-F308 AromaticContact CD2-CD2 3.93Å; F274-F308 HydrophobicContact CD2-CD2 3.93Å; F274-F308 AromaticContact CD2-CE1 3.54Å; F274-F308 HydrophobicContact CD2-CE1 3.54Å; F274-F308 AromaticContact CD2-CE2 3.73Å; F274-F308 HydrophobicContact CD2-CE2 3.73Å; F274-F308 AromaticContact CD2-CG 3.97Å; F274-F308 HydrophobicContact CD2-CG 3.97Å; F274-F308 AromaticContact CD2-CZ 3.54Å; F274-F308 HydrophobicContact CD2-CZ 3.54Å; F274-F308 HydrophobicContact CE2-CD1 4.26Å; F274-F308 HydrophobicContact CE2-CD2 4.44Å; F274-F308 HydrophobicContact CE2-CE1 4.45Å; F274-F308 HydrophobicContact CE2-CG 4.27Å; F274-F308 HydrophobicContact CG-CD1 4.38Å; F274-F308 AromaticContact CG-CE1 3.8Å; F274-F308 HydrophobicContact CG-CE1 3.8Å; F274-F308 HydrophobicContact CG-CE2 4.48Å; F274-F308 AromaticContact CG-CZ 3.88Å; F274-F308 HydrophobicContact CG-CZ 3.88Å
275	A	37.5	Very low	34.2	Very low	18 Å²	18	69 Å²	69	15%	0.149	37%	0.374	C	S	.	.	H	α-helix	trans	-65.5	-48.4	176	0	0	0	0	0	112	V264 P272 F277 T279	V264-A275 HydrophobicContact CB-CB 4.4Å; V264-A275 HydrophobicContact CG1-CB 3.33Å; V264-A275 HydrophobicContact CG2-CB 4.12Å; P272-A275 PolarHBondContact O-N 3.5Å; A275-F277 PolarHBondContact O-N 3.32Å; A275-T279 WeakPolarHBondContact O-CB 3.06Å; A275-T279 PolarHBondContact O-N 2.77Å; A275-T279 PolarHBondContact O-OG1 2.96Å
276	A	37.5	Very low	34	Very low	62 Å²	62	67.3 Å²	67.3	51%	0.512	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-38.3	173.5	0	0	0	0	0	111	P272 H280	P272-A276 PolarHBondContact O-N 2.98Å; P272-A276 VanDerWaalsContact O-N 3.15Å; A276-H280 VanDerWaalsContact O-CB 3.27Å; A276-H280 WeakPolarHBondContact O-CB 3.45Å; A276-H280 PolarHBondContact O-N 3.11Å
277	F	35.8	Very low	33.8	Very low	21 Å²	21	67 Å²	67	9%	0.092	37%	0.366	C	S	.	.	H	α-helix	trans	-66.5	-51.3	179.4	171.4	-95.6	0	0	0	114	E273 F274 A275 T279 H280 V281 M301 L304 V305	E273-F277 WeakPolarHBondContact O-CB 3.38Å; E273-F277 PolarHBondContact O-N 3.18Å; F274-F277 HydrophobicContact CD2-CD1 4.34Å; F274-F277 HydrophobicContact CE2-CD1 4.38Å; F274-F277 WeakPolarHBondContact O-CB 3.46Å; F274-F277 PolarHBondContact O-N 3Å; A275-F277 PolarHBondContact O-N 3.32Å; F277-T279 PolarHBondContact O-N 3.23Å; F277-H280 PolarHBondContact O-N 3.47Å; F277-H280 VanDerWaalsContact O-N 3.15Å; F277-V281 HydrophobicContact CD1-CG2 4.5Å; F277-V281 HydrophobicContact CD2-CG2 4.41Å; F277-V281 HydrophobicContact CE1-CG2 4.32Å; F277-V281 HydrophobicContact CE2-CG2 4.27Å; F277-V281 HydrophobicContact CZ-CG2 4.23Å; F277-V281 WeakPolarHBondContact O-CG2 3.37Å; F277-V281 PolarHBondContact O-N 2.95Å; F277-M301 HydrophobicContact CD2-CG 4.43Å; F277-M301 HydrophobicContact CE1-CE 4.2Å; F277-M301 HydrophobicContact CE2-CB 4.19Å; F277-M301 HydrophobicContact CE2-CE 4.22Å; F277-M301 HydrophobicContact CE2-CG 3.24Å; F277-M301 HydrophobicContact CZ-CE 3.58Å; F277-M301 HydrophobicContact CZ-CG 3.42Å; F277-M301 VanDerWaalsContact CZ-CG 3.42Å; F277-M301 HydrophobicContact CZ-SD 4.38Å; F277-L304 HydrophobicContact CD2-CB 4.28Å; F277-L304 HydrophobicContact CD2-CD1 4.01Å; F277-L304 HydrophobicContact CE2-CB 4.3Å; F277-V305 HydrophobicContact CE1-CG2 4.43Å; F277-V305 HydrophobicContact CE2-CG2 4.17Å; F277-V305 HydrophobicContact CZ-CG2 3.67Å
278	I	38.9	Very low	33.9	Very low	46 Å²	46	72.7 Å²	72.7	24%	0.236	40%	0.397	C	S	.	.	H	α-helix	trans	-59.4	-40.4	177	-72.6	-173.3	0	0	0	110.5	A260 F274 V281 L282	A260-I278 HydrophobicContact CB-CG2 4.39Å; F274-I278 HydrophobicContact CD1-CD1 4.03Å; F274-I278 HydrophobicContact CD1-CG1 4.5Å; F274-I278 HydrophobicContact CE1-CD1 3.63Å; F274-I278 HydrophobicContact CE1-CG1 4.31Å; F274-I278 HydrophobicContact CZ-CD1 4.22Å; F274-I278 PolarHBondContact O-N 3.46Å; I278-V281 PolarHBondContact O-N 3.3Å; I278-L282 HydrophobicContact CG2-CD1 3.78Å; I278-L282 HydrophobicContact CG2-CG 4.42Å; I278-L282 WeakPolarHBondContact O-CB 3.49Å; I278-L282 WeakPolarHBondContact O-CD1 3.23Å; I278-L282 WeakPolarHBondContact O-CG 3.4Å; I278-L282 PolarHBondContact O-N 3.23Å
279	T	40.9	Very low	34.2	Very low	48 Å²	48	70.6 Å²	70.6	29%	0.294	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-43.6	176.6	-52.9	0	0	0	0	111.4	A275 F277 L282 L283	A275-T279 WeakPolarHBondContact O-CB 3.06Å; A275-T279 PolarHBondContact O-N 2.77Å; A275-T279 PolarHBondContact O-OG1 2.96Å; F277-T279 PolarHBondContact O-N 3.23Å; T279-L282 PolarHBondContact O-N 2.87Å; T279-L283 HydrophobicContact CG2-CD1 3.89Å; T279-L283 WeakPolarHBondContact O-CB 3.39Å; T279-L283 WeakPolarHBondContact O-CD1 3.38Å; T279-L283 VanDerWaalsContact O-CG 3.23Å; T279-L283 WeakPolarHBondContact O-CG 2.83Å; T279-L283 PolarHBondContact O-N 3.46Å
280	H	38.9	Very low	34.5	Very low	99 Å²	99	66.3 Å²	66.3	46%	0.458	37%	0.373	S	S	.	.	H	α-helix	trans	-66.3	-39	178	-168.1	-85	0	0	0	112.7	A276 F277 L283 S284	A276-H280 VanDerWaalsContact O-CB 3.27Å; A276-H280 WeakPolarHBondContact O-CB 3.45Å; A276-H280 PolarHBondContact O-N 3.11Å; F277-H280 PolarHBondContact O-N 3.47Å; F277-H280 VanDerWaalsContact O-N 3.15Å; H280-L283 PolarHBondContact O-N 2.8Å; H280-S284 VanDerWaalsContact O-CB 3.28Å; H280-S284 WeakPolarHBondContact O-CB 3.5Å; H280-S284 PolarHBondContact O-N 3.46Å; H280-S284 PolarHBondContact O-OG 2.75Å
281	V	35.1	Very low	34.9	Very low	44 Å²	44	68.9 Å²	68.9	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-68.6	-41.6	176.9	173	0	0	0	0	111.4	F277 I278 S284 S285 M301	F277-V281 HydrophobicContact CD1-CG2 4.5Å; F277-V281 HydrophobicContact CD2-CG2 4.41Å; F277-V281 HydrophobicContact CE1-CG2 4.32Å; F277-V281 HydrophobicContact CE2-CG2 4.27Å; F277-V281 HydrophobicContact CZ-CG2 4.23Å; F277-V281 WeakPolarHBondContact O-CG2 3.37Å; F277-V281 PolarHBondContact O-N 2.95Å; I278-V281 PolarHBondContact O-N 3.3Å; V281-S284 WeakPolarHBondContact CA-OG 2.86Å; V281-S284 PolarHBondContact O-OG 3.25Å; V281-S285 PolarHBondContact O-N 2.72Å; V281-S285 PolarHBondContact O-OG 3.44Å; V281-M301 HydrophobicContact CB-CE 4.22Å; V281-M301 HydrophobicContact CG1-CE 3.78Å; V281-M301 HydrophobicContact CG2-CE 3.33Å; V281-M301 HydrophobicContact CG2-CG 4.47Å; V281-M301 HydrophobicContact CG2-SD 4.08Å
282	L	37.5	Very low	35.5	Very low	39 Å²	39	71.5 Å²	71.5	20%	0.204	39%	0.394	C	S	.	.	H	α-helix	trans	-61.4	-47.1	172.9	-74.4	167.7	0	0	0	110.3	M256 A260 I278 T279 S285 F286	M256-L282 HydrophobicContact CE-CD2 4.13Å; A260-L282 HydrophobicContact CB-CD1 4.18Å; I278-L282 HydrophobicContact CG2-CD1 3.78Å; I278-L282 HydrophobicContact CG2-CG 4.42Å; I278-L282 WeakPolarHBondContact O-CB 3.49Å; I278-L282 WeakPolarHBondContact O-CD1 3.23Å; I278-L282 WeakPolarHBondContact O-CG 3.4Å; I278-L282 PolarHBondContact O-N 3.23Å; T279-L282 PolarHBondContact O-N 2.87Å; L282-S285 WeakPolarHBondContact O-CB 3.36Å; L282-S285 PolarHBondContact O-N 3.11Å; L282-F286 WeakPolarHBondContact O-CD2 3.49Å; L282-F286 WeakPolarHBondContact O-CE2 3.15Å
283	L	33	Very low	36.1	Very low	74 Å²	74	68.8 Å²	68.8	39%	0.387	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-40.1	179.3	-75.4	163.4	0	0	0	113.6	L253 T279 H280 S285 F286	L253-L283 HydrophobicContact CD2-CD2 3.86Å; T279-L283 HydrophobicContact CG2-CD1 3.89Å; T279-L283 WeakPolarHBondContact O-CB 3.39Å; T279-L283 WeakPolarHBondContact O-CD1 3.38Å; T279-L283 VanDerWaalsContact O-CG 3.23Å; T279-L283 WeakPolarHBondContact O-CG 2.83Å; T279-L283 PolarHBondContact O-N 3.46Å; H280-L283 PolarHBondContact O-N 2.8Å; L283-S285 PolarHBondContact O-N 2.87Å; L283-F286 PolarHBondContact O-N 3.22Å; L283-F286 VanDerWaalsContact O-N 3.11Å
284	S	29.7	Very low	36.5	Very low	15 Å²	15	66.6 Å²	66.6	11%	0.105	36%	0.363	C	S	.	.	H	α-helix	trans	-73.8	-7.5	-178.3	47.1	0	0	0	0	114.4	H280 V281 F286	H280-S284 VanDerWaalsContact O-CB 3.28Å; H280-S284 WeakPolarHBondContact O-CB 3.5Å; H280-S284 PolarHBondContact O-N 3.46Å; H280-S284 PolarHBondContact O-OG 2.75Å; V281-S284 WeakPolarHBondContact CA-OG 2.86Å; V281-S284 PolarHBondContact O-OG 3.25Å; S284-F286 VanDerWaalsContact C-N 3.25Å
285	S	29.1	Very low	37	Very low	72 Å²	72	69.8 Å²	69.8	50%	0.503	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.1	169	-54.6	0	0	0	0	113.2	V281 L282 L283	V281-S285 PolarHBondContact O-N 2.72Å; V281-S285 PolarHBondContact O-OG 3.44Å; L282-S285 WeakPolarHBondContact O-CB 3.36Å; L282-S285 PolarHBondContact O-N 3.11Å; L283-S285 PolarHBondContact O-N 2.87Å
286	F	28	Very low	37.8	Very low	100 Å²	100	74.4 Å²	74.4	44%	0.439	39%	0.39	S	S	.	.	S	Bend	trans	-104.6	-14.4	-170.4	-69.9	-87.1	0	0	0	115.3	L253 L282 L283 S284	L253-F286 HydrophobicContact CD1-CD2 3.57Å; L253-F286 HydrophobicContact CD1-CE1 4.23Å; L253-F286 HydrophobicContact CD1-CE2 3.09Å; L253-F286 HydrophobicContact CD1-CG 4.33Å; L253-F286 HydrophobicContact CD1-CZ 3.47Å; L253-F286 VanDerWaalsContact CD1-CZ 3.47Å; L282-F286 WeakPolarHBondContact O-CD2 3.49Å; L282-F286 WeakPolarHBondContact O-CE2 3.15Å; L283-F286 PolarHBondContact O-N 3.22Å; L283-F286 VanDerWaalsContact O-N 3.11Å; S284-F286 VanDerWaalsContact C-N 3.25Å
287	D	28.6	Very low	38.1	Very low	95 Å²	95	73.7 Å²	73.7	51%	0.508	37%	0.374	S	S	.	.	S	Bend	trans	-87	153.8	178.1	-76.6	-28.6	0	0	0	112	V289	D287-V289 HydrophobicContact CB-CG2 3.5Å; D287-V289 WeakPolarHBondContact O-CG2 3.28Å; D287-V289 PolarHBondContact O-N 3.4Å
288	N	30.6	Very low	38.4	Very low	161 Å²	161	74.1 Å²	74.1	86%	0.861	38%	0.377	S	S	*	.			trans	-68.5	65.2	160.8	-85	-24.6	0	0	0	109.1	T290	N288-T290 PolarHBondContact O-N 3.27Å
289	V	35.4	Very low	38.9	Very low	35 Å²	35	77.2 Å²	77.2	21%	0.212	39%	0.391	C	S	.	.			trans	-71.3	122.6	177.4	-172.3	0	0	0	0	107.4	D287 E293 H294	D287-V289 HydrophobicContact CB-CG2 3.5Å; D287-V289 WeakPolarHBondContact O-CG2 3.28Å; D287-V289 PolarHBondContact O-N 3.4Å; V289-E293 HydrophobicContact CG1-CB 3.48Å; V289-E293 VanDerWaalsContact CG1-CB 3.48Å; V289-E293 HydrophobicContact CG1-CG 3.38Å; V289-H294 HydrophobicContact CG1-CB 3.95Å
290	T	38.2	Very low	39.2	Very low	92 Å²	92	78.5 Å²	78.5	56%	0.564	39%	0.393	S	S	*	.			trans	-59.4	150.9	170.6	56.7	0	0	0	0	109	N288 E292 E293 H294	N288-T290 PolarHBondContact O-N 3.27Å; T290-E292 PolarHBondContact O-N 2.75Å; T290-E292 VanDerWaalsContact O-N 3.08Å; T290-E293 PolarHBondContact O-N 3.18Å; T290-E293 WeakPolarHBondContact OG1-CB 3.04Å; T290-E293 PolarHBondContact OG1-N 2.77Å; T290-H294 PolarHBondContact O-N 3.29Å
291	L	40.1	Very low	39.1	Very low	122 Å²	122	75.3 Å²	75.3	64%	0.639	38%	0.379	S	S	*	.	H	α-helix	trans	-51.3	-36.9	177.7	-172	74.8	0	0	0	111.8	H294 K295	L291-H294 PolarHBondContact O-N 2.95Å; L291-K295 WeakPolarHBondContact O-CG 2.98Å; L291-K295 PolarHBondContact O-N 2.83Å
292	E	47.9	Very low	39.5	Very low	120 Å²	120	77.1 Å²	77.1	56%	0.561	38%	0.384	S	S	*	.	H	α-helix	trans	-67.6	-41.5	176	-74.2	-54.7	137.2	0	0	113.7	T290 H294 K295 R296	T290-E292 PolarHBondContact O-N 2.75Å; T290-E292 VanDerWaalsContact O-N 3.08Å; E292-H294 VanDerWaalsContact C-N 3.26Å; E292-H294 PolarHBondContact O-N 3.46Å; E292-K295 PolarHBondContact O-N 3.14Å; E292-K295 IonicContact OE1-NZ 2.83Å; E292-K295 PolarHBondContact OE1-NZ 3.13Å; E292-R296 PolarHBondContact O-N 3.46Å
293	E	45.3	Very low	39.9	Very low	45 Å²	45	81.9 Å²	81.9	21%	0.21	40%	0.403	C	S	.	.	H	α-helix	trans	-66.9	-32.5	174.8	179.3	71.3	-166.1	0	0	110.9	V289 T290 R296 R297	V289-E293 HydrophobicContact CG1-CB 3.48Å; V289-E293 VanDerWaalsContact CG1-CB 3.48Å; V289-E293 HydrophobicContact CG1-CG 3.38Å; T290-E293 PolarHBondContact O-N 3.18Å; T290-E293 WeakPolarHBondContact OG1-CB 3.04Å; T290-E293 PolarHBondContact OG1-N 2.77Å; E293-R296 VanDerWaalsContact CD-NH2 3.31Å; E293-R296 IonicContact OE1-CZ 3.69Å; E293-R296 IonicContact OE1-NH1 2.91Å; E293-R296 IonicContact OE1-NH2 3.31Å; E293-R296 PolarHBondContact OE1-NH2 2.63Å; E293-R296 IonicContact OE2-CZ 2.73Å; E293-R296 IonicContact OE2-NH1 3.11Å; E293-R296 PolarHBondContact OE2-NH1 2.62Å; E293-R296 IonicContact OE2-NH2 3.67Å; E293-R296 PolarHBondContact OE2-NH2 3.46Å; E293-R297 WeakPolarHBondContact O-CB 3.45Å; E293-R297 WeakPolarHBondContact O-CD 2.92Å; E293-R297 WeakPolarHBondContact O-CG 2.91Å; E293-R297 PolarHBondContact O-N 2.6Å; E293-R297 IonicContact OE1-CZ 3.82Å; E293-R297 VanDerWaalsContact OE1-CZ 3.31Å; E293-R297 IonicContact OE1-NE 3.67Å; E293-R297 PolarHBondContact OE1-NE 3.35Å; E293-R297 IonicContact OE1-NH2 2.8Å; E293-R297 PolarHBondContact OE1-NH2 3.48Å
294	H	42.5	Very low	40	Very low	62 Å²	62	81.6 Å²	81.6	29%	0.287	40%	0.402	S	S	.	.	H	α-helix	trans	-70.5	-40.4	174.2	-159.3	64.7	0	0	0	111.8	V289 T290 L291 E292 R297 L298	V289-H294 HydrophobicContact CG1-CB 3.95Å; T290-H294 PolarHBondContact O-N 3.29Å; L291-H294 PolarHBondContact O-N 2.95Å; E292-H294 VanDerWaalsContact C-N 3.26Å; E292-H294 PolarHBondContact O-N 3.46Å; H294-R297 PolarHBondContact O-N 3.45Å; H294-L298 VanDerWaalsContact O-CB 3.28Å; H294-L298 WeakPolarHBondContact O-CB 3.11Å; H294-L298 WeakPolarHBondContact O-CD1 3.48Å; H294-L298 VanDerWaalsContact O-CG 3.29Å; H294-L298 WeakPolarHBondContact O-CG 3.46Å; H294-L298 PolarHBondContact O-N 3.34Å
295	K	46.3	Very low	40.2	Very low	95 Å²	95	81 Å²	81	41%	0.413	40%	0.397	S	S	.	.	H	α-helix	trans	-61.8	-45.8	172.2	-74.9	176.6	-172.2	170.2	0	112.1	L291 E292 R297 L298 E299	L291-K295 WeakPolarHBondContact O-CG 2.98Å; L291-K295 PolarHBondContact O-N 2.83Å; E292-K295 PolarHBondContact O-N 3.14Å; E292-K295 IonicContact OE1-NZ 2.83Å; E292-K295 PolarHBondContact OE1-NZ 3.13Å; K295-R297 VanDerWaalsContact C-N 3.33Å; K295-R297 PolarHBondContact O-N 3.17Å; K295-L298 WeakPolarHBondContact O-CB 3.29Å; K295-L298 PolarHBondContact O-N 2.68Å; K295-L298 VanDerWaalsContact O-N 3.16Å; K295-E299 WeakPolarHBondContact O-CG 3.09Å; K295-E299 PolarHBondContact O-N 3.14Å
296	R	54.1	Low	40.6	Very low	115 Å²	115	83.9 Å²	83.9	43%	0.434	40%	0.401	S	S	.	.	H	α-helix	trans	-59.2	-44.9	176.8	-164.3	-170.2	82	-135.7	-13.6	111.5	E292 E293 L298 E299 E300	E292-R296 PolarHBondContact O-N 3.46Å; E293-R296 VanDerWaalsContact CD-NH2 3.31Å; E293-R296 IonicContact OE1-CZ 3.69Å; E293-R296 IonicContact OE1-NH1 2.91Å; E293-R296 IonicContact OE1-NH2 3.31Å; E293-R296 PolarHBondContact OE1-NH2 2.63Å; E293-R296 IonicContact OE2-CZ 2.73Å; E293-R296 IonicContact OE2-NH1 3.11Å; E293-R296 PolarHBondContact OE2-NH1 2.62Å; E293-R296 IonicContact OE2-NH2 3.67Å; E293-R296 PolarHBondContact OE2-NH2 3.46Å; R296-L298 VanDerWaalsContact C-N 3.32Å; R296-L298 PolarHBondContact O-N 3.2Å; R296-E299 PolarHBondContact O-N 2.94Å; R296-E300 IonicContact NE-OE1 2.86Å; R296-E300 PolarHBondContact NE-OE1 2.71Å; R296-E300 VanDerWaalsContact NE-OE1 3.1Å; R296-E300 WeakPolarHBondContact O-CG 3.38Å; R296-E300 PolarHBondContact O-N 2.8Å
297	R	44.3	Very low	40.9	Very low	48 Å²	48	86.3 Å²	86.3	18%	0.181	41%	0.413	C	S	.	.	H	α-helix	trans	-64.9	-35.9	177.3	-72.2	171.6	-171.3	-163.5	0.4	112.2	E293 H294 K295 E300 M301	E293-R297 WeakPolarHBondContact O-CB 3.45Å; E293-R297 WeakPolarHBondContact O-CD 2.92Å; E293-R297 WeakPolarHBondContact O-CG 2.91Å; E293-R297 PolarHBondContact O-N 2.6Å; E293-R297 IonicContact OE1-CZ 3.82Å; E293-R297 VanDerWaalsContact OE1-CZ 3.31Å; E293-R297 IonicContact OE1-NE 3.67Å; E293-R297 PolarHBondContact OE1-NE 3.35Å; E293-R297 IonicContact OE1-NH2 2.8Å; E293-R297 PolarHBondContact OE1-NH2 3.48Å; H294-R297 PolarHBondContact O-N 3.45Å; K295-R297 VanDerWaalsContact C-N 3.33Å; K295-R297 PolarHBondContact O-N 3.17Å; R297-E300 PolarHBondContact O-N 2.69Å; R297-M301 WeakPolarHBondContact O-CB 3.35Å; R297-M301 PolarHBondContact O-N 3.44Å
298	L	42.7	Very low	41	Very low	30 Å²	30	83 Å²	83	16%	0.157	40%	0.395	C	S	.	.	H	α-helix	trans	-67.7	-36.7	173.8	-83.8	167.8	0	0	0	112.6	H294 K295 R296 M301 E302 L321	H294-L298 VanDerWaalsContact O-CB 3.28Å; H294-L298 WeakPolarHBondContact O-CB 3.11Å; H294-L298 WeakPolarHBondContact O-CD1 3.48Å; H294-L298 VanDerWaalsContact O-CG 3.29Å; H294-L298 WeakPolarHBondContact O-CG 3.46Å; H294-L298 PolarHBondContact O-N 3.34Å; K295-L298 WeakPolarHBondContact O-CB 3.29Å; K295-L298 PolarHBondContact O-N 2.68Å; K295-L298 VanDerWaalsContact O-N 3.16Å; R296-L298 VanDerWaalsContact C-N 3.32Å; R296-L298 PolarHBondContact O-N 3.2Å; L298-M301 HydrophobicContact CD2-SD 3.88Å; L298-M301 WeakPolarHBondContact O-CA 3.39Å; L298-M301 WeakPolarHBondContact O-CB 3.38Å; L298-M301 PolarHBondContact O-N 3.48Å; L298-E302 PolarHBondContact O-N 2.69Å; L298-L321 HydrophobicContact CB-CD2 3.63Å; L298-L321 HydrophobicContact CD1-CD2 3.95Å; L298-L321 HydrophobicContact CD2-CD2 3.57Å; L298-L321 HydrophobicContact CD2-CG 4.37Å; L298-L321 HydrophobicContact CG-CD2 3.89Å
299	E	48.8	Very low	41.3	Very low	111 Å²	111	83.2 Å²	83.2	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-69.5	-38.5	172.2	-72.5	175.7	-178.8	0	0	112.6	K295 R296 M301 E302 K303	K295-E299 WeakPolarHBondContact O-CG 3.09Å; K295-E299 PolarHBondContact O-N 3.14Å; R296-E299 PolarHBondContact O-N 2.94Å; E299-M301 VanDerWaalsContact C-N 3.27Å; E299-E302 PolarHBondContact O-N 2.83Å; E299-K303 WeakPolarHBondContact O-CG 3.22Å; E299-K303 PolarHBondContact O-N 3.3Å; E299-K303 VanDerWaalsContact O-N 3.1Å
300	E	46.1	Very low	41.5	Very low	74 Å²	74	83.2 Å²	83.2	35%	0.346	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-38.3	169.8	-73	166.5	-166.2	0	0	110.7	R296 R297 K303 L304	R296-E300 IonicContact NE-OE1 2.86Å; R296-E300 PolarHBondContact NE-OE1 2.71Å; R296-E300 VanDerWaalsContact NE-OE1 3.1Å; R296-E300 WeakPolarHBondContact O-CG 3.38Å; R296-E300 PolarHBondContact O-N 2.8Å; R297-E300 PolarHBondContact O-N 2.69Å; E300-K303 PolarHBondContact O-N 2.81Å; E300-L304 PolarHBondContact O-N 3.17Å
301	M	38.6	Very low	41.4	Very low	33 Å²	33	83 Å²	83	16%	0.163	40%	0.398	C	S	.	.	H	α-helix	trans	-58.7	-45.7	171.8	-127.3	171.6	157	0	0	111.9	F277 V281 R297 L298 E299 K303 L304 V305 I317	F277-M301 HydrophobicContact CD2-CG 4.43Å; F277-M301 HydrophobicContact CE1-CE 4.2Å; F277-M301 HydrophobicContact CE2-CB 4.19Å; F277-M301 HydrophobicContact CE2-CE 4.22Å; F277-M301 HydrophobicContact CE2-CG 3.24Å; F277-M301 HydrophobicContact CZ-CE 3.58Å; F277-M301 HydrophobicContact CZ-CG 3.42Å; F277-M301 VanDerWaalsContact CZ-CG 3.42Å; F277-M301 HydrophobicContact CZ-SD 4.38Å; V281-M301 HydrophobicContact CB-CE 4.22Å; V281-M301 HydrophobicContact CG1-CE 3.78Å; V281-M301 HydrophobicContact CG2-CE 3.33Å; V281-M301 HydrophobicContact CG2-CG 4.47Å; V281-M301 HydrophobicContact CG2-SD 4.08Å; R297-M301 WeakPolarHBondContact O-CB 3.35Å; R297-M301 PolarHBondContact O-N 3.44Å; L298-M301 HydrophobicContact CD2-SD 3.88Å; L298-M301 WeakPolarHBondContact O-CA 3.39Å; L298-M301 WeakPolarHBondContact O-CB 3.38Å; L298-M301 PolarHBondContact O-N 3.48Å; E299-M301 VanDerWaalsContact C-N 3.27Å; M301-K303 VanDerWaalsContact C-N 3.32Å; M301-K303 PolarHBondContact O-N 3.31Å; M301-L304 PolarHBondContact O-N 3.5Å; M301-V305 VanDerWaalsContact O-CB 3.26Å; M301-V305 WeakPolarHBondContact O-CB 3.15Å; M301-V305 WeakPolarHBondContact O-CG2 2.93Å; M301-V305 PolarHBondContact O-N 3.36Å; M301-I317 HydrophobicContact CE-CD1 4.32Å
302	E	41.8	Very low	41.2	Very low	81 Å²	81	79.7 Å²	79.7	38%	0.379	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-34.6	178.1	-160.6	-165.6	140.7	0	0	112.1	L298 E299 K306	L298-E302 PolarHBondContact O-N 2.69Å; E299-E302 PolarHBondContact O-N 2.83Å; E302-K306 VanDerWaalsContact O-CG 3.28Å; E302-K306 WeakPolarHBondContact O-CG 3.5Å; E302-K306 PolarHBondContact O-N 3.3Å; E302-K306 VanDerWaalsContact O-N 3.15Å; E302-K306 WeakPolarHBondContact OE1-CE 3.38Å; E302-K306 IonicContact OE1-NZ 2.7Å; E302-K306 PolarHBondContact OE1-NZ 2.93Å
303	K	47.1	Very low	40.8	Very low	139 Å²	139	75.8 Å²	75.8	60%	0.604	36%	0.364	S	S	*	.	H	α-helix	trans	-70.6	-40.9	175.8	-70.7	171.6	-175.7	171.4	0	112.6	E299 E300 M301 H307	E299-K303 WeakPolarHBondContact O-CG 3.22Å; E299-K303 PolarHBondContact O-N 3.3Å; E299-K303 VanDerWaalsContact O-N 3.1Å; E300-K303 PolarHBondContact O-N 2.81Å; M301-K303 VanDerWaalsContact C-N 3.32Å; M301-K303 PolarHBondContact O-N 3.31Å; K303-H307 PolarHBondContact O-ND1 2.91Å
304	L	34.5	Very low	40.7	Very low	69 Å²	69	75.4 Å²	75.4	36%	0.361	36%	0.364	S	S	.	.	H	α-helix	trans	-71.3	-40	177.1	-81.5	159.6	0	0	0	111.8	F277 E300 M301 K306 H307 F308	F277-L304 HydrophobicContact CD2-CB 4.28Å; F277-L304 HydrophobicContact CD2-CD1 4.01Å; F277-L304 HydrophobicContact CE2-CB 4.3Å; E300-L304 PolarHBondContact O-N 3.17Å; M301-L304 PolarHBondContact O-N 3.5Å; L304-K306 VanDerWaalsContact C-N 3.32Å; L304-K306 PolarHBondContact O-N 3.29Å; L304-H307 VanDerWaalsContact O-CB 3.32Å; L304-H307 WeakPolarHBondContact O-CB 2.93Å; L304-H307 PolarHBondContact O-N 3.06Å; L304-F308 WeakPolarHBondContact O-CD2 3.29Å
305	V	34	Very low	40.7	Very low	1 Å²	1	79 Å²	79	1%	0.006	38%	0.381	C	S	.	.	H	α-helix	trans	-73.7	-23.7	-179.9	175.6	0	0	0	0	112	F277 M301 H307 F308 V313 N314 I317	F277-V305 HydrophobicContact CE1-CG2 4.43Å; F277-V305 HydrophobicContact CE2-CG2 4.17Å; F277-V305 HydrophobicContact CZ-CG2 3.67Å; M301-V305 VanDerWaalsContact O-CB 3.26Å; M301-V305 WeakPolarHBondContact O-CB 3.15Å; M301-V305 WeakPolarHBondContact O-CG2 2.93Å; M301-V305 PolarHBondContact O-N 3.36Å; V305-H307 PolarHBondContact O-N 3.11Å; V305-H307 VanDerWaalsContact O-N 3.14Å; V305-F308 CarbonylContact O-C 3.49Å; V305-F308 PolarHBondContact O-N 3.43Å; V305-V313 HydrophobicContact CG1-CG1 3.87Å; V305-V313 HydrophobicContact CG2-CG1 4.26Å; V305-N314 WeakPolarHBondContact CG1-OD1 3.26Å; V305-I317 HydrophobicContact CB-CD1 4.32Å; V305-I317 HydrophobicContact CG1-CD1 4.15Å; V305-I317 HydrophobicContact CG2-CD1 3.48Å; V305-I317 VanDerWaalsContact CG2-CD1 3.48Å
306	K	36.9	Very low	40.4	Very low	134 Å²	134	76.6 Å²	76.6	58%	0.583	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.1	166.5	-82.1	170.1	-173.7	161.7	0	113.5	E302 L304	E302-K306 VanDerWaalsContact O-CG 3.28Å; E302-K306 WeakPolarHBondContact O-CG 3.5Å; E302-K306 PolarHBondContact O-N 3.3Å; E302-K306 VanDerWaalsContact O-N 3.15Å; E302-K306 WeakPolarHBondContact OE1-CE 3.38Å; E302-K306 IonicContact OE1-NZ 2.7Å; E302-K306 PolarHBondContact OE1-NZ 2.93Å; L304-K306 VanDerWaalsContact C-N 3.32Å; L304-K306 PolarHBondContact O-N 3.29Å
307	H	34.1	Very low	39.9	Very low	150 Å²	150	72.1 Å²	72.1	69%	0.694	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-16.5	171.4	-72.2	60.8	0	0	0	113.4	K303 L304 V305	K303-H307 PolarHBondContact O-ND1 2.91Å; L304-H307 VanDerWaalsContact O-CB 3.32Å; L304-H307 WeakPolarHBondContact O-CB 2.93Å; L304-H307 PolarHBondContact O-N 3.06Å; V305-H307 PolarHBondContact O-N 3.11Å; V305-H307 VanDerWaalsContact O-N 3.14Å
308	F	31	Very low	39.9	Very low	26 Å²	26	76.1 Å²	76.1	11%	0.114	38%	0.377	C	S	.	.	S	Bend	trans	-104.3	102.2	176.2	-67.1	-85.6	0	0	0	108.2	T271 E273 F274 L304 V305 S310	T271-F308 WeakPolarHBondContact OG1-CE1 3.2Å; T271-F308 WeakPolarHBondContact OG1-CZ 3.11Å; E273-F308 HydrophobicContact CB-CZ 4.45Å; F274-F308 HydrophobicContact CB-CE1 3.63Å; F274-F308 HydrophobicContact CB-CE2 4.3Å; F274-F308 HydrophobicContact CB-CZ 3.44Å; F274-F308 VanDerWaalsContact CB-CZ 3.44Å; F274-F308 AromaticContact CD2-CD1 3.77Å; F274-F308 HydrophobicContact CD2-CD1 3.77Å; F274-F308 AromaticContact CD2-CD2 3.93Å; F274-F308 HydrophobicContact CD2-CD2 3.93Å; F274-F308 AromaticContact CD2-CE1 3.54Å; F274-F308 HydrophobicContact CD2-CE1 3.54Å; F274-F308 AromaticContact CD2-CE2 3.73Å; F274-F308 HydrophobicContact CD2-CE2 3.73Å; F274-F308 AromaticContact CD2-CG 3.97Å; F274-F308 HydrophobicContact CD2-CG 3.97Å; F274-F308 AromaticContact CD2-CZ 3.54Å; F274-F308 HydrophobicContact CD2-CZ 3.54Å; F274-F308 HydrophobicContact CE2-CD1 4.26Å; F274-F308 HydrophobicContact CE2-CD2 4.44Å; F274-F308 HydrophobicContact CE2-CE1 4.45Å; F274-F308 HydrophobicContact CE2-CG 4.27Å; F274-F308 HydrophobicContact CG-CD1 4.38Å; F274-F308 AromaticContact CG-CE1 3.8Å; F274-F308 HydrophobicContact CG-CE1 3.8Å; F274-F308 HydrophobicContact CG-CE2 4.48Å; F274-F308 AromaticContact CG-CZ 3.88Å; F274-F308 HydrophobicContact CG-CZ 3.88Å; L304-F308 WeakPolarHBondContact O-CD2 3.29Å; V305-F308 CarbonylContact O-C 3.49Å; V305-F308 PolarHBondContact O-N 3.43Å; F308-S310 PolarHBondContact O-N 2.95Å
309	D	36.6	Very low	40	Very low	166 Å²	166	76.9 Å²	76.9	89%	0.888	39%	0.385	S	S	*	.			trans	-65.1	44.4	176	-101.5	-18.9	0	0	0	112.9	P311	D309-P311 WeakPolarHBondContact O-CD 2.9Å
310	S	39.6	Very low	39.6	Very low	34 Å²	34	74.1 Å²	74.1	24%	0.238	38%	0.376	C	S	.	.			trans	-99.4	111.6	177.4	-178.2	0	0	0	0	110.4	F308 I312 V313 N314	F308-S310 PolarHBondContact O-N 2.95Å; S310-I312 PolarHBondContact O-N 3.09Å; S310-V313 WeakPolarHBondContact OG-CG2 3.01Å; S310-N314 WeakPolarHBondContact O-CB 3.41Å; S310-N314 PolarHBondContact O-N 2.77Å; S310-N314 PolarHBondContact O-ND2 3.49Å
311	P	37.3	Very low	39.3	Very low	89 Å²	89	73.8 Å²	73.8	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-60.7	-33.7	178.5	-21.5	31.8	0	0	0	112.7	D309 E315	D309-P311 WeakPolarHBondContact O-CD 2.9Å; P311-E315 WeakPolarHBondContact O-CB 3.06Å; P311-E315 WeakPolarHBondContact O-CG 3.07Å; P311-E315 PolarHBondContact O-N 2.94Å
312	I	35.9	Very low	39.5	Very low	52 Å²	52	76.6 Å²	76.6	27%	0.267	40%	0.399	S	S	.	.	H	α-helix	trans	-76.7	-42	-174	-63.2	163.1	0	0	0	111.4	S310 N314 E315 T316 L406	S310-I312 PolarHBondContact O-N 3.09Å; I312-N314 VanDerWaalsContact C-N 3.34Å; I312-E315 PolarHBondContact O-N 3.36Å; I312-T316 VanDerWaalsContact O-CB 3.24Å; I312-T316 WeakPolarHBondContact O-CB 3.26Å; I312-T316 PolarHBondContact O-N 3.16Å; I312-T316 PolarHBondContact O-OG1 3.43Å; I312-L406 WeakPolarHBondContact CD1-O 3.46Å
313	V	39.1	Very low	39.5	Very low	37 Å²	37	74.2 Å²	74.2	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-66.7	-43.3	174.9	178	0	0	0	0	108.7	V305 S310 T316 I317	V305-V313 HydrophobicContact CG1-CG1 3.87Å; V305-V313 HydrophobicContact CG2-CG1 4.26Å; S310-V313 WeakPolarHBondContact OG-CG2 3.01Å; V313-T316 PolarHBondContact O-N 3.11Å; V313-I317 HydrophobicContact CG1-CD1 3.5Å; V313-I317 HydrophobicContact CG1-CG1 4.26Å; V313-I317 WeakPolarHBondContact O-CB 3.13Å; V313-I317 WeakPolarHBondContact O-CG1 3.22Å; V313-I317 PolarHBondContact O-N 3.44Å
314	N	42.6	Very low	39.2	Very low	38 Å²	38	73.8 Å²	73.8	20%	0.203	40%	0.395	C	S	.	.	H	α-helix	trans	-61.3	-43.4	173.9	-87.9	-52.9	0	0	0	113.3	V305 S310 I312 K318	V305-N314 WeakPolarHBondContact CG1-OD1 3.26Å; S310-N314 WeakPolarHBondContact O-CB 3.41Å; S310-N314 PolarHBondContact O-N 2.77Å; S310-N314 PolarHBondContact O-ND2 3.49Å; I312-N314 VanDerWaalsContact C-N 3.34Å; N314-K318 WeakPolarHBondContact O-CB 3.32Å; N314-K318 WeakPolarHBondContact O-CD 3.49Å; N314-K318 WeakPolarHBondContact O-CG 3.22Å; N314-K318 PolarHBondContact O-N 3.16Å
315	E	43.6	Very low	39.7	Very low	137 Å²	137	73.2 Å²	73.2	64%	0.64	39%	0.392	S	S	*	.	H	α-helix	trans	-71.8	-37.8	178	-83.9	-166.9	162.6	0	0	113	P311 I312 K318 S319	P311-E315 WeakPolarHBondContact O-CB 3.06Å; P311-E315 WeakPolarHBondContact O-CG 3.07Å; P311-E315 PolarHBondContact O-N 2.94Å; I312-E315 PolarHBondContact O-N 3.36Å; E315-K318 CarbonylContact O-C 3.58Å; E315-S319 WeakPolarHBondContact O-CA 3.08Å; E315-S319 WeakPolarHBondContact O-CB 3.44Å; E315-S319 PolarHBondContact O-N 3.49Å
316	T	39.8	Very low	40.1	Very low	44 Å²	44	81.4 Å²	81.4	27%	0.27	43%	0.427	S	S	.	.	H	α-helix	trans	-72.6	-40	179.3	-51.8	0	0	0	0	110.5	I312 V313 S319 V320	I312-T316 VanDerWaalsContact O-CB 3.24Å; I312-T316 WeakPolarHBondContact O-CB 3.26Å; I312-T316 PolarHBondContact O-N 3.16Å; I312-T316 PolarHBondContact O-OG1 3.43Å; V313-T316 PolarHBondContact O-N 3.11Å; T316-S319 WeakPolarHBondContact O-CB 3.47Å; T316-S319 PolarHBondContact O-N 2.82Å; T316-V320 VanDerWaalsContact O-CG2 3.27Å; T316-V320 WeakPolarHBondContact O-CG2 3.29Å; T316-V320 PolarHBondContact O-N 3.1Å
317	I	42.4	Very low	40.3	Very low	22 Å²	22	77.5 Å²	77.5	11%	0.113	42%	0.417	C	S	.	.	H	α-helix	trans	-67.9	-44.4	173.1	-69.7	177.1	0	0	0	109.9	M301 V305 V313 S319 V320 L321	M301-I317 HydrophobicContact CE-CD1 4.32Å; V305-I317 HydrophobicContact CB-CD1 4.32Å; V305-I317 HydrophobicContact CG1-CD1 4.15Å; V305-I317 HydrophobicContact CG2-CD1 3.48Å; V305-I317 VanDerWaalsContact CG2-CD1 3.48Å; V313-I317 HydrophobicContact CG1-CD1 3.5Å; V313-I317 HydrophobicContact CG1-CG1 4.26Å; V313-I317 WeakPolarHBondContact O-CB 3.13Å; V313-I317 WeakPolarHBondContact O-CG1 3.22Å; V313-I317 PolarHBondContact O-N 3.44Å; I317-S319 VanDerWaalsContact C-N 3.29Å; I317-S319 PolarHBondContact O-N 3Å; I317-V320 PolarHBondContact O-N 3.12Å; I317-L321 HydrophobicContact CG2-CD1 3.42Å; I317-L321 VanDerWaalsContact CG2-CD1 3.42Å; I317-L321 HydrophobicContact CG2-CG 4Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 WeakPolarHBondContact O-CG 3.38Å; I317-L321 PolarHBondContact O-N 2.69Å
318	K	45.5	Very low	40.5	Very low	131 Å²	131	78.5 Å²	78.5	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-59.5	-38	170.1	-77.2	171.5	-176.8	178.3	0	111.7	N314 E315 L321 S322	N314-K318 WeakPolarHBondContact O-CB 3.32Å; N314-K318 WeakPolarHBondContact O-CD 3.49Å; N314-K318 WeakPolarHBondContact O-CG 3.22Å; N314-K318 PolarHBondContact O-N 3.16Å; E315-K318 CarbonylContact O-C 3.58Å; K318-L321 PolarHBondContact O-N 3.37Å; K318-S322 WeakPolarHBondContact O-CA 3.42Å; K318-S322 WeakPolarHBondContact O-CB 3.32Å; K318-S322 PolarHBondContact O-N 3.01Å; K318-S322 PolarHBondContact O-OG 3.06Å
319	S	43.9	Very low	40.9	Very low	46 Å²	46	84 Å²	84	32%	0.322	44%	0.441	S	S	.	.	H	α-helix	trans	-66.7	-38.4	176.7	166.8	0	0	0	0	112.1	E315 T316 I317 S323	E315-S319 WeakPolarHBondContact O-CA 3.08Å; E315-S319 WeakPolarHBondContact O-CB 3.44Å; E315-S319 PolarHBondContact O-N 3.49Å; T316-S319 WeakPolarHBondContact O-CB 3.47Å; T316-S319 PolarHBondContact O-N 2.82Å; I317-S319 VanDerWaalsContact C-N 3.29Å; I317-S319 PolarHBondContact O-N 3Å; S319-S323 WeakPolarHBondContact O-CB 3.25Å; S319-S323 PolarHBondContact O-N 3.32Å; S319-S323 VanDerWaalsContact O-N 3.16Å; S319-S323 PolarHBondContact O-OG 3.23Å
320	V	41.3	Very low	41.1	Very low	54 Å²	54	80.2 Å²	80.2	33%	0.327	42%	0.417	S	S	.	.	H	α-helix	trans	-72.5	-41.1	175.9	172.2	0	0	0	0	110.3	T316 I317 S323 I325	T316-V320 VanDerWaalsContact O-CG2 3.27Å; T316-V320 WeakPolarHBondContact O-CG2 3.29Å; T316-V320 PolarHBondContact O-N 3.1Å; I317-V320 PolarHBondContact O-N 3.12Å; V320-S323 PolarHBondContact O-OG 3.34Å; V320-S323 VanDerWaalsContact O-OG 3.12Å; V320-I325 WeakPolarHBondContact O-CD1 3.39Å
321	L	39.6	Very low	41.1	Very low	66 Å²	66	80.6 Å²	80.6	35%	0.346	42%	0.415	S	S	.	.	H	α-helix	trans	-73.5	-35.3	178.8	-71.2	172.5	0	0	0	114.2	L298 I317 K318	L298-L321 HydrophobicContact CB-CD2 3.63Å; L298-L321 HydrophobicContact CD1-CD2 3.95Å; L298-L321 HydrophobicContact CD2-CD2 3.57Å; L298-L321 HydrophobicContact CD2-CG 4.37Å; L298-L321 HydrophobicContact CG-CD2 3.89Å; I317-L321 HydrophobicContact CG2-CD1 3.42Å; I317-L321 VanDerWaalsContact CG2-CD1 3.42Å; I317-L321 HydrophobicContact CG2-CG 4Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 WeakPolarHBondContact O-CG 3.38Å; I317-L321 PolarHBondContact O-N 2.69Å; K318-L321 PolarHBondContact O-N 3.37Å
322	S	42.4	Very low	41.3	Very low	92 Å²	92	80.2 Å²	80.2	64%	0.643	41%	0.409	S	S	*	.	H	α-helix	trans	-92.4	-14.1	-176.7	67.4	0	0	0	0	113.1	K318 D324	K318-S322 WeakPolarHBondContact O-CA 3.42Å; K318-S322 WeakPolarHBondContact O-CB 3.32Å; K318-S322 PolarHBondContact O-N 3.01Å; K318-S322 PolarHBondContact O-OG 3.06Å; S322-D324 PolarHBondContact O-N 3.38Å
323	S	42.4	Very low	41.7	Very low	31 Å²	31	85 Å²	85	22%	0.217	42%	0.423	C	S	.	.	S	Bend	trans	-67.7	125.3	170.8	66.2	0	0	0	0	108.6	S319 V320 I325	S319-S323 WeakPolarHBondContact O-CB 3.25Å; S319-S323 PolarHBondContact O-N 3.32Å; S319-S323 VanDerWaalsContact O-N 3.16Å; S319-S323 PolarHBondContact O-OG 3.23Å; V320-S323 PolarHBondContact O-OG 3.34Å; V320-S323 VanDerWaalsContact O-OG 3.12Å; S323-I325 PolarHBondContact O-N 3.09Å; S323-I325 VanDerWaalsContact OG-CG1 3.29Å; S323-I325 WeakPolarHBondContact OG-CG1 3.4Å
324	D	41.1	Very low	42	Very low	131 Å²	131	86.7 Å²	86.7	70%	0.701	43%	0.429	S	S	*	.			trans	-57.6	86.5	159.6	-89.3	-23.3	0	0	0	107	S322 K326	S322-D324 PolarHBondContact O-N 3.38Å; D324-K326 HydrophobicContact CB-CG 4.45Å; D324-K326 PolarHBondContact O-N 2.92Å
325	I	43.8	Very low	42	Very low	56 Å²	56	89.9 Å²	89.9	29%	0.287	45%	0.445	S	S	.	.			trans	-71	93	174.3	-66.6	160.7	0	0	0	105.6	V320 S323 S327 Q331	V320-I325 WeakPolarHBondContact O-CD1 3.39Å; S323-I325 PolarHBondContact O-N 3.09Å; S323-I325 VanDerWaalsContact OG-CG1 3.29Å; S323-I325 WeakPolarHBondContact OG-CG1 3.4Å; I325-S327 WeakPolarHBondContact CG2-O 3.46Å; I325-S327 PolarHBondContact O-N 3.34Å; I325-Q331 HydrophobicContact CB-CG 4.28Å; I325-Q331 HydrophobicContact CD1-CG 3.54Å; I325-Q331 HydrophobicContact CG1-CG 3.87Å; I325-Q331 HydrophobicContact CG2-CB 4.4Å; I325-Q331 HydrophobicContact CG2-CG 3.45Å; I325-Q331 VanDerWaalsContact CG2-CG 3.45Å
326	K	42.9	Very low	41.9	Very low	173 Å²	173	88.8 Å²	88.8	75%	0.752	44%	0.44	S	S	*	.			trans	-74.3	-17.8	177.8	-64.2	-179.2	-174.9	-177.5	0	111.9	D324	D324-K326 HydrophobicContact CB-CG 4.45Å; D324-K326 PolarHBondContact O-N 2.92Å
327	S	41.9	Very low	42.2	Very low	52 Å²	52	93.7 Å²	93.7	36%	0.364	46%	0.458	S	S	.	.			trans	-160	151.8	178.8	70.4	0	0	0	0	113.8	I325 H329 Q330 Q331	I325-S327 WeakPolarHBondContact CG2-O 3.46Å; I325-S327 PolarHBondContact O-N 3.34Å; S327-H329 PolarHBondContact O-N 2.87Å; S327-H329 VanDerWaalsContact O-N 3.15Å; S327-Q330 WeakPolarHBondContact O-CB 3.42Å; S327-Q330 PolarHBondContact O-N 3.45Å; S327-Q330 PolarHBondContact OG-N 2.88Å; S327-Q331 PolarHBondContact O-N 2.76Å
328	R	37	Very low	42.2	Very low	171 Å²	171	96.5 Å²	96.5	65%	0.645	47%	0.473	S	S	*	.	H	α-helix	trans	-53.3	-30.2	169.9	-164.5	174.1	-174	173.5	3	113.1	N332	R328-N332 WeakPolarHBondContact O-CB 3.45Å; R328-N332 VanDerWaalsContact O-CG 3.25Å; R328-N332 PolarHBondContact O-N 3.44Å; R328-N332 PolarHBondContact O-OD1 2.92Å
329	H	39.2	Very low	42	Very low	142 Å²	142	95.4 Å²	95.4	66%	0.657	47%	0.466	S	S	*	.	H	α-helix	trans	-66.8	-34.5	174.5	-86.9	-7.3	0	0	0	113.5	S327 R333	S327-H329 PolarHBondContact O-N 2.87Å; S327-H329 VanDerWaalsContact O-N 3.15Å; H329-R333 WeakPolarHBondContact O-CB 3.31Å; H329-R333 WeakPolarHBondContact O-CG 3.41Å; H329-R333 PolarHBondContact O-N 2.98Å; H329-R333 VanDerWaalsContact O-N 3.1Å
330	Q	42	Very low	42	Very low	86 Å²	86	95.9 Å²	95.9	40%	0.402	47%	0.465	S	S	.	.	H	α-helix	trans	-74.2	-40	-179.9	-163.5	169.7	-12.4	0	0	111	S327 R333 Q334	S327-Q330 WeakPolarHBondContact O-CB 3.42Å; S327-Q330 PolarHBondContact O-N 3.45Å; S327-Q330 PolarHBondContact OG-N 2.88Å; Q330-R333 PolarHBondContact O-N 3.28Å; Q330-Q334 PolarHBondContact O-N 2.88Å; Q330-Q334 VanDerWaalsContact O-N 3.13Å
331	Q	40.4	Very low	42.2	Very low	42 Å²	42	98.4 Å²	98.4	20%	0.196	47%	0.468	C	S	.	.	H	α-helix	trans	-54	-56.5	167.3	-91.7	167	-20.2	0	0	112	I325 S327 R333 Q334 L335	I325-Q331 HydrophobicContact CB-CG 4.28Å; I325-Q331 HydrophobicContact CD1-CG 3.54Å; I325-Q331 HydrophobicContact CG1-CG 3.87Å; I325-Q331 HydrophobicContact CG2-CB 4.4Å; I325-Q331 HydrophobicContact CG2-CG 3.45Å; I325-Q331 VanDerWaalsContact CG2-CG 3.45Å; S327-Q331 PolarHBondContact O-N 2.76Å; Q331-R333 PolarHBondContact O-N 2.96Å; Q331-Q334 PolarHBondContact O-N 3.15Å; Q331-L335 PolarHBondContact O-N 2.77Å
332	N	41.4	Very low	42.4	Very low	82 Å²	82	99.2 Å²	99.2	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-59.6	-35.8	-177.6	-72	-3.9	0	0	0	112.3	R328 Q336	R328-N332 WeakPolarHBondContact O-CB 3.45Å; R328-N332 VanDerWaalsContact O-CG 3.25Å; R328-N332 PolarHBondContact O-N 3.44Å; R328-N332 PolarHBondContact O-OD1 2.92Å; N332-Q336 VanDerWaalsContact O-CB 3.29Å; N332-Q336 WeakPolarHBondContact O-CB 3.45Å; N332-Q336 PolarHBondContact O-N 2.87Å
333	R	44.4	Very low	42.3	Very low	151 Å²	151	95.4 Å²	95.4	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-66.8	-39.3	175.5	-79.5	-179.1	-176.8	-178.2	4.6	113.1	H329 Q330 Q331 Q336 K337	H329-R333 WeakPolarHBondContact O-CB 3.31Å; H329-R333 WeakPolarHBondContact O-CG 3.41Å; H329-R333 PolarHBondContact O-N 2.98Å; H329-R333 VanDerWaalsContact O-N 3.1Å; Q330-R333 PolarHBondContact O-N 3.28Å; Q331-R333 PolarHBondContact O-N 2.96Å; R333-Q336 PolarHBondContact O-N 3.08Å; R333-K337 WeakPolarHBondContact O-CG 3.36Å; R333-K337 PolarHBondContact O-N 3.43Å
334	Q	43.9	Very low	42.4	Very low	74 Å²	74	99.3 Å²	99.3	35%	0.346	46%	0.459	S	S	.	.	H	α-helix	trans	-70	-41.8	177.7	-73.6	-162.1	-14.4	0	0	111.5	Q330 Q331 Q336 K337 L338	Q330-Q334 PolarHBondContact O-N 2.88Å; Q330-Q334 VanDerWaalsContact O-N 3.13Å; Q331-Q334 PolarHBondContact O-N 3.15Å; Q334-Q336 VanDerWaalsContact C-N 3.32Å; Q334-Q336 PolarHBondContact O-N 2.94Å; Q334-K337 PolarHBondContact O-N 2.9Å; Q334-L338 PolarHBondContact O-N 3.44Å
335	L	43.1	Very low	42.6	Very low	104 Å²	104	97.9 Å²	97.9	55%	0.545	45%	0.447	S	S	.	.	H	α-helix	trans	-57.3	-43.3	170.7	-92.7	135	0	0	0	112.2	Q331 K337 L338 Y339	Q331-L335 PolarHBondContact O-N 2.77Å; L335-K337 PolarHBondContact O-N 2.91Å; L335-L338 WeakPolarHBondContact O-CB 3.35Å; L335-L338 PolarHBondContact O-N 3.06Å; L335-Y339 WeakPolarHBondContact O-CB 3.37Å; L335-Y339 PolarHBondContact O-N 3.42Å
336	Q	42.3	Very low	42.4	Very low	115 Å²	115	99.2 Å²	99.2	54%	0.537	45%	0.451	S	S	.	.	H	α-helix	trans	-69.4	-33.2	179.4	-166.1	154.2	18.9	0	0	113.2	N332 R333 Q334 Y339 N340	N332-Q336 VanDerWaalsContact O-CB 3.29Å; N332-Q336 WeakPolarHBondContact O-CB 3.45Å; N332-Q336 PolarHBondContact O-N 2.87Å; R333-Q336 PolarHBondContact O-N 3.08Å; Q334-Q336 VanDerWaalsContact C-N 3.32Å; Q334-Q336 PolarHBondContact O-N 2.94Å; Q336-Y339 PolarHBondContact O-N 2.61Å; Q336-N340 WeakPolarHBondContact O-CB 3.49Å; Q336-N340 VanDerWaalsContact O-CG 3.31Å; Q336-N340 PolarHBondContact O-N 2.93Å
337	K	45.3	Very low	42.3	Very low	147 Å²	147	91.7 Å²	91.7	64%	0.639	42%	0.419	S	S	*	.	H	α-helix	trans	-64.9	-41	171.7	-77	179.6	178.1	-173.5	0	112	R333 Q334 L335 R341	R333-K337 WeakPolarHBondContact O-CG 3.36Å; R333-K337 PolarHBondContact O-N 3.43Å; Q334-K337 PolarHBondContact O-N 2.9Å; L335-K337 PolarHBondContact O-N 2.91Å; K337-R341 PolarHBondContact O-N 3.33Å
338	L	43.5	Very low	42.4	Very low	81 Å²	81	90.8 Å²	90.8	42%	0.424	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-47.2	175	-178.1	65.1	0	0	0	110.6	Q334 L335 R341 I342	Q334-L338 PolarHBondContact O-N 3.44Å; L335-L338 WeakPolarHBondContact O-CB 3.35Å; L335-L338 PolarHBondContact O-N 3.06Å; L338-R341 PolarHBondContact O-N 2.93Å; L338-I342 HydrophobicContact CD1-CD1 4.4Å; L338-I342 HydrophobicContact CG-CD1 4.12Å; L338-I342 WeakPolarHBondContact O-CG1 3.34Å; L338-I342 PolarHBondContact O-N 3.41Å; L338-I342 VanDerWaalsContact O-N 3.12Å
339	Y	41.3	Very low	42.6	Very low	107 Å²	107	83.7 Å²	83.7	42%	0.42	39%	0.392	S	S	.	.	H	α-helix	trans	-59.4	-47.8	178.6	-171.4	-104	0	0	0	113	M256 L335 Q336 R341 I342 I343	M256-Y339 HydrophobicContact CE-CE2 4.23Å; L335-Y339 WeakPolarHBondContact O-CB 3.37Å; L335-Y339 PolarHBondContact O-N 3.42Å; Q336-Y339 PolarHBondContact O-N 2.61Å; Y339-R341 PolarHBondContact O-N 2.89Å; Y339-I342 PolarHBondContact O-N 3.3Å; Y339-I343 HydrophobicContact CD1-CD1 3.69Å; Y339-I343 HydrophobicContact CE1-CD1 3.25Å; Y339-I343 HydrophobicContact CE1-CG1 4.37Å; Y339-I343 HydrophobicContact CG-CD1 4.5Å; Y339-I343 PolarHBondContact O-N 2.93Å; Y339-I343 VanDerWaalsContact O-N 3.09Å
340	N	43.7	Very low	42.6	Very low	57 Å²	57	78.1 Å²	78.1	31%	0.305	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-40.8	178.5	-73.7	-14	0	0	0	112.6	Q336 I342 I343 E344	Q336-N340 WeakPolarHBondContact O-CB 3.49Å; Q336-N340 VanDerWaalsContact O-CG 3.31Å; Q336-N340 PolarHBondContact O-N 2.93Å; N340-I342 VanDerWaalsContact C-N 3.34Å; N340-I342 PolarHBondContact O-N 3.42Å; N340-I343 PolarHBondContact O-N 3.38Å; N340-E344 WeakPolarHBondContact O-CG 3.23Å; N340-E344 PolarHBondContact O-N 3.22Å
341	R	45.4	Very low	42.9	Very low	107 Å²	107	78 Å²	78	40%	0.404	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-36.6	178	-83	-178.6	173.7	178	-2.4	112.7	K337 L338 Y339 K345 Y413	K337-R341 PolarHBondContact O-N 3.33Å; L338-R341 PolarHBondContact O-N 2.93Å; Y339-R341 PolarHBondContact O-N 2.89Å; R341-K345 PolarHBondContact O-N 3.15Å; R341-Y413 VanDerWaalsContact NH1-CE1 3.32Å
342	I	43	Very low	43.3	Very low	83 Å²	83	82.5 Å²	82.5	43%	0.426	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-48.8	174.5	-68.7	167.3	0	0	0	109.2	L338 Y339 N340 E344 K345 F346	L338-I342 HydrophobicContact CD1-CD1 4.4Å; L338-I342 HydrophobicContact CG-CD1 4.12Å; L338-I342 WeakPolarHBondContact O-CG1 3.34Å; L338-I342 PolarHBondContact O-N 3.41Å; L338-I342 VanDerWaalsContact O-N 3.12Å; Y339-I342 PolarHBondContact O-N 3.3Å; N340-I342 VanDerWaalsContact C-N 3.34Å; N340-I342 PolarHBondContact O-N 3.42Å; I342-E344 PolarHBondContact O-N 3.36Å; I342-K345 PolarHBondContact O-N 2.88Å; I342-F346 HydrophobicContact CG2-CD2 3.71Å; I342-F346 HydrophobicContact CG2-CE2 3.55Å; I342-F346 VanDerWaalsContact O-CD2 3.23Å; I342-F346 WeakPolarHBondContact O-CD2 3.36Å; I342-F346 PolarHBondContact O-N 3.49Å; I342-F346 VanDerWaalsContact O-N 3.08Å
343	I	40.6	Very low	43.3	Very low	11 Å²	11	80 Å²	80	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-44	178.2	-70.5	172.5	0	0	0	112.7	V148 L152 Y339 N340 K345 F346 L347	V148-I343 HydrophobicContact CG1-CG2 3.59Å; L152-I343 HydrophobicContact CB-CG2 4.44Å; L152-I343 HydrophobicContact CD2-CG1 4.45Å; L152-I343 HydrophobicContact CD2-CG2 4.05Å; Y339-I343 HydrophobicContact CD1-CD1 3.69Å; Y339-I343 HydrophobicContact CE1-CD1 3.25Å; Y339-I343 HydrophobicContact CE1-CG1 4.37Å; Y339-I343 HydrophobicContact CG-CD1 4.5Å; Y339-I343 PolarHBondContact O-N 2.93Å; Y339-I343 VanDerWaalsContact O-N 3.09Å; N340-I343 PolarHBondContact O-N 3.38Å; I343-K345 VanDerWaalsContact C-N 3.31Å; I343-K345 PolarHBondContact O-N 3.31Å; I343-F346 PolarHBondContact O-N 2.94Å; I343-L347 HydrophobicContact CG2-CD1 4.23Å; I343-L347 PolarHBondContact O-N 2.89Å
344	E	44.3	Very low	43.1	Very low	114 Å²	114	74.7 Å²	74.7	53%	0.533	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-39.5	178.5	-76.3	176.8	171.6	0	0	112.3	V148 N340 I342 L347 G348	V148-E344 HydrophobicContact CG1-CG 4.47Å; N340-E344 WeakPolarHBondContact O-CG 3.23Å; N340-E344 PolarHBondContact O-N 3.22Å; I342-E344 PolarHBondContact O-N 3.36Å; E344-L347 PolarHBondContact O-N 3.03Å; E344-G348 PolarHBondContact O-N 3.16Å; E344-G348 VanDerWaalsContact O-N 3.15Å
345	K	45.3	Very low	43.3	Very low	100 Å²	100	74.3 Å²	74.3	44%	0.435	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-39.6	175.1	-74.2	-165.9	175.2	-161	0	112	R341 I342 I343 G348 I349 L402 L406	R341-K345 PolarHBondContact O-N 3.15Å; I342-K345 PolarHBondContact O-N 2.88Å; I343-K345 VanDerWaalsContact C-N 3.31Å; I343-K345 PolarHBondContact O-N 3.31Å; K345-G348 PolarHBondContact O-N 3.29Å; K345-I349 PolarHBondContact O-N 2.85Å; K345-L402 HydrophobicContact CD-CD2 4.37Å; K345-L406 HydrophobicContact CD-CD2 4.5Å
346	F	40.7	Very low	43.3	Very low	84 Å²	84	72.8 Å²	72.8	37%	0.368	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-43	174	-85.5	-72.4	0	0	0	112.7	L263 I342 I343 G348 I349 I350	L263-F346 HydrophobicContact CD1-CZ 4.07Å; L263-F346 HydrophobicContact CD2-CZ 4.1Å; I342-F346 HydrophobicContact CG2-CD2 3.71Å; I342-F346 HydrophobicContact CG2-CE2 3.55Å; I342-F346 VanDerWaalsContact O-CD2 3.23Å; I342-F346 WeakPolarHBondContact O-CD2 3.36Å; I342-F346 PolarHBondContact O-N 3.49Å; I342-F346 VanDerWaalsContact O-N 3.08Å; I343-F346 PolarHBondContact O-N 2.94Å; F346-G348 VanDerWaalsContact C-N 3.27Å; F346-G348 PolarHBondContact O-N 3.47Å; F346-I349 PolarHBondContact O-N 3.25Å; F346-I349 VanDerWaalsContact O-N 3.11Å; F346-I350 WeakPolarHBondContact O-CG1 3.38Å; F346-I350 PolarHBondContact O-N 2.89Å
347	L	39.8	Very low	43	Very low	16 Å²	16	67.6 Å²	67.6	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-56.8	-41.3	174.1	-82.3	171.4	0	0	0	112.2	V148 K151 L152 K155 I343 E344 I349 I350 D351	V148-L347 HydrophobicContact CG1-CD1 3.65Å; K151-L347 HydrophobicContact CB-CD2 4.34Å; L152-L347 HydrophobicContact CB-CD2 3.96Å; L152-L347 HydrophobicContact CB-CG 4.3Å; L152-L347 HydrophobicContact CD1-CD2 3.86Å; L152-L347 HydrophobicContact CD1-CG 3.97Å; K155-L347 HydrophobicContact CD-CD2 4.18Å; I343-L347 HydrophobicContact CG2-CD1 4.23Å; I343-L347 PolarHBondContact O-N 2.89Å; E344-L347 PolarHBondContact O-N 3.03Å; L347-I349 VanDerWaalsContact C-N 3.32Å; L347-I349 PolarHBondContact O-N 2.93Å; L347-I350 PolarHBondContact O-N 3.46Å; L347-D351 WeakPolarHBondContact O-CB 3.41Å; L347-D351 PolarHBondContact O-N 2.99Å
348	G	44.6	Very low	42.9	Very low	32 Å²	32	65 Å²	65	33%	0.33	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-30.6	176.9	0	0	0	0	0	114.1	E344 K345 F346 K352	E344-G348 PolarHBondContact O-N 3.16Å; E344-G348 VanDerWaalsContact O-N 3.15Å; K345-G348 PolarHBondContact O-N 3.29Å; F346-G348 VanDerWaalsContact C-N 3.27Å; F346-G348 PolarHBondContact O-N 3.47Å; G348-K352 WeakPolarHBondContact O-CG 3.27Å; G348-K352 PolarHBondContact O-N 3.27Å
349	I	41.4	Very low	43.1	Very low	23 Å²	23	67.1 Å²	67.1	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-71.2	-46.4	172.9	-63.8	168.3	0	0	0	109.8	K345 F346 L347 D351 K352 W353 L395 L402	K345-I349 PolarHBondContact O-N 2.85Å; F346-I349 PolarHBondContact O-N 3.25Å; F346-I349 VanDerWaalsContact O-N 3.11Å; L347-I349 VanDerWaalsContact C-N 3.32Å; L347-I349 PolarHBondContact O-N 2.93Å; I349-D351 VanDerWaalsContact C-N 3.32Å; I349-D351 PolarHBondContact O-N 3.45Å; I349-K352 WeakPolarHBondContact O-CB 3.28Å; I349-K352 PolarHBondContact O-N 3.1Å; I349-W353 PolarHBondContact O-N 3.29Å; I349-L395 HydrophobicContact CG2-CD1 4.19Å; I349-L402 HydrophobicContact CD1-CD1 4.14Å; I349-L402 HydrophobicContact CD1-CD2 4.21Å; I349-L402 HydrophobicContact CG1-CD1 4.12Å
350	I	38.9	Very low	42.7	Very low	24 Å²	24	62.6 Å²	62.6	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-40.5	179.1	-62.1	167.9	0	0	0	111.1	L152 K155 L156 F346 L347 K352 W353 Q354	L152-I350 HydrophobicContact CD1-CD1 3.72Å; K155-I350 HydrophobicContact CB-CG2 3.82Å; K155-I350 HydrophobicContact CD-CG2 3.96Å; K155-I350 HydrophobicContact CG-CG2 4.49Å; L156-I350 HydrophobicContact CD2-CD1 4.19Å; L156-I350 HydrophobicContact CG-CD1 4.3Å; F346-I350 WeakPolarHBondContact O-CG1 3.38Å; F346-I350 PolarHBondContact O-N 2.89Å; L347-I350 PolarHBondContact O-N 3.46Å; I350-K352 VanDerWaalsContact C-N 3.27Å; I350-K352 PolarHBondContact O-N 2.87Å; I350-W353 PolarHBondContact O-N 3.39Å; I350-Q354 WeakPolarHBondContact O-CB 3.15Å; I350-Q354 PolarHBondContact O-N 3.05Å
351	D	46.9	Very low	42.4	Very low	83 Å²	83	66.7 Å²	66.7	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-37.1	175.6	-92.4	-43.8	0	0	0	113.5	K155 L347 I349 W353 P355	K155-D351 IonicContact NZ-OD1 2.53Å; K155-D351 PolarHBondContact NZ-OD1 3.01Å; K155-D351 IonicContact NZ-OD2 2.78Å; K155-D351 PolarHBondContact NZ-OD2 3.44Å; L347-D351 WeakPolarHBondContact O-CB 3.41Å; L347-D351 PolarHBondContact O-N 2.99Å; I349-D351 VanDerWaalsContact C-N 3.32Å; I349-D351 PolarHBondContact O-N 3.45Å; D351-W353 VanDerWaalsContact C-N 3.33Å; D351-P355 WeakPolarHBondContact O-CD 3.4Å
352	K	49.1	Very low	42	Very low	137 Å²	137	64 Å²	64	60%	0.596	32%	0.324	S	S	*	.	H	α-helix	trans	-71.8	-30	175.4	-71.6	177.1	176	-171.8	0	112.6	G348 I349 I350	G348-K352 WeakPolarHBondContact O-CG 3.27Å; G348-K352 PolarHBondContact O-N 3.27Å; I349-K352 WeakPolarHBondContact O-CB 3.28Å; I349-K352 PolarHBondContact O-N 3.1Å; I350-K352 VanDerWaalsContact C-N 3.27Å; I350-K352 PolarHBondContact O-N 2.87Å
353	W	41.4	Very low	41.5	Very low	31 Å²	31	66.2 Å²	66.2	12%	0.117	34%	0.337	C	S	.	.	H	α-helix	trans	-90.8	-31.6	-170.9	-131.4	72.1	0	0	0	113.3	I349 I350 D351 N356 L357 L391 L395	I349-W353 PolarHBondContact O-N 3.29Å; I350-W353 PolarHBondContact O-N 3.39Å; D351-W353 VanDerWaalsContact C-N 3.33Å; W353-N356 WeakPolarHBondContact O-CB 3.29Å; W353-N356 PolarHBondContact O-N 3.27Å; W353-L357 HydrophobicContact CE3-CD1 3.34Å; W353-L357 HydrophobicContact CE3-CD2 4.43Å; W353-L357 HydrophobicContact CE3-CG 3.6Å; W353-L357 HydrophobicContact CZ3-CD1 3.57Å; W353-L357 HydrophobicContact CZ3-CD2 3.91Å; W353-L357 HydrophobicContact CZ3-CG 3.58Å; W353-L357 PolarHBondContact O-N 2.87Å; W353-L357 VanDerWaalsContact O-N 3.11Å; W353-L391 HydrophobicContact CH2-CB 4.16Å; W353-L391 HydrophobicContact CZ2-CB 3.82Å; W353-L391 VanDerWaalsContact CZ2-O 3.28Å; W353-L391 WeakPolarHBondContact CZ2-O 3.43Å; W353-L395 HydrophobicContact CD2-CD1 3.86Å; W353-L395 HydrophobicContact CG-CD1 3.85Å; W353-L395 HydrophobicContact CZ2-CB 3.81Å; W353-L395 HydrophobicContact CZ2-CD1 4.16Å; W353-L395 HydrophobicContact CZ2-CG 4.39Å
354	Q	41.3	Very low	41	Very low	39 Å²	39	70.3 Å²	70.3	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-55.6	-42.2	-176.7	-171.2	173.7	1.5	0	0	114.1	I350 N356 L357 N358	I350-Q354 WeakPolarHBondContact O-CB 3.15Å; I350-Q354 PolarHBondContact O-N 3.05Å; Q354-N356 VanDerWaalsContact C-N 3.31Å; Q354-N356 PolarHBondContact O-N 3.45Å; Q354-L357 PolarHBondContact O-N 3.15Å; Q354-N358 PolarHBondContact O-N 3.49Å; Q354-N358 VanDerWaalsContact O-N 3.07Å; Q354-N358 PolarHBondContact O-ND2 3.32Å
355	P	48.4	Very low	40.1	Very low	65 Å²	65	71.9 Å²	71.9	42%	0.422	38%	0.379	S	S	.	.	H	α-helix	trans	-62.9	-36	175.6	-21.7	33.8	0	0	0	113.1	D351 N358 N359	D351-P355 WeakPolarHBondContact O-CD 3.4Å; P355-N358 PolarHBondContact O-N 2.9Å; P355-N359 PolarHBondContact O-N 3.27Å; P355-N359 VanDerWaalsContact O-N 3.1Å; P355-N359 PolarHBondContact O-ND2 3.23Å
356	N	41.4	Very low	39.4	Very low	73 Å²	73	71.7 Å²	71.7	39%	0.39	39%	0.39	S	S	.	.	H	α-helix	trans	-73.1	-34.9	-178.7	-63.5	-29.6	0	0	0	112.3	W353 Q354 L391	W353-N356 WeakPolarHBondContact O-CB 3.29Å; W353-N356 PolarHBondContact O-N 3.27Å; Q354-N356 VanDerWaalsContact C-N 3.31Å; Q354-N356 PolarHBondContact O-N 3.45Å; N356-L391 HydrophobicContact CB-CD2 3.57Å
357	L	37.6	Very low	39	Very low	6 Å²	6	74.6 Å²	74.6	3%	0.031	41%	0.409	C	S	.	.	H	α-helix	trans	-65.4	-38.2	169.5	-91.7	164.7	0	0	0	112.5	C159 W353 Q354 L360	C159-L357 HydrophobicContact CB-CD1 4.32Å; W353-L357 HydrophobicContact CE3-CD1 3.34Å; W353-L357 HydrophobicContact CE3-CD2 4.43Å; W353-L357 HydrophobicContact CE3-CG 3.6Å; W353-L357 HydrophobicContact CZ3-CD1 3.57Å; W353-L357 HydrophobicContact CZ3-CD2 3.91Å; W353-L357 HydrophobicContact CZ3-CG 3.58Å; W353-L357 PolarHBondContact O-N 2.87Å; W353-L357 VanDerWaalsContact O-N 3.11Å; Q354-L357 PolarHBondContact O-N 3.15Å; L357-L360 HydrophobicContact CD2-CD1 4.42Å; L357-L360 PolarHBondContact O-N 3.21Å
358	N	43.1	Very low	38.6	Very low	92 Å²	92	81.4 Å²	81.4	49%	0.492	45%	0.451	S	S	.	.	H	α-helix	trans	-70.2	-32.3	-179.9	-72.1	-15.1	0	0	0	112.5	Q354 P355 L360	Q354-N358 PolarHBondContact O-N 3.49Å; Q354-N358 VanDerWaalsContact O-N 3.07Å; Q354-N358 PolarHBondContact O-ND2 3.32Å; P355-N358 PolarHBondContact O-N 2.9Å; N358-L360 PolarHBondContact O-N 3.5Å
359	N	46.8	Very low	37.9	Very low	125 Å²	125	82.8 Å²	82.8	67%	0.668	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.5	178.9	-68	-13.8	0	0	0	113.9	P355 E361	P355-N359 PolarHBondContact O-N 3.27Å; P355-N359 VanDerWaalsContact O-N 3.1Å; P355-N359 PolarHBondContact O-ND2 3.23Å; N359-E361 VanDerWaalsContact C-N 3.31Å; N359-E361 PolarHBondContact O-N 3.04Å
360	L	33.2	Very low	37.4	Very low	13 Å²	13	89.2 Å²	89.2	7%	0.068	50%	0.501	C	S	.	.			trans	-74	88.5	166.8	-73.2	163.9	0	0	0	108.6	L166 L357 N358 I362 K387 L388 L391	L166-L360 HydrophobicContact CD1-CD1 4.12Å; L357-L360 HydrophobicContact CD2-CD1 4.42Å; L357-L360 PolarHBondContact O-N 3.21Å; N358-L360 PolarHBondContact O-N 3.5Å; L360-I362 PolarHBondContact O-N 3.24Å; L360-K387 HydrophobicContact CD2-CB 4.03Å; L360-L388 HydrophobicContact CD1-CD1 4.25Å; L360-L391 HydrophobicContact CD1-CD1 3.76Å; L360-L391 HydrophobicContact CD2-CD1 4.21Å; L360-L391 HydrophobicContact CG-CD1 4.1Å
361	E	38.1	Very low	37	Very low	143 Å²	143	96 Å²	96	67%	0.668	54%	0.537	S	S	*	.			trans	-68.8	120.4	171.7	-75.2	-176.5	165.7	0	0	110.1	N359 N363	N359-E361 VanDerWaalsContact C-N 3.31Å; N359-E361 PolarHBondContact O-N 3.04Å; E361-N363 VanDerWaalsContact C-N 3.35Å; E361-N363 PolarHBondContact O-N 3.07Å
362	I	35.7	Very low	36.4	Very low	51 Å²	51	99.8 Å²	99.8	26%	0.262	56%	0.557	S	S	.	*			trans	-78.1	93.3	163.9	-58.5	162.9	0	0	0	104.4	L166 L360 S364	L166-I362 HydrophobicContact CD2-CD1 4.48Å; L166-I362 HydrophobicContact CD2-CG1 4.21Å; L360-I362 PolarHBondContact O-N 3.24Å; I362-S364 PolarHBondContact O-N 3.22Å
363	N	32.3	Very low	35.5	Very low	129 Å²	129	97 Å²	97	69%	0.69	57%	0.566	S	S	*	*			trans	-66.2	89.9	167.7	-86	-12.3	0	0	0	107.9	E361 N365	E361-N363 VanDerWaalsContact C-N 3.35Å; E361-N363 PolarHBondContact O-N 3.07Å; N363-N365 PolarHBondContact O-N 3.02Å
364	S	30.4	Very low	35	Very low	97 Å²	97	100.6 Å²	100.6	68%	0.678	60%	0.596	S	S	*	*			trans	-83.8	18.8	174.1	59	0	0	0	0	112.7	I362	I362-S364 PolarHBondContact O-N 3.22Å
365	N	26.8	Very low	34.5	Very low	147 Å²	147	106.6 Å²	106.6	79%	0.786	63%	0.63	S	S	*	*			trans	-128.4	84.6	-174	-72.2	-10.4	0	0	0	111.9	N363	N363-N365 PolarHBondContact O-N 3.02Å
366	S	30.5	Very low	33.5	Very low	95 Å²	95	114.5 Å²	114.5	66%	0.664	65%	0.651	S	S	*	*			trans	-172.2	119.4	159.8	55.5	0	0	0	0	105.4
367	D	31.5	Very low	33	Very low	146 Å²	146	115.8 Å²	115.8	78%	0.781	67%	0.666	S	S	*	*			cis	-152.8	114	22.9	-76.5	-43.5	0	0	0	109.2
368	T	30.3	Very low	32.6	Very low	158 Å²	158	122.2 Å²	122.2	97%	0.969	71%	0.705	S	S	*	*			trans	-110.3	30.7	151	54.7	0	0	0	0	109.9
369	G	30.8	Very low	31.9	Very low	62 Å²	62	125 Å²	125	64%	0.639	72%	0.72	S	S	*	*			trans	-89.2	120.1	-178.6	0	0	0	0	0	110.8	L371	G369-L371 PolarHBondContact O-N 3.45Å
370	D	31.7	Very low	31.2	Very low	157 Å²	157	128.4 Å²	128.4	84%	0.84	73%	0.732	S	S	*	*			trans	-32.9	128.5	177.4	-79.8	-51.4	0	0	0	115	N372	D370-N372 VanDerWaalsContact C-N 3.29Å; D370-N372 PolarHBondContact O-N 2.99Å
371	L	30.8	Very low	31.1	Very low	168 Å²	168	133.1 Å²	133.1	88%	0.88	77%	0.766	S	S	*	*	S	Bend	trans	-53.4	93.2	155.1	-69.3	162.7	0	0	0	108.4	G369	G369-L371 PolarHBondContact O-N 3.45Å
372	N	33.2	Very low	30.8	Very low	162 Å²	162	132.5 Å²	132.5	87%	0.866	76%	0.763	S	S	*	*			trans	179.2	108.9	145.7	-89.8	-32.3	0	0	0	111.6	D370	D370-N372 VanDerWaalsContact C-N 3.29Å; D370-N372 PolarHBondContact O-N 2.99Å
373	G	29.8	Very low	31	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	77%	0.772	S	S	*	*			trans	98.8	132	143.7	0	0	0	0	0	116.2
374	S	32	Very low	31.1	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	76%	0.757	S	S	*	*			trans	86.4	86	156.8	-166.5	0	0	0	0	117.4	R376	S374-R376 PolarHBondContact O-N 3.45Å; S374-R376 VanDerWaalsContact O-N 3.08Å
375	N	29.4	Very low	31.2	Very low	165 Å²	165	130.6 Å²	130.6	88%	0.882	75%	0.751	S	S	*	*			trans	3.3	94.4	130.7	-74.1	-16.2	0	0	0	115
376	R	29.3	Very low	31.6	Very low	231 Å²	231	125.4 Å²	125.4	87%	0.872	73%	0.726	S	S	*	*			trans	-143.9	102.5	156.8	-107.1	177.7	-173.9	-178.7	1	111	S374	S374-R376 PolarHBondContact O-N 3.45Å; S374-R376 VanDerWaalsContact O-N 3.08Å
377	S	29.7	Very low	32	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	72%	0.715	S	S	*	*			trans	46.4	91.1	149.2	58.6	0	0	0	0	118.6	N379	S377-N379 PolarHBondContact O-N 3.09Å; S377-N379 VanDerWaalsContact O-N 3.11Å
378	V	28.8	Very low	32.3	Very low	140 Å²	140	121.2 Å²	121.2	85%	0.848	69%	0.691	S	S	*	*	S	Bend	trans	-41	104.8	138.8	179.4	0	0	0	0	108.9
379	N	30	Very low	32.6	Very low	151 Å²	151	116.7 Å²	116.7	81%	0.807	67%	0.666	S	S	*	*			trans	-175	4.3	161	-95.3	-11.3	0	0	0	117.5	S377	S377-N379 PolarHBondContact O-N 3.09Å; S377-N379 VanDerWaalsContact O-N 3.11Å
380	E	31.4	Very low	33	Very low	196 Å²	196	118.6 Å²	118.6	92%	0.916	66%	0.658	S	S	*	*			trans	-113.1	4.4	-176.8	-72.6	-173.4	167.7	0	0	116.1	E382	E380-E382 PolarHBondContact O-N 3.44Å
381	S	30.7	Very low	33.4	Very low	113 Å²	113	112 Å²	112	79%	0.79	62%	0.623	S	S	*	*			trans	-91.9	53.6	178.9	66.7	0	0	0	0	113.1	S383	S381-S383 VanDerWaalsContact C-N 3.31Å; S381-S383 PolarHBondContact O-N 3.4Å
382	E	32.4	Very low	33.8	Very low	129 Å²	129	108.6 Å²	108.6	60%	0.603	61%	0.605	S	S	*	*			trans	-70.8	96.6	156.9	-103.6	-172.1	164.9	0	0	107.2	E380	E380-E382 PolarHBondContact O-N 3.44Å
383	S	39.1	Very low	34	Very low	65 Å²	65	106 Å²	106	46%	0.455	59%	0.591	S	S	.	*			trans	-46.8	142.5	-171.4	71.8	0	0	0	0	112.4	S381 N385 S386 K387	S381-S383 VanDerWaalsContact C-N 3.31Å; S381-S383 PolarHBondContact O-N 3.4Å; S383-N385 PolarHBondContact O-N 3.41Å; S383-S386 WeakPolarHBondContact O-CA 3.28Å; S383-S386 VanDerWaalsContact O-CB 3.29Å; S383-S386 WeakPolarHBondContact O-CB 3.4Å; S383-S386 PolarHBondContact O-N 3.11Å; S383-S386 PolarHBondContact OG-N 2.93Å; S383-K387 PolarHBondContact O-N 3.28Å
384	N	34.6	Very low	34.4	Very low	71 Å²	71	106.6 Å²	106.6	38%	0.38	58%	0.575	S	S	.	*	H	α-helix	trans	-51.6	-23.2	174.2	-76.4	-21	0	0	0	112.9	K387 L388	N384-K387 PolarHBondContact O-N 3.05Å; N384-L388 WeakPolarHBondContact O-CB 3.1Å; N384-L388 PolarHBondContact O-N 3Å
385	N	32	Very low	34.8	Very low	102 Å²	102	103.8 Å²	103.8	55%	0.545	55%	0.552	S	S	.	*	H	α-helix	trans	-66.7	-35.8	171.7	-70.3	-17	0	0	0	113.5	S383 S389	S383-N385 PolarHBondContact O-N 3.41Å; N385-S389 VanDerWaalsContact O-CB 3.3Å; N385-S389 WeakPolarHBondContact O-CB 3.34Å; N385-S389 PolarHBondContact O-N 3.11Å; N385-S389 PolarHBondContact O-OG 3.16Å
386	S	36.6	Very low	35.2	Very low	37 Å²	37	98.9 Å²	98.9	26%	0.259	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-46.1	171.7	-179	0	0	0	0	110.5	S383 S389 Q390	S383-S386 WeakPolarHBondContact O-CA 3.28Å; S383-S386 VanDerWaalsContact O-CB 3.29Å; S383-S386 WeakPolarHBondContact O-CB 3.4Å; S383-S386 PolarHBondContact O-N 3.11Å; S383-S386 PolarHBondContact OG-N 2.93Å; S386-S389 PolarHBondContact O-N 3.48Å; S386-Q390 VanDerWaalsContact O-CG 3.3Å; S386-Q390 WeakPolarHBondContact O-CG 3.08Å; S386-Q390 PolarHBondContact O-N 3Å; S386-Q390 PolarHBondContact OG-NE2 3.38Å
387	K	38.5	Very low	35.8	Very low	98 Å²	98	94.3 Å²	94.3	43%	0.426	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-42.2	177.8	-67.4	177.5	-177.7	171.6	0	112.6	L360 S383 N384 Q390 L391	L360-K387 HydrophobicContact CD2-CB 4.03Å; S383-K387 PolarHBondContact O-N 3.28Å; N384-K387 PolarHBondContact O-N 3.05Å; K387-Q390 PolarHBondContact O-N 3.3Å; K387-L391 WeakPolarHBondContact O-CG 3.43Å; K387-L391 PolarHBondContact O-N 3.28Å
388	L	37.1	Very low	36.2	Very low	55 Å²	55	92.1 Å²	92.1	29%	0.288	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-43	174.2	-169.3	77.6	0	0	0	111.8	L166 L360 N384 L391 L392	L166-L388 HydrophobicContact CD1-CD1 4.34Å; L360-L388 HydrophobicContact CD1-CD1 4.25Å; N384-L388 WeakPolarHBondContact O-CB 3.1Å; N384-L388 PolarHBondContact O-N 3Å; L388-L391 WeakPolarHBondContact O-CB 3.49Å; L388-L391 PolarHBondContact O-N 3.12Å; L388-L392 HydrophobicContact CG-CD1 4.4Å; L388-L392 PolarHBondContact O-N 3.39Å
389	S	37.3	Very low	36.7	Very low	64 Å²	64	88.3 Å²	88.3	45%	0.448	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177	-59	0	0	0	0	111.9	N385 S386 L391 L392 L393	N385-S389 VanDerWaalsContact O-CB 3.3Å; N385-S389 WeakPolarHBondContact O-CB 3.34Å; N385-S389 PolarHBondContact O-N 3.11Å; N385-S389 PolarHBondContact O-OG 3.16Å; S386-S389 PolarHBondContact O-N 3.48Å; S389-L391 VanDerWaalsContact C-N 3.35Å; S389-L392 PolarHBondContact O-N 3.43Å; S389-L393 PolarHBondContact O-N 3.09Å
390	Q	39	Very low	37.1	Very low	101 Å²	101	84.7 Å²	84.7	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-39.8	173.8	-72.9	176.6	19.9	0	0	112	S386 K387 L393 L394	S386-Q390 VanDerWaalsContact O-CG 3.3Å; S386-Q390 WeakPolarHBondContact O-CG 3.08Å; S386-Q390 PolarHBondContact O-N 3Å; S386-Q390 PolarHBondContact OG-NE2 3.38Å; K387-Q390 PolarHBondContact O-N 3.3Å; Q390-L393 WeakPolarHBondContact O-CB 3.48Å; Q390-L393 PolarHBondContact O-N 3Å; Q390-L394 PolarHBondContact O-N 3.14Å
391	L	39.3	Very low	37.5	Very low	20 Å²	20	81 Å²	81	11%	0.105	43%	0.427	C	S	.	.	H	α-helix	trans	-64	-45.8	175.6	-76	166.3	0	0	0	111.9	W353 N356 L360 K387 L388 S389 L393 L394 L395	W353-L391 HydrophobicContact CH2-CB 4.16Å; W353-L391 HydrophobicContact CZ2-CB 3.82Å; W353-L391 VanDerWaalsContact CZ2-O 3.28Å; W353-L391 WeakPolarHBondContact CZ2-O 3.43Å; N356-L391 HydrophobicContact CB-CD2 3.57Å; L360-L391 HydrophobicContact CD1-CD1 3.76Å; L360-L391 HydrophobicContact CD2-CD1 4.21Å; L360-L391 HydrophobicContact CG-CD1 4.1Å; K387-L391 WeakPolarHBondContact O-CG 3.43Å; K387-L391 PolarHBondContact O-N 3.28Å; L388-L391 WeakPolarHBondContact O-CB 3.49Å; L388-L391 PolarHBondContact O-N 3.12Å; S389-L391 VanDerWaalsContact C-N 3.35Å; L391-L393 VanDerWaalsContact C-N 3.31Å; L391-L393 PolarHBondContact O-N 2.89Å; L391-L394 WeakPolarHBondContact O-CB 3.42Å; L391-L394 PolarHBondContact O-N 2.86Å; L391-L394 VanDerWaalsContact O-N 3.14Å; L391-L395 PolarHBondContact O-N 3.3Å
392	L	39.7	Very low	37.8	Very low	95 Å²	95	78.1 Å²	78.1	50%	0.497	40%	0.402	S	S	.	.	H	α-helix	trans	-57.5	-42.6	174.2	-80.5	159.2	0	0	0	111.8	L388 S389 L395 H396	L388-L392 HydrophobicContact CG-CD1 4.4Å; L388-L392 PolarHBondContact O-N 3.39Å; S389-L392 PolarHBondContact O-N 3.43Å; L392-L395 WeakPolarHBondContact O-CB 3.08Å; L392-L395 PolarHBondContact O-N 2.67Å; L392-H396 PolarHBondContact O-N 2.85Å
393	L	38	Very low	38	Very low	107 Å²	107	75.1 Å²	75.1	56%	0.56	39%	0.388	S	S	*	.	H	α-helix	trans	-63.4	-38.1	174.4	-107.4	134.6	0	0	0	113.1	S389 Q390 L391 H396 K397	S389-L393 PolarHBondContact O-N 3.09Å; Q390-L393 WeakPolarHBondContact O-CB 3.48Å; Q390-L393 PolarHBondContact O-N 3Å; L391-L393 VanDerWaalsContact C-N 3.31Å; L391-L393 PolarHBondContact O-N 2.89Å; L393-H396 PolarHBondContact O-N 3.24Å; L393-K397 WeakPolarHBondContact O-CG 3.44Å; L393-K397 PolarHBondContact O-N 3.21Å
394	L	38.4	Very low	37.8	Very low	91 Å²	91	74.8 Å²	74.8	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-66.2	-42.8	174.2	-91.6	148.5	0	0	0	111.9	Q390 L391 H396 K397 D398	Q390-L394 PolarHBondContact O-N 3.14Å; L391-L394 WeakPolarHBondContact O-CB 3.42Å; L391-L394 PolarHBondContact O-N 2.86Å; L391-L394 VanDerWaalsContact O-N 3.14Å; L394-H396 VanDerWaalsContact C-N 3.33Å; L394-H396 PolarHBondContact O-N 3.1Å; L394-K397 PolarHBondContact O-N 3.21Å; L394-D398 PolarHBondContact O-N 3.5Å
395	L	39.3	Very low	38	Very low	47 Å²	47	76.9 Å²	76.9	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-58.2	-46.6	173.9	-169.2	86	0	0	0	110.9	I349 W353 L391 L392 K397 D398 I399	I349-L395 HydrophobicContact CG2-CD1 4.19Å; W353-L395 HydrophobicContact CD2-CD1 3.86Å; W353-L395 HydrophobicContact CG-CD1 3.85Å; W353-L395 HydrophobicContact CZ2-CB 3.81Å; W353-L395 HydrophobicContact CZ2-CD1 4.16Å; W353-L395 HydrophobicContact CZ2-CG 4.39Å; L391-L395 PolarHBondContact O-N 3.3Å; L392-L395 WeakPolarHBondContact O-CB 3.08Å; L392-L395 PolarHBondContact O-N 2.67Å; L395-K397 PolarHBondContact O-N 3.24Å; L395-D398 PolarHBondContact O-N 3.46Å; L395-I399 HydrophobicContact CD2-CD1 4.17Å; L395-I399 HydrophobicContact CG-CD1 4Å; L395-I399 VanDerWaalsContact O-CG1 3.29Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.71Å
396	H	38.7	Very low	38.1	Very low	63 Å²	63	75 Å²	75	29%	0.292	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-43.7	179	-169	75.8	0	0	0	111.6	E266 L392 L393 L394 D398 I399 I400	E266-H396 IonicContact OE1-CE1 3.75Å; E266-H396 IonicContact OE1-ND1 2.72Å; E266-H396 IonicContact OE2-CE1 3.11Å; E266-H396 PolarHBondContact OE2-CE1 3.44Å; E266-H396 IonicContact OE2-ND1 3.21Å; E266-H396 PolarHBondContact OE2-ND1 3.44Å; L392-H396 PolarHBondContact O-N 2.85Å; L393-H396 PolarHBondContact O-N 3.24Å; L394-H396 VanDerWaalsContact C-N 3.33Å; L394-H396 PolarHBondContact O-N 3.1Å; H396-D398 PolarHBondContact O-N 3.4Å; H396-I399 PolarHBondContact O-N 2.96Å; H396-I400 VanDerWaalsContact O-CG1 3.3Å; H396-I400 WeakPolarHBondContact O-CG1 3.1Å; H396-I400 PolarHBondContact O-N 3.44Å
397	K	41	Very low	37.9	Very low	134 Å²	134	78 Å²	78	58%	0.583	39%	0.389	S	S	*	.	H	α-helix	trans	-62.4	-40.9	174.4	-76.5	178.9	-179.8	178.3	0	113	L393 L394 L395 I400 H401	L393-K397 WeakPolarHBondContact O-CG 3.44Å; L393-K397 PolarHBondContact O-N 3.21Å; L394-K397 PolarHBondContact O-N 3.21Å; L395-K397 PolarHBondContact O-N 3.24Å; K397-I400 PolarHBondContact O-N 3.41Å; K397-H401 WeakPolarHBondContact O-CB 3.29Å; K397-H401 PolarHBondContact O-N 3.49Å
398	D	38.2	Very low	37.7	Very low	56 Å²	56	79 Å²	79	30%	0.299	40%	0.399	S	S	.	.	H	α-helix	trans	-67.8	-38.9	179	-87.1	-7.3	0	0	0	112	L394 L395 H396 H401 L402	L394-D398 PolarHBondContact O-N 3.5Å; L395-D398 PolarHBondContact O-N 3.46Å; H396-D398 PolarHBondContact O-N 3.4Å; D398-H401 PolarHBondContact O-N 2.88Å; D398-L402 WeakPolarHBondContact O-CB 3.35Å; D398-L402 PolarHBondContact O-N 3.49Å
399	I	39	Very low	37.4	Very low	60 Å²	60	82.1 Å²	82.1	31%	0.308	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-47.1	173.7	-69.7	167.3	0	0	0	110.2	L395 H396 H401 L402 Q403	L395-I399 HydrophobicContact CD2-CD1 4.17Å; L395-I399 HydrophobicContact CG-CD1 4Å; L395-I399 VanDerWaalsContact O-CG1 3.29Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.71Å; H396-I399 PolarHBondContact O-N 2.96Å; I399-H401 PolarHBondContact O-N 2.91Å; I399-L402 PolarHBondContact O-N 3.44Å; I399-Q403 WeakPolarHBondContact O-CB 3.32Å; I399-Q403 PolarHBondContact O-N 3.01Å
400	I	38.1	Very low	36.9	Very low	75 Å²	75	85 Å²	85	39%	0.385	43%	0.429	S	S	.	.	H	α-helix	trans	-59.8	-46.7	175.4	-68.4	167.3	0	0	0	110.8	H396 K397 L402 Q403 T404	H396-I400 VanDerWaalsContact O-CG1 3.3Å; H396-I400 WeakPolarHBondContact O-CG1 3.1Å; H396-I400 PolarHBondContact O-N 3.44Å; K397-I400 PolarHBondContact O-N 3.41Å; I400-L402 VanDerWaalsContact C-N 3.3Å; I400-L402 PolarHBondContact O-N 3.04Å; I400-Q403 WeakPolarHBondContact O-CB 3.33Å; I400-Q403 PolarHBondContact O-N 2.9Å; I400-T404 PolarHBondContact O-N 3.25Å; I400-T404 PolarHBondContact O-OG1 3.37Å
401	H	41	Very low	36.5	Very low	119 Å²	119	84.5 Å²	84.5	55%	0.551	43%	0.429	S	S	*	.	H	α-helix	trans	-62.8	-37.6	178.4	-172.9	76.8	0	0	0	112.2	K397 D398 I399 Q403 T404 K405	K397-H401 WeakPolarHBondContact O-CB 3.29Å; K397-H401 PolarHBondContact O-N 3.49Å; D398-H401 PolarHBondContact O-N 2.88Å; I399-H401 PolarHBondContact O-N 2.91Å; H401-Q403 VanDerWaalsContact C-N 3.34Å; H401-T404 PolarHBondContact O-N 3.47Å; H401-K405 VanDerWaalsContact O-CB 3.23Å; H401-K405 WeakPolarHBondContact O-CB 3.37Å; H401-K405 PolarHBondContact O-N 3.09Å
402	L	37.5	Very low	35.9	Very low	52 Å²	52	93.3 Å²	93.3	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-37.9	176.6	-148	114.3	0	0	0	111.6	K345 I349 D398 I399 I400 K405 L406	K345-L402 HydrophobicContact CD-CD2 4.37Å; I349-L402 HydrophobicContact CD1-CD1 4.14Å; I349-L402 HydrophobicContact CD1-CD2 4.21Å; I349-L402 HydrophobicContact CG1-CD1 4.12Å; D398-L402 WeakPolarHBondContact O-CB 3.35Å; D398-L402 PolarHBondContact O-N 3.49Å; I399-L402 PolarHBondContact O-N 3.44Å; I400-L402 VanDerWaalsContact C-N 3.3Å; I400-L402 PolarHBondContact O-N 3.04Å; L402-K405 PolarHBondContact O-N 3.28Å; L402-L406 HydrophobicContact CD2-CD1 4Å; L402-L406 VanDerWaalsContact O-CB 3.27Å; L402-L406 WeakPolarHBondContact O-CB 3.34Å; L402-L406 WeakPolarHBondContact O-CG 3.48Å; L402-L406 PolarHBondContact O-N 3.29Å
403	Q	35.2	Very low	35.3	Very low	65 Å²	65	95.5 Å²	95.5	30%	0.304	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-51.3	173.2	-175.1	177.8	-10.8	0	0	110.8	I399 I400 H401 K405 L406 E407	I399-Q403 WeakPolarHBondContact O-CB 3.32Å; I399-Q403 PolarHBondContact O-N 3.01Å; I400-Q403 WeakPolarHBondContact O-CB 3.33Å; I400-Q403 PolarHBondContact O-N 2.9Å; H401-Q403 VanDerWaalsContact C-N 3.34Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 3.48Å; Q403-L406 WeakPolarHBondContact O-CB 3.5Å; Q403-L406 PolarHBondContact O-N 3.25Å; Q403-E407 WeakPolarHBondContact O-CG 3.43Å; Q403-E407 PolarHBondContact O-N 3.1Å
404	T	36.4	Very low	34.8	Very low	59 Å²	59	98.5 Å²	98.5	36%	0.362	49%	0.485	S	S	.	.	H	α-helix	trans	-62.9	-34.7	177.2	-44.5	0	0	0	0	112.5	I400 H401 N408	I400-T404 PolarHBondContact O-N 3.25Å; I400-T404 PolarHBondContact O-OG1 3.37Å; H401-T404 PolarHBondContact O-N 3.47Å; T404-N408 WeakPolarHBondContact CG2-ND2 3.49Å; T404-N408 WeakPolarHBondContact O-CB 3.36Å; T404-N408 PolarHBondContact O-N 3.41Å; T404-N408 PolarHBondContact O-ND2 3.47Å
405	K	37.2	Very low	34.1	Very low	114 Å²	114	102.7 Å²	102.7	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-75.1	-34.1	177.8	-165.2	174.8	-173.9	174.7	0	112.5	H401 L402 Q403 Q409	H401-K405 VanDerWaalsContact O-CB 3.23Å; H401-K405 WeakPolarHBondContact O-CB 3.37Å; H401-K405 PolarHBondContact O-N 3.09Å; L402-K405 PolarHBondContact O-N 3.28Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 3.48Å; K405-Q409 PolarHBondContact O-N 2.95Å
406	L	35.5	Very low	33.4	Very low	63 Å²	63	106.7 Å²	106.7	33%	0.33	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-47.6	170.5	-88.9	163.4	0	0	0	110.2	I312 K345 L402 Q403 N408	I312-L406 WeakPolarHBondContact CD1-O 3.46Å; K345-L406 HydrophobicContact CD-CD2 4.5Å; L402-L406 HydrophobicContact CD2-CD1 4Å; L402-L406 VanDerWaalsContact O-CB 3.27Å; L402-L406 WeakPolarHBondContact O-CB 3.34Å; L402-L406 WeakPolarHBondContact O-CG 3.48Å; L402-L406 PolarHBondContact O-N 3.29Å; Q403-L406 WeakPolarHBondContact O-CB 3.5Å; Q403-L406 PolarHBondContact O-N 3.25Å; L406-N408 VanDerWaalsContact C-N 3.26Å; L406-N408 PolarHBondContact O-N 3Å
407	E	32.7	Very low	32.9	Very low	99 Å²	99	109.5 Å²	109.5	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-59.2	-31	178	-74.1	164.8	-178.5	0	0	113.7	Q403	Q403-E407 WeakPolarHBondContact O-CG 3.43Å; Q403-E407 PolarHBondContact O-N 3.1Å
408	N	32.6	Very low	32.1	Very low	120 Å²	120	109.3 Å²	109.3	64%	0.642	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	3.3	-170.5	-70.5	-51.3	0	0	0	116	T404 L406	T404-N408 WeakPolarHBondContact CG2-ND2 3.49Å; T404-N408 WeakPolarHBondContact O-CB 3.36Å; T404-N408 PolarHBondContact O-N 3.41Å; T404-N408 PolarHBondContact O-ND2 3.47Å; L406-N408 VanDerWaalsContact C-N 3.26Å; L406-N408 PolarHBondContact O-N 3Å
409	Q	30.5	Very low	31.5	Very low	120 Å²	120	111.3 Å²	111.3	56%	0.561	57%	0.574	S	S	*	*			trans	-123.9	117.5	179.2	-74.6	-166.2	-18	0	0	113.7	K405	K405-Q409 PolarHBondContact O-N 2.95Å
410	P	27.9	Very low	30.8	Very low	125 Å²	125	117.1 Å²	117.1	81%	0.812	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-70.4	132.8	174	26.7	-31.2	0	0	0	111.7
411	I	29.8	Very low	30.2	Very low	91 Å²	91	121.4 Å²	121.4	47%	0.467	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-94.6	116.3	-176.6	-57.8	173	0	0	0	109.7
412	K	26.4	Very low	29.3	Very low	204 Å²	204	120.2 Å²	120.2	89%	0.887	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-79.8	135.1	169.9	-73.2	-175.7	177.1	-178.2	0	111.1
413	Y	28.7	Very low	28.7	Very low	142 Å²	142	126.6 Å²	126.6	56%	0.557	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-101.4	121.7	173.9	-73.1	-88.4	0	0	0	110.5	R341	R341-Y413 VanDerWaalsContact NH1-CE1 3.32Å
414	D	26.4	Very low	28.4	Very low	169 Å²	169	131.7 Å²	131.7	90%	0.904	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-96.6	116.8	162.5	-92.9	-26.1	0	0	0	109.4
415	E	25	Very low	27.9	Very low	180 Å²	180	135 Å²	135	84%	0.841	70%	0.703	S	S	*	*			trans	-88.2	102.6	175	-70.4	-172.3	144.5	0	0	110.2
416	T	24.2	Very low	27.6	Very low	131 Å²	131	130.3 Å²	130.3	80%	0.804	68%	0.684	S	S	*	*			trans	-164.6	145.5	151.7	33.3	0	0	0	0	111.2
417	S	26.8	Very low	27.4	Very low	122 Å²	122	131.4 Å²	131.4	85%	0.853	69%	0.69	S	S	*	*			trans	105.5	85.9	165.9	-42.1	0	0	0	0	116.8
418	I	25.3	Very low	27.4	Very low	129 Å²	129	131 Å²	131	66%	0.662	69%	0.687	S	S	*	*			trans	-85.1	146.8	164.1	-42.4	168.6	0	0	0	106.6
419	V	25.8	Very low	27.5	Very low	99 Å²	99	127.6 Å²	127.6	60%	0.6	67%	0.665	S	S	*	*				152	139.4	93.1	179.3	0	0	0	0	110.7
420	K	24.1	Very low	27.7	Very low	181 Å²	181	123.9 Å²	123.9	79%	0.787	65%	0.651	S	S	*	*			trans	59.4	114.9	150	-68.6	158.3	-158.4	178.6	0	121.4
421	N	25.8	Very low	28.1	Very low	165 Å²	165	123 Å²	123	88%	0.882	64%	0.638	S	S	*	*				-167.4	125.5	98.9	-90.8	-16.1	0	0	0	110.3
422	A	22.3	Very low	28.5	Very low	95 Å²	95	120.2 Å²	120.2	79%	0.785	63%	0.629	S	S	*	*			trans	-96.7	133.8	179.6	0	0	0	0	0	110.2
423	Q	24.2	Very low	29.1	Very low	185 Å²	185	111.4 Å²	111.4	86%	0.864	59%	0.591	S	S	*	*			trans	-155.8	91	155.2	-113.6	150.1	-4.3	0	0	110.4	Y140	Y140-Q423 PolarHBondContact OH-O 2.93Å
424	K	28.3	Very low	29.5	Very low	173 Å²	173	106.6 Å²	106.6	75%	0.752	58%	0.578	S	S	*	*			trans	53.2	123.3	165.3	-81.4	176.8	178.5	-178.7	0	119.1	Y140	Y140-K424 WeakPolarHBondContact OH-CB 3.43Å; Y140-K424 PolarHBondContact OH-O 3.02Å
425	P	27.6	Very low	30.2	Very low	127 Å²	127	103.8 Å²	103.8	83%	0.825	56%	0.562	S	S	*	*			trans	-80.2	154.6	176.8	33.8	-31.7	0	0	0	111.1
426	L	30.7	Very low	31	Very low	17 Å²	17	97.8 Å²	97.8	9%	0.089	54%	0.535	C	S	.	.			trans	-102	131	-167.9	-164.5	91.3	0	0	0	109.6	Y140 L141 C144 F428	Y140-L426 HydrophobicContact CD1-CD1 3.2Å; Y140-L426 HydrophobicContact CE1-CD1 3.82Å; Y140-L426 HydrophobicContact CG-CD1 3.83Å; Y140-L426 WeakPolarHBondContact O-CD1 3.41Å; L141-L426 HydrophobicContact CB-CD1 4.05Å; L141-L426 HydrophobicContact CB-CD2 3.56Å; L141-L426 HydrophobicContact CB-CG 3.92Å; L141-L426 HydrophobicContact CD2-CD1 4.47Å; L141-L426 HydrophobicContact CD2-CD2 3.12Å; L141-L426 HydrophobicContact CD2-CG 3.5Å; L141-L426 HydrophobicContact CG-CD1 3.77Å; L141-L426 HydrophobicContact CG-CD2 3.32Å; L141-L426 HydrophobicContact CG-CG 3.34Å; L141-L426 WeakPolarHBondContact O-CD2 3.33Å; C144-L426 HydrophobicContact CB-CB 3.71Å; C144-L426 HydrophobicContact CB-CD1 4.07Å; C144-L426 HydrophobicContact CB-CD2 4Å; C144-L426 HydrophobicContact CB-CG 4.18Å; L426-F428 VanDerWaalsContact C-N 3.26Å; L426-F428 HydrophobicContact CB-CD2 4.34Å; L426-F428 HydrophobicContact CB-CE2 4.05Å; L426-F428 HydrophobicContact CD2-CD2 3.93Å; L426-F428 HydrophobicContact CD2-CE1 4.14Å; L426-F428 HydrophobicContact CD2-CE2 3.34Å; L426-F428 HydrophobicContact CD2-CZ 3.44Å; L426-F428 VanDerWaalsContact CD2-CZ 3.44Å; L426-F428 HydrophobicContact CG-CE2 4.42Å; L426-F428 WeakPolarHBondContact O-CD2 3.38Å; L426-F428 PolarHBondContact O-N 3.42Å
427	D	31	Very low	31.7	Very low	85 Å²	85	95.2 Å²	95.2	46%	0.455	52%	0.519	S	S	.	.			trans	-81.4	74.9	-172.2	-146.1	15.5	0	0	0	111.3	R429 T430	D427-R429 PolarHBondContact O-N 3.09Å; D427-R429 WeakPolarHBondContact OD1-CB 3.45Å; D427-T430 PolarHBondContact O-N 3.48Å; D427-T430 VanDerWaalsContact O-N 3.09Å
428	F	31.3	Very low	32.4	Very low	91 Å²	91	93.5 Å²	93.5	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-49.5	-14	161.8	-74.5	-80.5	0	0	0	112	M145 L426 T430	M145-F428 HydrophobicContact CG-CE1 3.86Å; M145-F428 HydrophobicContact CG-CZ 3.48Å; M145-F428 VanDerWaalsContact CG-CZ 3.48Å; M145-F428 HydrophobicContact SD-CE1 4.33Å; L426-F428 VanDerWaalsContact C-N 3.26Å; L426-F428 HydrophobicContact CB-CD2 4.34Å; L426-F428 HydrophobicContact CB-CE2 4.05Å; L426-F428 HydrophobicContact CD2-CD2 3.93Å; L426-F428 HydrophobicContact CD2-CE1 4.14Å; L426-F428 HydrophobicContact CD2-CE2 3.34Å; L426-F428 HydrophobicContact CD2-CZ 3.44Å; L426-F428 VanDerWaalsContact CD2-CZ 3.44Å; L426-F428 HydrophobicContact CG-CE2 4.42Å; L426-F428 WeakPolarHBondContact O-CD2 3.38Å; L426-F428 PolarHBondContact O-N 3.42Å; F428-T430 VanDerWaalsContact C-N 3.3Å; F428-T430 PolarHBondContact O-N 3.23Å
429	R	34.7	Very low	33.3	Very low	49 Å²	49	92.3 Å²	92.3	19%	0.185	49%	0.494	C	S	.	.	H	α-helix	trans	-70.7	-14.7	177.5	-155.2	172	-168.8	175.4	5.5	115.5	Q244 G245 L246 S248 H249 D427	Q244-R429 CarbonylContact O-C 3.4Å; G245-R429 VanDerWaalsContact C-NE 3.34Å; G245-R429 WeakPolarHBondContact O-CD 3.39Å; G245-R429 PolarHBondContact O-NE 3.3Å; G245-R429 PolarHBondContact O-NH1 3.18Å; L246-R429 VanDerWaalsContact CA-CZ 3.43Å; L246-R429 PolarHBondContact O-NE 3.1Å; L246-R429 VanDerWaalsContact O-NE 3.11Å; L246-R429 PolarHBondContact O-NH2 2.94Å; S248-R429 VanDerWaalsContact CB-CG 3.5Å; S248-R429 WeakPolarHBondContact CB-O 3.4Å; S248-R429 WeakPolarHBondContact OG-CA 3.48Å; S248-R429 PolarHBondContact OG-O 3.16Å; H249-R429 VanDerWaalsContact CB-NH2 3.3Å; H249-R429 WeakPolarHBondContact CD2-CD 3.49Å; H249-R429 VanDerWaalsContact CD2-CG 3.43Å; H249-R429 WeakPolarHBondContact CD2-CG 3.46Å; H249-R429 PolarHBondContact CD2-NE 3.36Å; H249-R429 PolarHBondContact CE1-NH1 2.75Å; H249-R429 VanDerWaalsContact ND1-CZ 3.33Å; H249-R429 PolarHBondContact ND1-NH2 2.8Å; H249-R429 VanDerWaalsContact NE2-CD 3.26Å; H249-R429 WeakPolarHBondContact NE2-CD 3.31Å; H249-R429 PolarHBondContact NE2-NE 3.11Å; D427-R429 PolarHBondContact O-N 3.09Å; D427-R429 WeakPolarHBondContact OD1-CB 3.45Å
430	T	35.4	Very low	34.3	Very low	42 Å²	42	91.3 Å²	91.3	26%	0.258	48%	0.484	S	S	.	.	H	α-helix	trans	-94.8	-26.7	-179.3	-40.4	0	0	0	0	112.1	Q244 D427 F428 S434	Q244-T430 HydrophobicContact CB-CG2 3.85Å; Q244-T430 HydrophobicContact CG-CG2 4.44Å; Q244-T430 WeakPolarHBondContact O-CA 3.37Å; D427-T430 PolarHBondContact O-N 3.48Å; D427-T430 VanDerWaalsContact O-N 3.09Å; F428-T430 VanDerWaalsContact C-N 3.3Å; F428-T430 PolarHBondContact O-N 3.23Å; T430-S434 PolarHBondContact O-OG 3.38Å; T430-S434 VanDerWaalsContact O-OG 3.12Å
431	L	37.3	Very low	35.4	Very low	105 Å²	105	86.8 Å²	86.8	55%	0.55	47%	0.469	S	S	.	.	H	α-helix	trans	-80.8	-44.5	-172.6	-173.2	63.2	0	0	0	112.8	E433 S434 I435	L431-E433 VanDerWaalsContact C-N 3.3Å; L431-E433 PolarHBondContact O-N 3.33Å; L431-S434 PolarHBondContact O-N 3.43Å; L431-I435 HydrophobicContact CG-CD1 4.39Å; L431-I435 WeakPolarHBondContact O-CG1 3.39Å; L431-I435 PolarHBondContact O-N 3.09Å
432	A	37	Very low	36.4	Very low	33 Å²	33	83.5 Å²	83.5	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-69.4	-29	-175.7	0	0	0	0	0	112.5	S248 A251 I435 L436	S248-A432 WeakPolarHBondContact OG-CB 3.4Å; S248-A432 PolarHBondContact OG-N 3.46Å; A251-A432 HydrophobicContact CB-CB 3.57Å; A432-I435 PolarHBondContact O-N 3.46Å; A432-L436 WeakPolarHBondContact O-CB 3.28Å; A432-L436 PolarHBondContact O-N 3.08Å
433	E	39.1	Very low	37.9	Very low	19 Å²	19	83 Å²	83	9%	0.089	43%	0.432	C	S	.	.	H	α-helix	trans	-64.5	-45.8	172.4	-81.9	179.7	-119.7	0	0	113.9	C243 Q244 L246 G247 S248 L431 I435 L436 V437	C243-E433 VanDerWaalsContact O-OE1 3.14Å; Q244-E433 VanDerWaalsContact C-CD 3.45Å; Q244-E433 WeakPolarHBondContact CA-OE1 3.44Å; Q244-E433 WeakPolarHBondContact CA-OE2 3.38Å; Q244-E433 PolarHBondContact N-OE2 3.43Å; L246-E433 PolarHBondContact N-OE1 3.11Å; L246-E433 VanDerWaalsContact N-OE1 3.07Å; G247-E433 WeakPolarHBondContact CA-OE1 3.36Å; G247-E433 WeakPolarHBondContact CA-OE2 3.44Å; G247-E433 PolarHBondContact N-OE1 3.33Å; G247-E433 PolarHBondContact N-OE2 3.23Å; G247-E433 WeakPolarHBondContact O-CG 3.49Å; S248-E433 PolarHBondContact N-OE1 3.07Å; S248-E433 VanDerWaalsContact OG-CG 3.3Å; S248-E433 WeakPolarHBondContact OG-CG 3.26Å; S248-E433 PolarHBondContact OG-N 3.3Å; L431-E433 VanDerWaalsContact C-N 3.3Å; L431-E433 PolarHBondContact O-N 3.33Å; E433-I435 PolarHBondContact O-N 3.07Å; E433-L436 PolarHBondContact O-N 3.34Å; E433-V437 WeakPolarHBondContact O-CG2 3.49Å; E433-V437 PolarHBondContact O-N 3.32Å
434	S	37.4	Very low	39.4	Very low	41 Å²	41	79.3 Å²	79.3	29%	0.287	42%	0.417	S	S	.	.	H	α-helix	trans	-60.4	-38.6	179.4	-60.7	0	0	0	0	110.4	Q244 T430 L431 V438	Q244-S434 PolarHBondContact NE2-OG 2.82Å; T430-S434 PolarHBondContact O-OG 3.38Å; T430-S434 VanDerWaalsContact O-OG 3.12Å; L431-S434 PolarHBondContact O-N 3.43Å; S434-V438 WeakPolarHBondContact O-CG2 3.47Å; S434-V438 PolarHBondContact O-N 3.05Å
435	I	40.8	Very low	40.7	Very low	111 Å²	111	77.7 Å²	77.7	57%	0.569	41%	0.41	S	S	*	.	H	α-helix	trans	-69.3	-42.3	176.9	-65.1	169.6	0	0	0	111.3	L431 A432 E433 V437 V438 K439	L431-I435 HydrophobicContact CG-CD1 4.39Å; L431-I435 WeakPolarHBondContact O-CG1 3.39Å; L431-I435 PolarHBondContact O-N 3.09Å; A432-I435 PolarHBondContact O-N 3.46Å; E433-I435 PolarHBondContact O-N 3.07Å; I435-V437 PolarHBondContact O-N 3.43Å; I435-V438 PolarHBondContact O-N 2.72Å; I435-K439 PolarHBondContact O-N 3.33Å
436	L	42	Very low	42.1	Very low	53 Å²	53	75.8 Å²	75.8	28%	0.277	39%	0.392	S	S	.	.	H	α-helix	trans	-63.5	-42.8	179.7	-159.3	84	0	0	0	111.8	A432 E433 V438 K439 I440	A432-L436 WeakPolarHBondContact O-CB 3.28Å; A432-L436 PolarHBondContact O-N 3.08Å; E433-L436 PolarHBondContact O-N 3.34Å; L436-V438 VanDerWaalsContact C-N 3.31Å; L436-V438 PolarHBondContact O-N 2.97Å; L436-K439 PolarHBondContact O-N 3.23Å; L436-I440 HydrophobicContact CD2-CD1 4.28Å; L436-I440 HydrophobicContact CG-CD1 4.18Å; L436-I440 WeakPolarHBondContact O-CG1 3.04Å; L436-I440 PolarHBondContact O-N 2.98Å
437	V	39.5	Very low	43.7	Very low	77 Å²	77	79.4 Å²	79.4	47%	0.467	41%	0.412	S	S	.	.	H	α-helix	trans	-61.5	-40.6	176.6	171.3	0	0	0	0	111.2	E433 I435 N441	E433-V437 WeakPolarHBondContact O-CG2 3.49Å; E433-V437 PolarHBondContact O-N 3.32Å; I435-V437 PolarHBondContact O-N 3.43Å; V437-N441 WeakPolarHBondContact O-CB 3.46Å; V437-N441 PolarHBondContact O-N 2.7Å; V437-N441 VanDerWaalsContact O-N 3.09Å; V437-N441 PolarHBondContact O-ND2 3.44Å; V437-N441 VanDerWaalsContact O-ND2 3.12Å
438	V	40.4	Very low	45.5	Very low	86 Å²	86	82 Å²	82	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-44.8	175.6	172.7	0	0	0	0	110.8	S434 I435 L436 N441 L442	S434-V438 WeakPolarHBondContact O-CG2 3.47Å; S434-V438 PolarHBondContact O-N 3.05Å; I435-V438 PolarHBondContact O-N 2.72Å; L436-V438 VanDerWaalsContact C-N 3.31Å; L436-V438 PolarHBondContact O-N 2.97Å; V438-N441 PolarHBondContact O-N 3.31Å; V438-L442 HydrophobicContact CG1-CD1 4.06Å; V438-L442 WeakPolarHBondContact O-CG 3.34Å; V438-L442 PolarHBondContact O-N 3.43Å
439	K	43.7	Very low	47	Very low	104 Å²	104	82.9 Å²	82.9	45%	0.452	43%	0.428	S	S	.	.	H	α-helix	trans	-59.9	-49.1	177.7	-179.5	178.2	168.2	179.6	0	112	I435 L436 N441 L442 E443	I435-K439 PolarHBondContact O-N 3.33Å; L436-K439 PolarHBondContact O-N 3.23Å; K439-N441 VanDerWaalsContact C-N 3.31Å; K439-N441 PolarHBondContact O-N 2.99Å; K439-L442 WeakPolarHBondContact O-CB 3.33Å; K439-L442 PolarHBondContact O-N 3.47Å; K439-E443 WeakPolarHBondContact CE-OE1 3.42Å; K439-E443 HydrophobicContact CG-CG 4.48Å; K439-E443 IonicContact NZ-OE1 2.73Å; K439-E443 PolarHBondContact O-N 3.41Å
440	I	48	Very low	48.5	Very low	79 Å²	79	85.8 Å²	85.8	41%	0.405	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-43	178.6	-68.6	166.3	0	0	0	110.9	L436 L442 E443 L444	L436-I440 HydrophobicContact CD2-CD1 4.28Å; L436-I440 HydrophobicContact CG-CD1 4.18Å; L436-I440 WeakPolarHBondContact O-CG1 3.04Å; L436-I440 PolarHBondContact O-N 2.98Å; I440-L442 VanDerWaalsContact C-N 3.27Å; I440-L442 PolarHBondContact O-N 3.13Å; I440-E443 PolarHBondContact O-N 3.13Å; I440-L444 HydrophobicContact CG2-CD1 4.02Å; I440-L444 HydrophobicContact CG2-CG 4.42Å; I440-L444 WeakPolarHBondContact O-CB 3.39Å; I440-L444 WeakPolarHBondContact O-CG 3.39Å; I440-L444 PolarHBondContact O-N 2.96Å
441	N	46.8	Very low	50.3	Low	86 Å²	86	87.5 Å²	87.5	46%	0.46	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-33	176.8	-80.2	-36	0	0	0	112.7	V437 V438 K439 K445	V437-N441 WeakPolarHBondContact O-CB 3.46Å; V437-N441 PolarHBondContact O-N 2.7Å; V437-N441 VanDerWaalsContact O-N 3.09Å; V437-N441 PolarHBondContact O-ND2 3.44Å; V437-N441 VanDerWaalsContact O-ND2 3.12Å; V438-N441 PolarHBondContact O-N 3.31Å; K439-N441 VanDerWaalsContact C-N 3.31Å; K439-N441 PolarHBondContact O-N 2.99Å; N441-K445 VanDerWaalsContact O-CG 3.31Å; N441-K445 WeakPolarHBondContact O-CG 3.4Å; N441-K445 PolarHBondContact O-N 3.42Å
442	L	47.5	Very low	52	Low	96 Å²	96	87.4 Å²	87.4	50%	0.503	45%	0.454	S	S	.	.	H	α-helix	trans	-72.4	-45.2	174.5	-71.5	170.7	0	0	0	111.5	V438 K439 I440 L444 K445 I446	V438-L442 HydrophobicContact CG1-CD1 4.06Å; V438-L442 WeakPolarHBondContact O-CG 3.34Å; V438-L442 PolarHBondContact O-N 3.43Å; K439-L442 WeakPolarHBondContact O-CB 3.33Å; K439-L442 PolarHBondContact O-N 3.47Å; I440-L442 VanDerWaalsContact C-N 3.27Å; I440-L442 PolarHBondContact O-N 3.13Å; L442-L444 PolarHBondContact O-N 3.1Å; L442-K445 WeakPolarHBondContact O-CB 3.26Å; L442-K445 PolarHBondContact O-N 3.44Å; L442-K445 VanDerWaalsContact O-N 3.12Å; L442-I446 WeakPolarHBondContact O-CG1 3.47Å; L442-I446 PolarHBondContact O-N 2.88Å
443	E	53.2	Low	53.8	Low	84 Å²	84	91 Å²	91	39%	0.393	47%	0.468	S	S	.	.	H	α-helix	trans	-60.2	-43.3	176.5	-73	173.8	166.4	0	0	111.8	K439 I440 K445 I446 N447	K439-E443 WeakPolarHBondContact CE-OE1 3.42Å; K439-E443 HydrophobicContact CG-CG 4.48Å; K439-E443 IonicContact NZ-OE1 2.73Å; K439-E443 PolarHBondContact O-N 3.41Å; I440-E443 PolarHBondContact O-N 3.13Å; E443-K445 VanDerWaalsContact C-N 3.3Å; E443-K445 PolarHBondContact O-N 2.93Å; E443-I446 PolarHBondContact O-N 3.41Å; E443-N447 PolarHBondContact O-N 2.95Å
444	L	56.6	Low	55.4	Low	107 Å²	107	93.9 Å²	93.9	56%	0.56	48%	0.484	S	S	*	.	H	α-helix	trans	-62	-37.3	174.3	-73.8	172.6	0	0	0	112.5	I440 L442 K448	I440-L444 HydrophobicContact CG2-CD1 4.02Å; I440-L444 HydrophobicContact CG2-CG 4.42Å; I440-L444 WeakPolarHBondContact O-CB 3.39Å; I440-L444 WeakPolarHBondContact O-CG 3.39Å; I440-L444 PolarHBondContact O-N 2.96Å; L442-L444 PolarHBondContact O-N 3.1Å; L444-K448 WeakPolarHBondContact O-CB 3.41Å; L444-K448 PolarHBondContact O-N 3.33Å; L444-K448 VanDerWaalsContact O-N 3.11Å
445	K	55	Low	57.5	Low	139 Å²	139	96.7 Å²	96.7	60%	0.604	50%	0.495	S	S	*	.	H	α-helix	trans	-67.8	-41.6	174.4	-79	176.9	-179.9	-178.7	0	111.6	N441 L442 E443 K448 L449	N441-K445 VanDerWaalsContact O-CG 3.31Å; N441-K445 WeakPolarHBondContact O-CG 3.4Å; N441-K445 PolarHBondContact O-N 3.42Å; L442-K445 WeakPolarHBondContact O-CB 3.26Å; L442-K445 PolarHBondContact O-N 3.44Å; L442-K445 VanDerWaalsContact O-N 3.12Å; E443-K445 VanDerWaalsContact C-N 3.3Å; E443-K445 PolarHBondContact O-N 2.93Å; K445-K448 PolarHBondContact O-N 3.24Å; K445-L449 WeakPolarHBondContact O-CG 3.46Å; K445-L449 PolarHBondContact O-N 3.04Å
446	I	57.4	Low	59.1	Low	87 Å²	87	95.9 Å²	95.9	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-51.6	176.8	-70.2	167.5	0	0	0	110	L442 E443 K448 L449 E450	L442-I446 WeakPolarHBondContact O-CG1 3.47Å; L442-I446 PolarHBondContact O-N 2.88Å; E443-I446 PolarHBondContact O-N 3.41Å; I446-K448 VanDerWaalsContact C-N 3.26Å; I446-K448 PolarHBondContact O-N 2.79Å; I446-L449 WeakPolarHBondContact O-CA 3.42Å; I446-L449 WeakPolarHBondContact O-CB 3.45Å; I446-L449 PolarHBondContact O-N 3.07Å; I446-E450 HydrophobicContact CG2-CG 4.32Å; I446-E450 PolarHBondContact O-N 3.39Å
447	N	62.6	Low	60.7	Low	94 Å²	94	100 Å²	100	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-59.2	-37.7	179.1	-69	-10	0	0	0	112.3	E443 S451	E443-N447 PolarHBondContact O-N 2.95Å; N447-S451 WeakPolarHBondContact O-CB 3.5Å; N447-S451 PolarHBondContact O-N 3.22Å
448	K	70.4	Confident	62.7	Low	139 Å²	139	101 Å²	101	60%	0.604	50%	0.503	S	S	*	.	H	α-helix	trans	-65.1	-41.6	174.9	-173.8	177.4	-179.6	179.1	0	111.8	L444 K445 I446 Q452	L444-K448 WeakPolarHBondContact O-CB 3.41Å; L444-K448 PolarHBondContact O-N 3.33Å; L444-K448 VanDerWaalsContact O-N 3.11Å; K445-K448 PolarHBondContact O-N 3.24Å; I446-K448 VanDerWaalsContact C-N 3.26Å; I446-K448 PolarHBondContact O-N 2.79Å; K448-Q452 WeakPolarHBondContact O-CG 3.47Å; K448-Q452 PolarHBondContact O-N 2.88Å; K448-Q452 VanDerWaalsContact O-N 3.1Å
449	L	62.5	Low	64.7	Low	110 Å²	110	101.8 Å²	101.8	58%	0.576	50%	0.5	S	S	*	.	H	α-helix	trans	-67.2	-43.2	177	-72.3	169.6	0	0	0	111.6	K445 I446 S451 Q452 L453	K445-L449 WeakPolarHBondContact O-CG 3.46Å; K445-L449 PolarHBondContact O-N 3.04Å; I446-L449 WeakPolarHBondContact O-CA 3.42Å; I446-L449 WeakPolarHBondContact O-CB 3.45Å; I446-L449 PolarHBondContact O-N 3.07Å; L449-S451 PolarHBondContact O-N 3.34Å; L449-Q452 PolarHBondContact O-N 3.16Å; L449-L453 WeakPolarHBondContact O-CB 3.43Å; L449-L453 PolarHBondContact O-N 3.14Å
450	E	66.1	Low	66.3	Low	110 Å²	110	101.9 Å²	101.9	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-60.9	-42.7	175.5	-72.7	-178.9	167.5	0	0	112	I446 Q452 L453 N454	I446-E450 HydrophobicContact CG2-CG 4.32Å; I446-E450 PolarHBondContact O-N 3.39Å; E450-Q452 PolarHBondContact O-N 3.38Å; E450-L453 PolarHBondContact O-N 3.18Å; E450-N454 PolarHBondContact O-N 3.09Å; E450-N454 PolarHBondContact O-ND2 3.3Å
451	S	73.5	Confident	67.8	Low	78 Å²	78	104 Å²	104	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-41.5	175.3	177	0	0	0	0	112.4	N447 L449 L455	N447-S451 WeakPolarHBondContact O-CB 3.5Å; N447-S451 PolarHBondContact O-N 3.22Å; L449-S451 PolarHBondContact O-N 3.34Å; S451-L455 PolarHBondContact O-N 3.18Å; S451-L455 VanDerWaalsContact O-N 3.1Å
452	Q	72.8	Confident	69.6	Low	102 Å²	102	103.7 Å²	103.7	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-41.8	175.2	-74.5	178.9	-22.9	0	0	111.9	K448 L449 E450 L455 E456	K448-Q452 WeakPolarHBondContact O-CG 3.47Å; K448-Q452 PolarHBondContact O-N 2.88Å; K448-Q452 VanDerWaalsContact O-N 3.1Å; L449-Q452 PolarHBondContact O-N 3.16Å; E450-Q452 PolarHBondContact O-N 3.38Å; Q452-L455 PolarHBondContact O-N 3.04Å; Q452-E456 PolarHBondContact O-N 3.03Å
453	L	73.9	Confident	71	Confident	110 Å²	110	103.9 Å²	103.9	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-63.7	-41.6	178.6	-167.1	118.1	0	0	0	111.8	L449 E450 E456 R457	L449-L453 WeakPolarHBondContact O-CB 3.43Å; L449-L453 PolarHBondContact O-N 3.14Å; E450-L453 PolarHBondContact O-N 3.18Å; L453-E456 PolarHBondContact O-N 3.43Å; L453-R457 WeakPolarHBondContact O-CB 3.5Å; L453-R457 PolarHBondContact O-N 3.48Å
454	N	73.5	Confident	72	Confident	79 Å²	79	103.7 Å²	103.7	42%	0.422	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-42.1	174.9	-73	-24.3	0	0	0	111.9	E450 E456 R457 D458	E450-N454 PolarHBondContact O-N 3.09Å; E450-N454 PolarHBondContact O-ND2 3.3Å; N454-E456 PolarHBondContact O-N 2.99Å; N454-R457 WeakPolarHBondContact O-CB 3.49Å; N454-R457 PolarHBondContact O-N 3.3Å; N454-D458 PolarHBondContact O-N 2.82Å
455	L	80.5	Confident	73.1	Confident	99 Å²	99	100.5 Å²	100.5	52%	0.518	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-41.4	177.3	-172.1	72.8	0	0	0	112.3	S451 Q452 D458 K459	S451-L455 PolarHBondContact O-N 3.18Å; S451-L455 VanDerWaalsContact O-N 3.1Å; Q452-L455 PolarHBondContact O-N 3.04Å; L455-D458 PolarHBondContact O-N 2.86Å; L455-K459 WeakPolarHBondContact O-CG 3.44Å; L455-K459 PolarHBondContact O-N 3.29Å; L455-K459 VanDerWaalsContact O-N 3.13Å
456	E	74.7	Confident	74.3	Confident	94 Å²	94	98.7 Å²	98.7	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-38.5	175.5	-71	-56	135.2	0	0	111.9	Q452 L453 N454 D458 K459 I460	Q452-E456 PolarHBondContact O-N 3.03Å; L453-E456 PolarHBondContact O-N 3.43Å; N454-E456 PolarHBondContact O-N 2.99Å; E456-D458 VanDerWaalsContact C-N 3.32Å; E456-D458 PolarHBondContact O-N 3.24Å; E456-K459 PolarHBondContact O-N 3.02Å; E456-K459 IonicContact OE1-NZ 2.71Å; E456-K459 PolarHBondContact OE1-NZ 3.29Å; E456-I460 WeakPolarHBondContact O-CG1 3.45Å; E456-I460 PolarHBondContact O-N 3.09Å
457	R	76.8	Confident	75.1	Confident	141 Å²	141	99.6 Å²	99.6	53%	0.532	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-43.9	173.1	-173.2	-169.2	-82.9	178.8	-5.4	111.4	L453 N454 I460 H461	L453-R457 WeakPolarHBondContact O-CB 3.5Å; L453-R457 PolarHBondContact O-N 3.48Å; N454-R457 WeakPolarHBondContact O-CB 3.49Å; N454-R457 PolarHBondContact O-N 3.3Å; R457-I460 PolarHBondContact O-N 2.94Å; R457-H461 PolarHBondContact O-CD2 3.33Å; R457-H461 PolarHBondContact O-N 3.27Å
458	D	81.2	Confident	75.8	Confident	96 Å²	96	101.8 Å²	101.8	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-39.1	179.2	-72.2	-16.3	0	0	0	112.6	N454 L455 E456 H461 T462	N454-D458 PolarHBondContact O-N 2.82Å; L455-D458 PolarHBondContact O-N 2.86Å; E456-D458 VanDerWaalsContact C-N 3.32Å; E456-D458 PolarHBondContact O-N 3.24Å; D458-H461 PolarHBondContact O-N 2.94Å; D458-T462 WeakPolarHBondContact O-CB 3.32Å; D458-T462 PolarHBondContact O-N 2.92Å; D458-T462 PolarHBondContact O-OG1 3.06Å
459	K	81.8	Confident	76.2	Confident	103 Å²	103	100 Å²	100	45%	0.448	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-46.2	173.2	-73.1	174.8	-170.7	167.5	0	111.2	L455 E456 T462 E463	L455-K459 WeakPolarHBondContact O-CG 3.44Å; L455-K459 PolarHBondContact O-N 3.29Å; L455-K459 VanDerWaalsContact O-N 3.13Å; E456-K459 PolarHBondContact O-N 3.02Å; E456-K459 IonicContact OE1-NZ 2.71Å; E456-K459 PolarHBondContact OE1-NZ 3.29Å; K459-T462 PolarHBondContact O-N 3.22Å; K459-E463 PolarHBondContact O-N 3.39Å
460	I	77.5	Confident	76.9	Confident	107 Å²	107	98.2 Å²	98.2	55%	0.549	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-46.6	177.6	-67.8	168.6	0	0	0	110.2	E456 R457 T462 E463 V464	E456-I460 WeakPolarHBondContact O-CG1 3.45Å; E456-I460 PolarHBondContact O-N 3.09Å; R457-I460 PolarHBondContact O-N 2.94Å; I460-T462 VanDerWaalsContact C-N 3.28Å; I460-T462 PolarHBondContact O-N 3.48Å; I460-E463 PolarHBondContact O-N 3.47Å; I460-V464 HydrophobicContact CG2-CG2 4.17Å; I460-V464 WeakPolarHBondContact O-CB 3.49Å; I460-V464 VanDerWaalsContact O-CG2 3.26Å; I460-V464 WeakPolarHBondContact O-CG2 3.32Å; I460-V464 PolarHBondContact O-N 3.31Å
461	H	80.3	Confident	77.1	Confident	122 Å²	122	96.4 Å²	96.4	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-58.4	-39.9	176.4	-88.7	-56.1	0	0	0	112.7	R457 D458 G465	R457-H461 PolarHBondContact O-CD2 3.33Å; R457-H461 PolarHBondContact O-N 3.27Å; D458-H461 PolarHBondContact O-N 2.94Å; H461-G465 PolarHBondContact O-N 2.73Å
462	T	83.5	Confident	77.2	Confident	80 Å²	80	96.4 Å²	96.4	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-45.4	177.2	-57.6	0	0	0	0	111.7	D458 K459 I460 G465 K466	D458-T462 WeakPolarHBondContact O-CB 3.32Å; D458-T462 PolarHBondContact O-N 2.92Å; D458-T462 PolarHBondContact O-OG1 3.06Å; K459-T462 PolarHBondContact O-N 3.22Å; I460-T462 VanDerWaalsContact C-N 3.28Å; I460-T462 PolarHBondContact O-N 3.48Å; T462-G465 PolarHBondContact O-N 3.04Å; T462-K466 PolarHBondContact O-N 3.25Å; T462-K466 VanDerWaalsContact O-N 3.09Å
463	E	77.5	Confident	77.3	Confident	100 Å²	100	97.4 Å²	97.4	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-67.8	-39.4	177.8	-70.3	-58.5	129.3	0	0	112.2	K459 I460 G465 K466 L467	K459-E463 PolarHBondContact O-N 3.39Å; I460-E463 PolarHBondContact O-N 3.47Å; E463-G465 VanDerWaalsContact C-N 3.3Å; E463-G465 PolarHBondContact O-N 3.25Å; E463-K466 PolarHBondContact O-N 3.11Å; E463-K466 IonicContact OE1-NZ 3.1Å; E463-K466 PolarHBondContact OE1-NZ 3.35Å; E463-L467 WeakPolarHBondContact O-CG 3.32Å; E463-L467 PolarHBondContact O-N 3.47Å
464	V	74.3	Confident	77.1	Confident	81 Å²	81	99.3 Å²	99.3	49%	0.491	49%	0.492	S	S	.	.	H	α-helix	trans	-60.3	-40.8	172.1	171.1	0	0	0	0	110.9	I460 L467 K468	I460-V464 HydrophobicContact CG2-CG2 4.17Å; I460-V464 WeakPolarHBondContact O-CB 3.49Å; I460-V464 VanDerWaalsContact O-CG2 3.26Å; I460-V464 WeakPolarHBondContact O-CG2 3.32Å; I460-V464 PolarHBondContact O-N 3.31Å; V464-L467 PolarHBondContact O-N 3.01Å; V464-K468 WeakPolarHBondContact O-CB 3.23Å; V464-K468 PolarHBondContact O-N 3.49Å
465	G	79.5	Confident	76.9	Confident	40 Å²	40	102.6 Å²	102.6	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-46.2	175	0	0	0	0	0	113.1	H461 T462 E463 L467 K468 E469	H461-G465 PolarHBondContact O-N 2.73Å; T462-G465 PolarHBondContact O-N 3.04Å; E463-G465 VanDerWaalsContact C-N 3.3Å; E463-G465 PolarHBondContact O-N 3.25Å; G465-L467 PolarHBondContact O-N 3.34Å; G465-K468 WeakPolarHBondContact O-CB 3.45Å; G465-K468 PolarHBondContact O-N 3.17Å; G465-E469 PolarHBondContact O-N 3.04Å
466	K	80.6	Confident	76.2	Confident	100 Å²	100	102.4 Å²	102.4	44%	0.435	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-42.4	175.8	-68.2	173.4	-171.3	165.5	0	112.1	T462 E463 K468 E469 I470	T462-K466 PolarHBondContact O-N 3.25Å; T462-K466 VanDerWaalsContact O-N 3.09Å; E463-K466 PolarHBondContact O-N 3.11Å; E463-K466 IonicContact OE1-NZ 3.1Å; E463-K466 PolarHBondContact OE1-NZ 3.35Å; K466-K468 VanDerWaalsContact C-N 3.32Å; K466-K468 PolarHBondContact O-N 3.38Å; K466-E469 PolarHBondContact O-N 2.73Å; K466-I470 VanDerWaalsContact O-CG1 3.32Å; K466-I470 WeakPolarHBondContact O-CG1 3.21Å; K466-I470 PolarHBondContact O-N 3.49Å
467	L	73.4	Confident	75.4	Confident	107 Å²	107	107.1 Å²	107.1	56%	0.56	52%	0.519	S	S	*	.	H	α-helix	trans	-62.8	-39.8	176.5	-76.3	170.6	0	0	0	111.5	E463 V464 G465 I470 C471	E463-L467 WeakPolarHBondContact O-CG 3.32Å; E463-L467 PolarHBondContact O-N 3.47Å; V464-L467 PolarHBondContact O-N 3.01Å; G465-L467 PolarHBondContact O-N 3.34Å; L467-I470 PolarHBondContact O-N 3.44Å; L467-C471 PolarHBondContact O-N 2.99Å; L467-C471 PolarHBondContact O-SG 2.99Å
468	K	78	Confident	74.1	Confident	140 Å²	140	103.4 Å²	103.4	61%	0.609	52%	0.524	S	S	*	.	H	α-helix	trans	-61.6	-46	174.9	-167	175.3	-179.7	-178.7	0	111.7	V464 G465 K466 I470 C471 D472	V464-K468 WeakPolarHBondContact O-CB 3.23Å; V464-K468 PolarHBondContact O-N 3.49Å; G465-K468 WeakPolarHBondContact O-CB 3.45Å; G465-K468 PolarHBondContact O-N 3.17Å; K466-K468 VanDerWaalsContact C-N 3.32Å; K466-K468 PolarHBondContact O-N 3.38Å; K468-I470 VanDerWaalsContact C-N 3.31Å; K468-I470 PolarHBondContact O-N 3.38Å; K468-C471 WeakPolarHBondContact O-CB 3.34Å; K468-C471 PolarHBondContact O-N 3.42Å; K468-C471 VanDerWaalsContact O-N 3.17Å; K468-D472 VanDerWaalsContact O-CG 3.32Å; K468-D472 PolarHBondContact O-N 2.92Å
469	E	78.1	Confident	72.4	Confident	102 Å²	102	106 Å²	106	48%	0.477	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-37.4	176.2	-165.3	-160.4	150.8	0	0	112.4	G465 K466 R473	G465-E469 PolarHBondContact O-N 3.04Å; K466-E469 PolarHBondContact O-N 2.73Å; E469-R473 VanDerWaalsContact CD-NH2 3.3Å; E469-R473 WeakPolarHBondContact O-CG 3.39Å; E469-R473 PolarHBondContact O-N 3.26Å; E469-R473 PolarHBondContact O-NE 3.5Å; E469-R473 IonicContact OE1-CZ 3.61Å; E469-R473 IonicContact OE1-NH1 3.51Å; E469-R473 PolarHBondContact OE1-NH1 3.18Å; E469-R473 IonicContact OE1-NH2 3.58Å; E469-R473 PolarHBondContact OE1-NH2 3.13Å; E469-R473 VanDerWaalsContact OE1-NH2 3.11Å; E469-R473 IonicContact OE2-NH2 3.46Å
470	I	76.8	Confident	70.4	Confident	72 Å²	72	109.2 Å²	109.2	37%	0.369	57%	0.567	S	S	.	*	H	α-helix	trans	-64.8	-47.4	173.8	-68.4	167	0	0	0	110.4	K466 L467 K468 D472 R473 F474	K466-I470 VanDerWaalsContact O-CG1 3.32Å; K466-I470 WeakPolarHBondContact O-CG1 3.21Å; K466-I470 PolarHBondContact O-N 3.49Å; L467-I470 PolarHBondContact O-N 3.44Å; K468-I470 VanDerWaalsContact C-N 3.31Å; K468-I470 PolarHBondContact O-N 3.38Å; I470-D472 VanDerWaalsContact C-N 3.34Å; I470-D472 PolarHBondContact O-N 3.3Å; I470-R473 PolarHBondContact O-N 3.04Å; I470-F474 HydrophobicContact CG2-CD2 3.74Å; I470-F474 HydrophobicContact CG2-CE2 3.54Å; I470-F474 VanDerWaalsContact O-CD2 3.23Å; I470-F474 WeakPolarHBondContact O-CD2 3.4Å; I470-F474 PolarHBondContact O-N 2.88Å
471	C	70.7	Confident	70	Confident	72 Å²	72	109.4 Å²	109.4	49%	0.486	57%	0.568	S	S	.	*	H	α-helix	trans	-58.8	-42.9	176.4	-77.9	0	0	0	0	112.5	L467 K468 R473 F474 K475	L467-C471 PolarHBondContact O-N 2.99Å; L467-C471 PolarHBondContact O-SG 2.99Å; K468-C471 WeakPolarHBondContact O-CB 3.34Å; K468-C471 PolarHBondContact O-N 3.42Å; K468-C471 VanDerWaalsContact O-N 3.17Å; C471-R473 VanDerWaalsContact C-N 3.35Å; C471-R473 PolarHBondContact O-N 3.49Å; C471-F474 PolarHBondContact O-N 3.37Å; C471-K475 PolarHBondContact O-N 3.5Å
472	D	75.7	Confident	69.5	Low	77 Å²	77	108.7 Å²	108.7	41%	0.412	57%	0.568	S	S	.	*	H	α-helix	trans	-67	-35.7	179	-67.5	-22.3	0	0	0	111.7	K468 I470 F474 K475 T476	K468-D472 VanDerWaalsContact O-CG 3.32Å; K468-D472 PolarHBondContact O-N 2.92Å; I470-D472 VanDerWaalsContact C-N 3.34Å; I470-D472 PolarHBondContact O-N 3.3Å; D472-F474 VanDerWaalsContact C-N 3.34Å; D472-F474 PolarHBondContact O-N 2.75Å; D472-K475 PolarHBondContact O-N 3.06Å; D472-T476 PolarHBondContact O-N 3.05Å; D472-T476 PolarHBondContact O-OG1 3.22Å
473	R	74.4	Confident	68.7	Low	124 Å²	124	110.3 Å²	110.3	47%	0.468	57%	0.572	S	S	.	*	H	α-helix	trans	-65.7	-33	171.3	-78.4	-172.9	-73.8	-134.5	-8.4	113.5	E469 I470 C471 T476 R477	E469-R473 VanDerWaalsContact CD-NH2 3.3Å; E469-R473 WeakPolarHBondContact O-CG 3.39Å; E469-R473 PolarHBondContact O-N 3.26Å; E469-R473 PolarHBondContact O-NE 3.5Å; E469-R473 IonicContact OE1-CZ 3.61Å; E469-R473 IonicContact OE1-NH1 3.51Å; E469-R473 PolarHBondContact OE1-NH1 3.18Å; E469-R473 IonicContact OE1-NH2 3.58Å; E469-R473 PolarHBondContact OE1-NH2 3.13Å; E469-R473 VanDerWaalsContact OE1-NH2 3.11Å; E469-R473 IonicContact OE2-NH2 3.46Å; I470-R473 PolarHBondContact O-N 3.04Å; C471-R473 VanDerWaalsContact C-N 3.35Å; C471-R473 PolarHBondContact O-N 3.49Å; R473-T476 WeakPolarHBondContact CA-OG1 3.49Å; R473-T476 PolarHBondContact O-OG1 2.84Å; R473-T476 VanDerWaalsContact O-OG1 3.13Å; R473-R477 PolarHBondContact O-N 3.11Å
474	F	70.4	Confident	68.2	Low	150 Å²	150	110.9 Å²	110.9	66%	0.658	58%	0.578	S	S	*	*	H	α-helix	trans	-72.7	-40.7	174.8	-84.2	-69.2	0	0	0	111.9	I470 C471 D472 R477 G478	I470-F474 HydrophobicContact CG2-CD2 3.74Å; I470-F474 HydrophobicContact CG2-CE2 3.54Å; I470-F474 VanDerWaalsContact O-CD2 3.23Å; I470-F474 WeakPolarHBondContact O-CD2 3.4Å; I470-F474 PolarHBondContact O-N 2.88Å; C471-F474 PolarHBondContact O-N 3.37Å; D472-F474 VanDerWaalsContact C-N 3.34Å; D472-F474 PolarHBondContact O-N 2.75Å; F474-R477 PolarHBondContact O-N 3.38Å; F474-G478 PolarHBondContact O-N 2.92Å
475	K	69.3	Low	67.8	Low	147 Å²	147	112.8 Å²	112.8	64%	0.639	58%	0.584	S	S	*	*	H	α-helix	trans	-60.4	-46.7	175.1	-73.5	-179.5	178.9	178.7	0	111.9	C471 D472 R477 G478	C471-K475 PolarHBondContact O-N 3.5Å; D472-K475 PolarHBondContact O-N 3.06Å; K475-R477 VanDerWaalsContact C-N 3.28Å; K475-R477 PolarHBondContact O-N 3.3Å; K475-G478 PolarHBondContact O-N 3.06Å
476	T	66.3	Low	67	Low	95 Å²	95	117.6 Å²	117.6	58%	0.583	60%	0.595	S	S	*	*	H	α-helix	trans	-66.7	-23.7	-179.8	46.1	0	0	0	0	114.3	D472 R473	D472-T476 PolarHBondContact O-N 3.05Å; D472-T476 PolarHBondContact O-OG1 3.22Å; R473-T476 WeakPolarHBondContact CA-OG1 3.49Å; R473-T476 PolarHBondContact O-OG1 2.84Å; R473-T476 VanDerWaalsContact O-OG1 3.13Å
477	R	57.3	Low	66.1	Low	193 Å²	193	118.9 Å²	118.9	73%	0.728	61%	0.607	S	S	*	*	H	α-helix	trans	-83.7	-16.8	171.3	-79.2	-174.8	179.1	-170.9	-0.9	114.2	R473 F474 K475 D479 T480	R473-R477 PolarHBondContact O-N 3.11Å; F474-R477 PolarHBondContact O-N 3.38Å; K475-R477 VanDerWaalsContact C-N 3.28Å; K475-R477 PolarHBondContact O-N 3.3Å; R477-D479 VanDerWaalsContact C-N 3.31Å; R477-T480 PolarHBondContact O-OG1 3.35Å
478	G	49.9	Very low	65.5	Low	63 Å²	63	119.8 Å²	119.8	65%	0.649	61%	0.61	S	S	*	*	H	α-helix	trans	-77.6	-18.1	174.9	0	0	0	0	0	113.4	F474 K475	F474-G478 PolarHBondContact O-N 2.92Å; K475-G478 PolarHBondContact O-N 3.06Å
479	D	45.8	Very low	64.5	Low	151 Å²	151	118.1 Å²	118.1	81%	0.807	61%	0.611	S	S	*	*			trans	-96.8	5.6	-179.4	-70.5	-27.9	0	0	0	113.9	R477	R477-D479 VanDerWaalsContact C-N 3.31Å
480	T	39	Very low	63.2	Low	171 Å²	171	119.5 Å²	119.5	100%	1.049	62%	0.623	S	S	*	*			trans	-118.2	0	169.8	53.8	0	0	0	0	110.2	R477	R477-T480 PolarHBondContact O-OG1 3.35Å

Retrieved 480 of 480 residues in 478.1 ms (Link to these results)

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