A0A3Q0KBC8_SCHMA Loading...

Coiled-coil domain-containing protein 63

AlphaFold DB , UniProt , Accession A0A3Q0KBC8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 566 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	29	Very low	36.5	Very low	234 Å²	234	150.3 Å²	150.3	100%	1.153	81%	0.813	S	S	*	*				0	146.5	0	-85.7	-60.4	-177.4	0	0	108
2	P	39.2	Very low	37.1	Very low	94 Å²	94	151.5 Å²	151.5	61%	0.61	81%	0.81	S	S	*	*				-133.6	178.4	-105.3	38	-21.2	0	0	0	114.1
3	R	34.5	Very low	37.9	Very low	231 Å²	231	151.2 Å²	151.2	87%	0.872	81%	0.808	S	S	*	*			trans	77.7	159.8	131	-96.9	179.7	-171.1	-146.6	2.6	119.4
4	P	44.2	Very low	38.7	Very low	102 Å²	102	149.6 Å²	149.6	66%	0.662	80%	0.799	S	S	*	*				-134.6	-145.4	-107.2	40.3	-17.8	0	0	0	110.3
5	T	39	Very low	39.7	Very low	134 Å²	134	144.5 Å²	144.5	82%	0.822	78%	0.776	S	S	*	*			trans	87.2	131.4	169.9	65.9	0	0	0	0	113.9
6	S	36.1	Very low	40.8	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	76%	0.762	S	S	*	*			cis	-160.9	124.6	13.8	-165.4	0	0	0	0	106.9
7	A	34.5	Very low	41.6	Very low	76 Å²	76	141.1 Å²	141.1	63%	0.628	76%	0.757	S	S	*	*				65.9	118.5	102	0	0	0	0	0	117.2
8	Q	35.1	Very low	42.4	Very low	185 Å²	185	139.8 Å²	139.8	86%	0.864	75%	0.749	S	S	*	*			trans	85.9	86.4	145	-65.9	161.5	-48.7	0	0	120.3
9	S	38.1	Very low	43.4	Very low	125 Å²	125	137.9 Å²	137.9	87%	0.874	74%	0.738	S	S	*	*				160.4	99	115.2	50.9	0	0	0	0	111.6
10	E	33.1	Very low	44.6	Very low	184 Å²	184	136.3 Å²	136.3	86%	0.86	73%	0.728	S	S	*	*			trans	-83.3	144.2	147	-68.4	176.6	155.8	0	0	106.6
11	Q	38.6	Very low	45.7	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	73%	0.726	S	S	*	*	S	Bend	trans	129.3	26.4	151.3	-63.5	-174.8	-27.8	0	0	120.7
12	E	43.6	Very low	47.6	Very low	165 Å²	165	132 Å²	132	77%	0.771	70%	0.701	S	S	*	*	S	Bend	trans	-132.7	-9.3	162.3	-89.1	-173.8	174.7	0	0	119.2	T15	E12-T15 PolarHBondContact O-OG1 3.46Å
13	D	48	Very low	49.4	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	70%	0.703	S	S	*	*	S	Bend	trans	-93.6	-12.7	174.7	-71	-8.1	0	0	0	114.1	T15	D13-T15 VanDerWaalsContact C-N 3.27Å; D13-T15 PolarHBondContact O-N 3.09Å
14	N	48.9	Very low	51.2	Low	128 Å²	128	131 Å²	131	68%	0.684	69%	0.692	S	S	*	*	S	Bend	trans	-85.2	1.4	178.4	-146.7	11.4	0	0	0	113
15	T	54.2	Low	52.7	Low	74 Å²	74	135.4 Å²	135.4	45%	0.454	70%	0.696	S	S	.	*	H	α-helix	trans	-86.9	-25.4	171.7	43.2	0	0	0	0	112.5	E12 D13 L17 L19	E12-T15 PolarHBondContact O-OG1 3.46Å; D13-T15 VanDerWaalsContact C-N 3.27Å; D13-T15 PolarHBondContact O-N 3.09Å; T15-L17 PolarHBondContact O-N 3.38Å; T15-L19 PolarHBondContact O-N 3.34Å; T15-L19 VanDerWaalsContact O-N 3.11Å
16	D	55.9	Low	54.3	Low	103 Å²	103	134 Å²	134	55%	0.551	68%	0.682	S	S	*	*	H	α-helix	trans	-69.4	-33	-178.9	-83.4	0.9	0	0	0	112.7	L19	D16-L19 WeakPolarHBondContact O-CB 3.45Å; D16-L19 PolarHBondContact O-N 3.07Å
17	L	54.5	Low	56.4	Low	128 Å²	128	133.9 Å²	133.9	67%	0.67	67%	0.67	S	S	*	*	H	α-helix	trans	-79.8	-33.5	179.3	-147.9	75.2	0	0	0	112.5	T15 L19 I20	T15-L17 PolarHBondContact O-N 3.38Å; L17-L19 PolarHBondContact O-N 3.47Å; L17-I20 HydrophobicContact CD1-CD1 4.45Å; L17-I20 PolarHBondContact O-N 3.03Å
18	L	56.3	Low	58.3	Low	117 Å²	117	134.1 Å²	134.1	61%	0.613	66%	0.661	S	S	*	*	H	α-helix	trans	-60.6	-30.6	166.7	-92	158.2	0	0	0	111.5	E22	L18-E22 WeakPolarHBondContact O-CB 3.4Å; L18-E22 PolarHBondContact O-N 3.35Å; L18-E22 VanDerWaalsContact O-N 3.14Å
19	L	62.8	Low	60.4	Low	104 Å²	104	130.7 Å²	130.7	55%	0.545	64%	0.644	S	S	.	*	H	α-helix	trans	-66.6	-37.5	178.3	-145.1	81.9	0	0	0	113.1	T15 D16 L17 E22 Y23	T15-L19 PolarHBondContact O-N 3.34Å; T15-L19 VanDerWaalsContact O-N 3.11Å; D16-L19 WeakPolarHBondContact O-CB 3.45Å; D16-L19 PolarHBondContact O-N 3.07Å; L17-L19 PolarHBondContact O-N 3.47Å; L19-E22 WeakPolarHBondContact O-CB 3.49Å; L19-E22 PolarHBondContact O-N 3.45Å; L19-Y23 PolarHBondContact O-N 3.22Å
20	I	67.2	Low	62.2	Low	105 Å²	105	129.4 Å²	129.4	54%	0.538	63%	0.627	S	S	.	*	H	α-helix	trans	-73.8	-41.8	-176.8	-64.6	171.6	0	0	0	111.1	L17 E22 Y23 E24	L17-I20 HydrophobicContact CD1-CD1 4.45Å; L17-I20 PolarHBondContact O-N 3.03Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.25Å; I20-Y23 WeakPolarHBondContact O-CB 3.47Å; I20-Y23 PolarHBondContact O-N 3.46Å; I20-Y23 VanDerWaalsContact O-N 3.09Å; I20-E24 PolarHBondContact O-N 2.87Å
21	E	66.7	Low	64.4	Low	147 Å²	147	127.7 Å²	127.7	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-66.2	-33.3	174.4	-158.3	177	-164.9	0	0	110.9	R25	E21-R25 VanDerWaalsContact O-CB 3.31Å; E21-R25 WeakPolarHBondContact O-CB 3.14Å; E21-R25 PolarHBondContact O-N 2.95Å
22	E	69.1	Low	66.5	Low	133 Å²	133	124.2 Å²	124.2	62%	0.621	60%	0.599	S	S	*	*	H	α-helix	trans	-61.8	-42.6	168.2	-123.8	-162.9	174.1	0	0	112	L18 L19 I20 R25 L26	L18-E22 WeakPolarHBondContact O-CB 3.4Å; L18-E22 PolarHBondContact O-N 3.35Å; L18-E22 VanDerWaalsContact O-N 3.14Å; L19-E22 WeakPolarHBondContact O-CB 3.49Å; L19-E22 PolarHBondContact O-N 3.45Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.25Å; E22-R25 PolarHBondContact O-N 2.86Å; E22-L26 VanDerWaalsContact O-CB 3.23Å; E22-L26 WeakPolarHBondContact O-CB 3.48Å; E22-L26 PolarHBondContact O-N 3.3Å
23	Y	77.7	Confident	68.2	Low	165 Å²	165	121.1 Å²	121.1	65%	0.647	59%	0.587	S	S	*	*	H	α-helix	trans	-66.3	-45	-177.3	-164.4	-89.3	0	0	0	113.1	L19 I20 L26 H27	L19-Y23 PolarHBondContact O-N 3.22Å; I20-Y23 WeakPolarHBondContact O-CB 3.47Å; I20-Y23 PolarHBondContact O-N 3.46Å; I20-Y23 VanDerWaalsContact O-N 3.09Å; Y23-L26 PolarHBondContact O-N 3.44Å; Y23-H27 WeakPolarHBondContact O-CB 3.38Å; Y23-H27 PolarHBondContact O-N 3.37Å
24	E	72.6	Confident	69.8	Low	141 Å²	141	119.1 Å²	119.1	66%	0.659	57%	0.573	S	S	*	*	H	α-helix	trans	-66.7	-38.3	177.1	-74.4	-160.4	159.9	0	0	112.1	I20 L26 H27 N28	I20-E24 PolarHBondContact O-N 2.87Å; E24-L26 VanDerWaalsContact C-N 3.32Å; E24-H27 PolarHBondContact O-N 3.44Å; E24-N28 PolarHBondContact O-N 2.93Å
25	R	74.6	Confident	71.4	Confident	194 Å²	194	118.4 Å²	118.4	73%	0.732	57%	0.569	S	S	*	*	H	α-helix	trans	-62.9	-42.7	174	-158	177.1	-171.4	-174.4	2.9	110.5	E21 E22 Q29	E21-R25 VanDerWaalsContact O-CB 3.31Å; E21-R25 WeakPolarHBondContact O-CB 3.14Å; E21-R25 PolarHBondContact O-N 2.95Å; E22-R25 PolarHBondContact O-N 2.86Å; R25-Q29 WeakPolarHBondContact O-CB 3.49Å; R25-Q29 PolarHBondContact O-N 3.04Å
26	L	73	Confident	72.7	Confident	103 Å²	103	119.9 Å²	119.9	54%	0.539	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-40.1	176.7	-161.8	69.3	0	0	0	112	E22 Y23 E24 Q29 L30	E22-L26 VanDerWaalsContact O-CB 3.23Å; E22-L26 WeakPolarHBondContact O-CB 3.48Å; E22-L26 PolarHBondContact O-N 3.3Å; Y23-L26 PolarHBondContact O-N 3.44Å; E24-L26 VanDerWaalsContact C-N 3.32Å; L26-Q29 PolarHBondContact O-N 3.43Å; L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 PolarHBondContact O-N 3.47Å
27	H	79	Confident	74	Confident	108 Å²	108	122.1 Å²	122.1	50%	0.5	57%	0.572	S	S	.	*	H	α-helix	trans	-68.2	-45.3	179.4	-171.2	77.6	0	0	0	112.8	Y23 E24 Q29 L30 R31	Y23-H27 WeakPolarHBondContact O-CB 3.38Å; Y23-H27 PolarHBondContact O-N 3.37Å; E24-H27 PolarHBondContact O-N 3.44Å; H27-Q29 VanDerWaalsContact C-N 3.3Å; H27-Q29 PolarHBondContact O-N 3.14Å; H27-L30 WeakPolarHBondContact O-CB 3.34Å; H27-L30 PolarHBondContact O-N 3.11Å; H27-R31 PolarHBondContact O-N 3.29Å
28	N	75.9	Confident	75.3	Confident	81 Å²	81	121 Å²	121	43%	0.433	56%	0.563	S	S	.	*	H	α-helix	trans	-64.3	-37.4	174.5	-98.2	-28.8	0	0	0	111.6	E24 L30 R31 I32	E24-N28 PolarHBondContact O-N 2.93Å; N28-L30 VanDerWaalsContact C-N 3.34Å; N28-R31 PolarHBondContact O-N 3.09Å; N28-I32 WeakPolarHBondContact O-CG1 3.21Å; N28-I32 PolarHBondContact O-N 3.32Å
29	Q	78	Confident	76.6	Confident	112 Å²	112	121.8 Å²	121.8	52%	0.523	56%	0.561	S	S	.	*	H	α-helix	trans	-65.6	-38	175	-158.2	169	8	0	0	111.6	R25 L26 H27 I32 L33	R25-Q29 WeakPolarHBondContact O-CB 3.49Å; R25-Q29 PolarHBondContact O-N 3.04Å; L26-Q29 PolarHBondContact O-N 3.43Å; H27-Q29 VanDerWaalsContact C-N 3.3Å; H27-Q29 PolarHBondContact O-N 3.14Å; Q29-I32 PolarHBondContact O-N 3.36Å; Q29-L33 WeakPolarHBondContact O-CB 3.23Å; Q29-L33 WeakPolarHBondContact O-CD1 3.4Å; Q29-L33 WeakPolarHBondContact O-CG 3.31Å; Q29-L33 PolarHBondContact O-N 2.94Å
30	L	77.5	Confident	77.5	Confident	98 Å²	98	121.9 Å²	121.9	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-59.9	-45	171.2	-119.5	157.8	0	0	0	111.9	L26 H27 N28 L33 Q34	L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 PolarHBondContact O-N 3.47Å; H27-L30 WeakPolarHBondContact O-CB 3.34Å; H27-L30 PolarHBondContact O-N 3.11Å; N28-L30 VanDerWaalsContact C-N 3.34Å; L30-L33 WeakPolarHBondContact O-CB 3.48Å; L30-L33 PolarHBondContact O-N 3.28Å; L30-Q34 WeakPolarHBondContact O-CB 3.38Å; L30-Q34 PolarHBondContact O-N 2.99Å
31	R	78.9	Confident	78.2	Confident	149 Å²	149	120.2 Å²	120.2	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-66.8	-39.3	179.2	-167.7	171.1	74.9	-173.3	1.9	112.6	H27 N28 Q34 N35	H27-R31 PolarHBondContact O-N 3.29Å; N28-R31 PolarHBondContact O-N 3.09Å; R31-Q34 PolarHBondContact O-N 2.89Å; R31-N35 PolarHBondContact O-N 2.86Å; R31-N35 VanDerWaalsContact O-N 3.09Å
32	I	82.2	Confident	79	Confident	105 Å²	105	118.6 Å²	118.6	54%	0.538	55%	0.546	S	S	.	.	H	α-helix	trans	-63.4	-47.3	173.9	-67.9	166.9	0	0	0	110	N28 Q29 Q34 N35 E36	N28-I32 WeakPolarHBondContact O-CG1 3.21Å; N28-I32 PolarHBondContact O-N 3.32Å; Q29-I32 PolarHBondContact O-N 3.36Å; I32-Q34 VanDerWaalsContact C-N 3.27Å; I32-Q34 PolarHBondContact O-N 2.9Å; I32-N35 PolarHBondContact O-N 3.01Å; I32-E36 PolarHBondContact O-N 3.35Å
33	L	79.8	Confident	79.7	Confident	101 Å²	101	116.5 Å²	116.5	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-58.3	-38.1	175.4	-81	163.7	0	0	0	112.5	Q29 L30 E36 R37	Q29-L33 WeakPolarHBondContact O-CB 3.23Å; Q29-L33 WeakPolarHBondContact O-CD1 3.4Å; Q29-L33 WeakPolarHBondContact O-CG 3.31Å; Q29-L33 PolarHBondContact O-N 2.94Å; L30-L33 WeakPolarHBondContact O-CB 3.48Å; L30-L33 PolarHBondContact O-N 3.28Å; L33-E36 PolarHBondContact O-N 2.72Å; L33-R37 WeakPolarHBondContact O-CB 3.39Å; L33-R37 PolarHBondContact O-N 3.42Å
34	Q	82	Confident	79.9	Confident	105 Å²	105	115 Å²	115	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-71	-39.1	-179	-146.9	162.7	-8.7	0	0	112.1	L30 R31 I32 R37 Q38	L30-Q34 WeakPolarHBondContact O-CB 3.38Å; L30-Q34 PolarHBondContact O-N 2.99Å; R31-Q34 PolarHBondContact O-N 2.89Å; I32-Q34 VanDerWaalsContact C-N 3.27Å; I32-Q34 PolarHBondContact O-N 2.9Å; Q34-R37 PolarHBondContact O-N 3.44Å; Q34-Q38 PolarHBondContact O-N 2.99Å
35	N	81.9	Confident	80.5	Confident	114 Å²	114	112.6 Å²	112.6	61%	0.61	53%	0.529	S	S	*	.	H	α-helix	trans	-68.2	-40.2	171.6	-89.5	-12.5	0	0	0	112.3	R31 I32 R37 Q38 K39	R31-N35 PolarHBondContact O-N 2.86Å; R31-N35 VanDerWaalsContact O-N 3.09Å; I32-N35 PolarHBondContact O-N 3.01Å; N35-R37 VanDerWaalsContact C-N 3.31Å; N35-R37 PolarHBondContact O-N 3.41Å; N35-Q38 PolarHBondContact O-N 3.01Å; N35-K39 WeakPolarHBondContact O-CB 3.34Å; N35-K39 PolarHBondContact O-N 2.85Å
36	E	81.4	Confident	81.1	Confident	105 Å²	105	107.6 Å²	107.6	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-61.7	-40.3	173	-77.9	-167.6	154.2	0	0	111.6	I32 L33 Q38 K39 Q40	I32-E36 PolarHBondContact O-N 3.35Å; L33-E36 PolarHBondContact O-N 2.72Å; E36-Q38 PolarHBondContact O-N 2.8Å; E36-K39 PolarHBondContact O-N 2.94Å; E36-Q40 WeakPolarHBondContact O-CB 3.34Å; E36-Q40 VanDerWaalsContact O-CG 3.27Å; E36-Q40 WeakPolarHBondContact O-CG 3.49Å; E36-Q40 PolarHBondContact O-N 3.49Å
37	R	82	Confident	81.7	Confident	150 Å²	150	107.5 Å²	107.5	57%	0.566	52%	0.515	S	S	*	.	H	α-helix	trans	-61.8	-42.9	174.6	-167.7	-169.6	70.7	172.8	3.5	112	L33 Q34 N35 T41	L33-R37 WeakPolarHBondContact O-CB 3.39Å; L33-R37 PolarHBondContact O-N 3.42Å; Q34-R37 PolarHBondContact O-N 3.44Å; N35-R37 VanDerWaalsContact C-N 3.31Å; N35-R37 PolarHBondContact O-N 3.41Å; R37-T41 WeakPolarHBondContact O-CB 3.27Å; R37-T41 WeakPolarHBondContact O-CG2 3.33Å; R37-T41 PolarHBondContact O-N 2.98Å; R37-T41 PolarHBondContact O-OG1 3.36Å
38	Q	83.5	Confident	82	Confident	104 Å²	104	107 Å²	107	49%	0.486	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-46	176.3	-166.1	86.2	15.7	0	0	111.2	Q34 N35 E36 Q40 T41 E42	Q34-Q38 PolarHBondContact O-N 2.99Å; N35-Q38 PolarHBondContact O-N 3.01Å; E36-Q38 PolarHBondContact O-N 2.8Å; Q38-Q40 PolarHBondContact O-N 3.29Å; Q38-T41 WeakPolarHBondContact CA-OG1 3.37Å; Q38-T41 PolarHBondContact O-N 3.5Å; Q38-T41 PolarHBondContact O-OG1 3.49Å; Q38-E42 PolarHBondContact O-N 3.28Å
39	K	82.7	Confident	82.5	Confident	133 Å²	133	104.7 Å²	104.7	58%	0.578	51%	0.511	S	S	*	.	H	α-helix	trans	-64.4	-42.9	178.3	-171.4	-179.2	176.3	-173.1	0	112.3	N35 E36 T41 E42 E43	N35-K39 WeakPolarHBondContact O-CB 3.34Å; N35-K39 PolarHBondContact O-N 2.85Å; E36-K39 PolarHBondContact O-N 2.94Å; K39-T41 VanDerWaalsContact C-N 3.35Å; K39-T41 PolarHBondContact O-N 2.84Å; K39-E42 PolarHBondContact O-N 2.88Å; K39-E43 WeakPolarHBondContact O-CB 3.47Å; K39-E43 WeakPolarHBondContact O-CG 3.5Å; K39-E43 PolarHBondContact O-N 3.33Å
40	Q	80.9	Confident	83	Confident	106 Å²	106	106.3 Å²	106.3	50%	0.495	52%	0.516	S	S	.	.	H	α-helix	trans	-61.7	-43.4	175.3	-75.4	-178.8	8.4	0	0	111.1	E36 Q38 E43 F44	E36-Q40 WeakPolarHBondContact O-CB 3.34Å; E36-Q40 VanDerWaalsContact O-CG 3.27Å; E36-Q40 WeakPolarHBondContact O-CG 3.49Å; E36-Q40 PolarHBondContact O-N 3.49Å; Q38-Q40 PolarHBondContact O-N 3.29Å; Q40-E43 PolarHBondContact O-N 3.44Å; Q40-F44 HydrophobicContact CB-CD2 4.36Å; Q40-F44 HydrophobicContact CB-CE2 4.37Å; Q40-F44 WeakPolarHBondContact O-CB 3.49Å; Q40-F44 WeakPolarHBondContact O-CD2 3.01Å; Q40-F44 WeakPolarHBondContact O-CG 3.36Å; Q40-F44 PolarHBondContact O-N 2.93Å
41	T	83.7	Confident	83.4	Confident	70 Å²	70	109.2 Å²	109.2	43%	0.429	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-41.9	178.4	43.9	0	0	0	0	112.5	R37 Q38 K39 F44 T45	R37-T41 WeakPolarHBondContact O-CB 3.27Å; R37-T41 WeakPolarHBondContact O-CG2 3.33Å; R37-T41 PolarHBondContact O-N 2.98Å; R37-T41 PolarHBondContact O-OG1 3.36Å; Q38-T41 WeakPolarHBondContact CA-OG1 3.37Å; Q38-T41 PolarHBondContact O-N 3.5Å; Q38-T41 PolarHBondContact O-OG1 3.49Å; K39-T41 VanDerWaalsContact C-N 3.35Å; K39-T41 PolarHBondContact O-N 2.84Å; T41-F44 PolarHBondContact O-N 2.95Å; T41-T45 WeakPolarHBondContact O-CG2 3.35Å; T41-T45 PolarHBondContact O-N 2.93Å
42	E	82.1	Confident	84	Confident	113 Å²	113	108.4 Å²	108.4	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-46.6	173.6	-73.8	176	-172.7	0	0	112.1	Q38 K39 F44 T45 V46	Q38-E42 PolarHBondContact O-N 3.28Å; K39-E42 PolarHBondContact O-N 2.88Å; E42-F44 VanDerWaalsContact C-N 3.3Å; E42-F44 PolarHBondContact O-N 3.46Å; E42-T45 PolarHBondContact O-N 2.9Å; E42-T45 VanDerWaalsContact O-N 3.12Å; E42-T45 PolarHBondContact O-OG1 3.49Å; E42-V46 PolarHBondContact O-N 3.12Å
43	E	83.8	Confident	84.4	Confident	90 Å²	90	110.5 Å²	110.5	42%	0.421	53%	0.527	S	S	.	.	H	α-helix	trans	-59.4	-39.9	174.4	-77.2	-171.6	-165.7	0	0	112.5	K39 Q40 V46 K47	K39-E43 WeakPolarHBondContact O-CB 3.47Å; K39-E43 WeakPolarHBondContact O-CG 3.5Å; K39-E43 PolarHBondContact O-N 3.33Å; Q40-E43 PolarHBondContact O-N 3.44Å; E43-V46 PolarHBondContact O-N 3.36Å; E43-K47 WeakPolarHBondContact O-CB 3.35Å; E43-K47 WeakPolarHBondContact O-CG 3.35Å; E43-K47 PolarHBondContact O-N 2.82Å; E43-K47 IonicContact OE2-NZ 3.76Å
44	F	83.5	Confident	84.9	Confident	134 Å²	134	107.9 Å²	107.9	59%	0.588	52%	0.52	S	S	*	.	H	α-helix	trans	-61.9	-44.1	174	-85.9	-63.5	0	0	0	111.2	Q40 T41 E42 V46 K47 L48	Q40-F44 HydrophobicContact CB-CD2 4.36Å; Q40-F44 HydrophobicContact CB-CE2 4.37Å; Q40-F44 WeakPolarHBondContact O-CB 3.49Å; Q40-F44 WeakPolarHBondContact O-CD2 3.01Å; Q40-F44 WeakPolarHBondContact O-CG 3.36Å; Q40-F44 PolarHBondContact O-N 2.93Å; T41-F44 PolarHBondContact O-N 2.95Å; E42-F44 VanDerWaalsContact C-N 3.3Å; E42-F44 PolarHBondContact O-N 3.46Å; F44-V46 PolarHBondContact O-N 2.8Å; F44-K47 PolarHBondContact O-N 3.37Å; F44-L48 WeakPolarHBondContact O-CB 3.34Å; F44-L48 PolarHBondContact O-N 3.42Å
45	T	85	Confident	85.3	Confident	90 Å²	90	106.3 Å²	106.3	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-64.9	-39.8	178.4	60.1	0	0	0	0	112.9	T41 E42 L48 G49	T41-T45 WeakPolarHBondContact O-CG2 3.35Å; T41-T45 PolarHBondContact O-N 2.93Å; E42-T45 PolarHBondContact O-N 2.9Å; E42-T45 VanDerWaalsContact O-N 3.12Å; E42-T45 PolarHBondContact O-OG1 3.49Å; T45-L48 PolarHBondContact O-N 3.48Å; T45-G49 PolarHBondContact O-N 3.01Å
46	V	86.5	Confident	85.9	Confident	89 Å²	89	106.3 Å²	106.3	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-67.5	-44.1	176.5	174.9	0	0	0	0	111.2	E42 E43 F44 G49 K50	E42-V46 PolarHBondContact O-N 3.12Å; E43-V46 PolarHBondContact O-N 3.36Å; F44-V46 PolarHBondContact O-N 2.8Å; V46-G49 PolarHBondContact O-N 3.32Å; V46-K50 PolarHBondContact O-N 2.99Å; V46-K50 VanDerWaalsContact O-N 3.08Å
47	K	85.2	Confident	86.5	Confident	101 Å²	101	106 Å²	106	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-61.3	-45.9	174.1	-78.2	170.8	-179.9	161	0	111	E43 F44 G49 K50 Y51	E43-K47 WeakPolarHBondContact O-CB 3.35Å; E43-K47 WeakPolarHBondContact O-CG 3.35Å; E43-K47 PolarHBondContact O-N 2.82Å; E43-K47 IonicContact OE2-NZ 3.76Å; F44-K47 PolarHBondContact O-N 3.37Å; K47-G49 VanDerWaalsContact C-N 3.3Å; K47-G49 PolarHBondContact O-N 3.12Å; K47-K50 WeakPolarHBondContact O-CB 3.44Å; K47-K50 PolarHBondContact O-N 3.48Å; K47-K50 VanDerWaalsContact O-N 3.11Å; K47-Y51 HydrophobicContact CB-CD2 4.33Å; K47-Y51 HydrophobicContact CB-CE2 3.99Å; K47-Y51 WeakPolarHBondContact O-CD2 3.5Å; K47-Y51 PolarHBondContact O-N 3.49Å
48	L	85.9	Confident	86.9	Confident	96 Å²	96	103.8 Å²	103.8	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-60.4	-39.7	177.9	-168.4	70.2	0	0	0	111.7	F44 T45 Y51 K52	F44-L48 WeakPolarHBondContact O-CB 3.34Å; F44-L48 PolarHBondContact O-N 3.42Å; T45-L48 PolarHBondContact O-N 3.48Å; L48-Y51 PolarHBondContact O-N 2.91Å; L48-K52 WeakPolarHBondContact O-CB 3.49Å; L48-K52 WeakPolarHBondContact O-CG 3.05Å; L48-K52 PolarHBondContact O-N 3.43Å
49	G	86.9	Confident	87.4	Confident	33 Å²	33	104.5 Å²	104.5	34%	0.34	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-40.2	173.3	0	0	0	0	0	113.4	T45 V46 K47 K52 K53	T45-G49 PolarHBondContact O-N 3.01Å; V46-G49 PolarHBondContact O-N 3.32Å; K47-G49 VanDerWaalsContact C-N 3.3Å; K47-G49 PolarHBondContact O-N 3.12Å; G49-K52 PolarHBondContact O-N 3.47Å; G49-K53 PolarHBondContact O-N 3.38Å; G49-K53 VanDerWaalsContact O-N 3.12Å
50	K	87.4	Confident	87.9	Confident	147 Å²	147	104.2 Å²	104.2	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-44.1	174.4	-70.1	-179.9	-178	-177.8	0	111.9	V46 K47 K52 K53 A54	V46-K50 PolarHBondContact O-N 2.99Å; V46-K50 VanDerWaalsContact O-N 3.08Å; K47-K50 WeakPolarHBondContact O-CB 3.44Å; K47-K50 PolarHBondContact O-N 3.48Å; K47-K50 VanDerWaalsContact O-N 3.11Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.11Å; K50-K53 PolarHBondContact O-N 3.36Å; K50-A54 WeakPolarHBondContact O-CB 3.3Å; K50-A54 PolarHBondContact O-N 3.08Å
51	Y	87.2	Confident	88.5	Confident	158 Å²	158	103.8 Å²	103.8	62%	0.62	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-42.9	175.9	-69.3	-53.9	0	0	0	111.3	K47 L48 K53 A54 T55	K47-Y51 HydrophobicContact CB-CD2 4.33Å; K47-Y51 HydrophobicContact CB-CE2 3.99Å; K47-Y51 WeakPolarHBondContact O-CD2 3.5Å; K47-Y51 PolarHBondContact O-N 3.49Å; L48-Y51 PolarHBondContact O-N 2.91Å; Y51-K53 PolarHBondContact O-N 3.17Å; Y51-A54 PolarHBondContact O-N 3.44Å; Y51-T55 PolarHBondContact O-N 3.06Å; Y51-T55 PolarHBondContact O-OG1 3.32Å
52	K	90.6	Very high	88.9	Confident	132 Å²	132	104.5 Å²	104.5	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-59.6	-44.2	175.6	-78.8	-177.3	175.8	-173.2	0	113.2	L48 G49 K50 T55 E56	L48-K52 WeakPolarHBondContact O-CB 3.49Å; L48-K52 WeakPolarHBondContact O-CG 3.05Å; L48-K52 PolarHBondContact O-N 3.43Å; G49-K52 PolarHBondContact O-N 3.47Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.11Å; K52-T55 VanDerWaalsContact CA-OG1 3.3Å; K52-T55 WeakPolarHBondContact CA-OG1 3.14Å; K52-T55 PolarHBondContact O-N 3.37Å; K52-T55 PolarHBondContact O-OG1 2.88Å; K52-E56 WeakPolarHBondContact O-CB 3.34Å; K52-E56 PolarHBondContact O-N 3.46Å
53	K	90	Very high	89.4	Confident	149 Å²	149	105.3 Å²	105.3	65%	0.648	52%	0.519	S	S	*	.	H	α-helix	trans	-65.1	-40.5	176	-71.9	-177	-179.5	-175.1	0	112.3	G49 K50 Y51 E56 I57	G49-K53 PolarHBondContact O-N 3.38Å; G49-K53 VanDerWaalsContact O-N 3.12Å; K50-K53 PolarHBondContact O-N 3.36Å; Y51-K53 PolarHBondContact O-N 3.17Å; K53-E56 PolarHBondContact O-N 2.87Å; K53-I57 WeakPolarHBondContact O-CG1 3.36Å; K53-I57 PolarHBondContact O-N 2.79Å
54	A	91.7	Very high	89.8	Confident	47 Å²	47	107.3 Å²	107.3	39%	0.388	53%	0.528	S	S	.	.	H	α-helix	trans	-65.8	-41.6	177.5	0	0	0	0	0	111.7	K50 Y51 E56 I57 L58	K50-A54 WeakPolarHBondContact O-CB 3.3Å; K50-A54 PolarHBondContact O-N 3.08Å; Y51-A54 PolarHBondContact O-N 3.44Å; A54-E56 VanDerWaalsContact C-N 3.33Å; A54-I57 PolarHBondContact O-N 3.02Å; A54-L58 WeakPolarHBondContact O-CG 3.43Å; A54-L58 PolarHBondContact O-N 3.4Å
55	T	90.3	Very high	90.2	Very high	71 Å²	71	105.4 Å²	105.4	44%	0.436	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-40.1	174.2	46.2	0	0	0	0	111.6	Y51 K52 I57 L58 E59	Y51-T55 PolarHBondContact O-N 3.06Å; Y51-T55 PolarHBondContact O-OG1 3.32Å; K52-T55 VanDerWaalsContact CA-OG1 3.3Å; K52-T55 WeakPolarHBondContact CA-OG1 3.14Å; K52-T55 PolarHBondContact O-N 3.37Å; K52-T55 PolarHBondContact O-OG1 2.88Å; T55-I57 VanDerWaalsContact C-N 3.35Å; T55-I57 PolarHBondContact O-N 3.25Å; T55-L58 PolarHBondContact O-N 2.98Å; T55-E59 VanDerWaalsContact O-CB 3.31Å; T55-E59 WeakPolarHBondContact O-CB 3.34Å; T55-E59 VanDerWaalsContact O-CG 3.22Å; T55-E59 WeakPolarHBondContact O-CG 3.36Å; T55-E59 PolarHBondContact O-N 2.8Å
56	E	93.2	Very high	90.5	Very high	114 Å²	114	106.8 Å²	106.8	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-34.2	179.4	-159.2	175.7	-158.7	0	0	112.4	K52 K53 A54 K60	K52-E56 WeakPolarHBondContact O-CB 3.34Å; K52-E56 PolarHBondContact O-N 3.46Å; K53-E56 PolarHBondContact O-N 2.87Å; A54-E56 VanDerWaalsContact C-N 3.33Å; E56-K60 WeakPolarHBondContact O-CG 3.48Å; E56-K60 PolarHBondContact O-N 3.02Å; E56-K60 VanDerWaalsContact O-N 3.17Å
57	I	93.7	Very high	90.5	Very high	99 Å²	99	106.4 Å²	106.4	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-68.7	-48.7	172.6	-66.7	164.3	0	0	0	110.7	K53 A54 T55 E59 K60 E61	K53-I57 WeakPolarHBondContact O-CG1 3.36Å; K53-I57 PolarHBondContact O-N 2.79Å; A54-I57 PolarHBondContact O-N 3.02Å; T55-I57 VanDerWaalsContact C-N 3.35Å; T55-I57 PolarHBondContact O-N 3.25Å; I57-E59 VanDerWaalsContact C-N 3.26Å; I57-E59 PolarHBondContact O-N 2.92Å; I57-K60 WeakPolarHBondContact O-CB 3.46Å; I57-K60 PolarHBondContact O-N 3.41Å; I57-K60 VanDerWaalsContact O-N 3.15Å; I57-E61 PolarHBondContact O-N 3.37Å
58	L	91.7	Very high	90.6	Very high	104 Å²	104	107 Å²	107	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-62.8	-34.9	178.9	-72.2	170.1	0	0	0	111.8	A54 T55 N62	A54-L58 WeakPolarHBondContact O-CG 3.43Å; A54-L58 PolarHBondContact O-N 3.4Å; T55-L58 PolarHBondContact O-N 2.98Å; L58-N62 WeakPolarHBondContact O-CB 3.22Å; L58-N62 PolarHBondContact O-N 3.12Å
59	E	92.8	Very high	90.6	Very high	118 Å²	118	107 Å²	107	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-45.1	173.6	-78.8	170.9	173.4	0	0	111	T55 I57 N62 E63	T55-E59 VanDerWaalsContact O-CB 3.31Å; T55-E59 WeakPolarHBondContact O-CB 3.34Å; T55-E59 VanDerWaalsContact O-CG 3.22Å; T55-E59 WeakPolarHBondContact O-CG 3.36Å; T55-E59 PolarHBondContact O-N 2.8Å; I57-E59 VanDerWaalsContact C-N 3.26Å; I57-E59 PolarHBondContact O-N 2.92Å; E59-N62 PolarHBondContact O-N 2.87Å; E59-E63 WeakPolarHBondContact O-CG 3.39Å; E59-E63 PolarHBondContact O-N 3.21Å
60	K	93.8	Very high	90.6	Very high	128 Å²	128	109.9 Å²	109.9	56%	0.557	54%	0.54	S	S	*	.	H	α-helix	trans	-62.2	-45.2	174.1	-74.9	179.9	-178.8	179.5	0	113	E56 I57 N62 E63 E64	E56-K60 WeakPolarHBondContact O-CG 3.48Å; E56-K60 PolarHBondContact O-N 3.02Å; E56-K60 VanDerWaalsContact O-N 3.17Å; I57-K60 WeakPolarHBondContact O-CB 3.46Å; I57-K60 PolarHBondContact O-N 3.41Å; I57-K60 VanDerWaalsContact O-N 3.15Å; K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 3.15Å; K60-E63 WeakPolarHBondContact O-CB 3.36Å; K60-E63 PolarHBondContact O-N 2.87Å; K60-E64 WeakPolarHBondContact O-CG 3.18Å; K60-E64 PolarHBondContact O-N 3.29Å
61	E	94.1	Very high	90.5	Very high	97 Å²	97	107.8 Å²	107.8	45%	0.453	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-39.7	176	-72.3	179.5	170.5	0	0	111.4	I57 E64 I65	I57-E61 PolarHBondContact O-N 3.37Å; E61-E64 PolarHBondContact O-N 3.48Å; E61-I65 WeakPolarHBondContact O-CB 3.49Å; E61-I65 VanDerWaalsContact O-CG1 3.27Å; E61-I65 WeakPolarHBondContact O-CG1 3.31Å; E61-I65 PolarHBondContact O-N 3.4Å
62	N	92.1	Very high	90.4	Very high	85 Å²	85	104 Å²	104	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-69	-35.5	177.5	-158.4	-9.6	0	0	0	111.4	L58 E59 K60 K66	L58-N62 WeakPolarHBondContact O-CB 3.22Å; L58-N62 PolarHBondContact O-N 3.12Å; E59-N62 PolarHBondContact O-N 2.87Å; K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 3.15Å; N62-K66 VanDerWaalsContact O-CB 3.28Å; N62-K66 WeakPolarHBondContact O-CB 3.27Å; N62-K66 WeakPolarHBondContact O-CG 3.49Å; N62-K66 PolarHBondContact O-N 2.86Å
63	E	92.6	Very high	90	Very high	130 Å²	130	101.6 Å²	101.6	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-42.3	169.8	-74.5	178.7	173.3	0	0	112.1	E59 K60 K66 C67	E59-E63 WeakPolarHBondContact O-CG 3.39Å; E59-E63 PolarHBondContact O-N 3.21Å; K60-E63 WeakPolarHBondContact O-CB 3.36Å; K60-E63 PolarHBondContact O-N 2.87Å; E63-K66 PolarHBondContact O-N 2.84Å; E63-C67 WeakPolarHBondContact O-CB 3.19Å; E63-C67 PolarHBondContact O-N 3.29Å
64	E	92	Very high	89.8	Confident	131 Å²	131	96.2 Å²	96.2	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-46.7	175.6	-75.4	-179.1	-178.4	0	0	112.1	K60 E61 K66 C67 L68	K60-E64 WeakPolarHBondContact O-CG 3.18Å; K60-E64 PolarHBondContact O-N 3.29Å; E61-E64 PolarHBondContact O-N 3.48Å; E64-K66 VanDerWaalsContact C-N 3.33Å; E64-K66 PolarHBondContact O-N 2.87Å; E64-C67 WeakPolarHBondContact O-CB 3.5Å; E64-C67 PolarHBondContact O-N 2.91Å; E64-C67 VanDerWaalsContact O-N 3.12Å; E64-L68 WeakPolarHBondContact O-CG 3.47Å; E64-L68 PolarHBondContact O-N 3.46Å
65	I	90.7	Very high	89.6	Confident	94 Å²	94	98 Å²	98	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-62.8	-41.5	176.4	-68	166	0	0	0	110.4	E61 C67 L68 L69	E61-I65 WeakPolarHBondContact O-CB 3.49Å; E61-I65 VanDerWaalsContact O-CG1 3.27Å; E61-I65 WeakPolarHBondContact O-CG1 3.31Å; E61-I65 PolarHBondContact O-N 3.4Å; I65-C67 VanDerWaalsContact C-N 3.32Å; I65-C67 PolarHBondContact O-N 3.41Å; I65-L68 PolarHBondContact O-N 3.19Å; I65-L69 HydrophobicContact CG2-CD1 3.93Å; I65-L69 HydrophobicContact CG2-CG 4.37Å; I65-L69 WeakPolarHBondContact O-CB 3.37Å; I65-L69 WeakPolarHBondContact O-CG 3.28Å; I65-L69 PolarHBondContact O-N 2.9Å
66	K	91.8	Very high	89.4	Confident	120 Å²	120	100 Å²	100	52%	0.522	52%	0.523	S	S	.	.	H	α-helix	trans	-61.7	-41.1	173.2	-78.3	172.7	-174.4	174.5	0	111.3	N62 E63 E64 L69 T70	N62-K66 VanDerWaalsContact O-CB 3.28Å; N62-K66 WeakPolarHBondContact O-CB 3.27Å; N62-K66 WeakPolarHBondContact O-CG 3.49Å; N62-K66 PolarHBondContact O-N 2.86Å; E63-K66 PolarHBondContact O-N 2.84Å; E64-K66 VanDerWaalsContact C-N 3.33Å; E64-K66 PolarHBondContact O-N 2.87Å; K66-L69 PolarHBondContact O-N 2.7Å; K66-T70 WeakPolarHBondContact O-CB 3.48Å; K66-T70 VanDerWaalsContact O-CG2 3.22Å; K66-T70 WeakPolarHBondContact O-CG2 3.22Å; K66-T70 PolarHBondContact O-N 3.48Å; K66-T70 PolarHBondContact O-OG1 3.49Å; K66-T70 VanDerWaalsContact O-OG1 3.13Å
67	C	86.2	Confident	89.2	Confident	81 Å²	81	97 Å²	97	55%	0.547	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-47	175.8	-167.7	0	0	0	0	111.2	E63 E64 I65 L69 T70 L71	E63-C67 WeakPolarHBondContact O-CB 3.19Å; E63-C67 PolarHBondContact O-N 3.29Å; E64-C67 WeakPolarHBondContact O-CB 3.5Å; E64-C67 PolarHBondContact O-N 2.91Å; E64-C67 VanDerWaalsContact O-N 3.12Å; I65-C67 VanDerWaalsContact C-N 3.32Å; I65-C67 PolarHBondContact O-N 3.41Å; C67-L69 PolarHBondContact O-N 3.13Å; C67-T70 WeakPolarHBondContact CA-OG1 3.35Å; C67-T70 PolarHBondContact O-N 3.24Å; C67-T70 PolarHBondContact O-OG1 3.38Å; C67-L71 WeakPolarHBondContact O-CB 3.32Å; C67-L71 PolarHBondContact O-N 2.81Å
68	L	89	Confident	88.9	Confident	112 Å²	112	98.4 Å²	98.4	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-43.6	175.5	-70.1	174	0	0	0	112.3	E64 I65 T70 L71 V72	E64-L68 WeakPolarHBondContact O-CG 3.47Å; E64-L68 PolarHBondContact O-N 3.46Å; I65-L68 PolarHBondContact O-N 3.19Å; L68-T70 VanDerWaalsContact C-N 3.34Å; L68-T70 PolarHBondContact O-N 2.83Å; L68-L71 WeakPolarHBondContact O-CB 3.36Å; L68-L71 PolarHBondContact O-N 3.33Å; L68-V72 VanDerWaalsContact O-CG2 3.32Å; L68-V72 WeakPolarHBondContact O-CG2 3.49Å; L68-V72 PolarHBondContact O-N 3.35Å
69	L	85.5	Confident	88.9	Confident	98 Å²	98	99.3 Å²	99.3	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-43.8	174.7	-79.6	168.7	0	0	0	111	I65 K66 C67 L71 V72 D73	I65-L69 HydrophobicContact CG2-CD1 3.93Å; I65-L69 HydrophobicContact CG2-CG 4.37Å; I65-L69 WeakPolarHBondContact O-CB 3.37Å; I65-L69 WeakPolarHBondContact O-CG 3.28Å; I65-L69 PolarHBondContact O-N 2.9Å; K66-L69 PolarHBondContact O-N 2.7Å; C67-L69 PolarHBondContact O-N 3.13Å; L69-L71 VanDerWaalsContact C-N 3.29Å; L69-L71 PolarHBondContact O-N 2.93Å; L69-V72 PolarHBondContact O-N 3.01Å; L69-D73 VanDerWaalsContact O-CB 3.22Å; L69-D73 WeakPolarHBondContact O-CB 3.19Å; L69-D73 PolarHBondContact O-N 2.68Å
70	T	86.4	Confident	88.7	Confident	92 Å²	92	98.4 Å²	98.4	56%	0.564	50%	0.504	S	S	*	.	H	α-helix	trans	-66.9	-30	176.5	57.6	0	0	0	0	112.9	K66 C67 L68 D73 S74	K66-T70 WeakPolarHBondContact O-CB 3.48Å; K66-T70 VanDerWaalsContact O-CG2 3.22Å; K66-T70 WeakPolarHBondContact O-CG2 3.22Å; K66-T70 PolarHBondContact O-N 3.48Å; K66-T70 PolarHBondContact O-OG1 3.49Å; K66-T70 VanDerWaalsContact O-OG1 3.13Å; C67-T70 WeakPolarHBondContact CA-OG1 3.35Å; C67-T70 PolarHBondContact O-N 3.24Å; C67-T70 PolarHBondContact O-OG1 3.38Å; L68-T70 VanDerWaalsContact C-N 3.34Å; L68-T70 PolarHBondContact O-N 2.83Å; T70-D73 CarbonylContact O-C 3.57Å; T70-S74 WeakPolarHBondContact O-CA 3.46Å; T70-S74 PolarHBondContact O-N 3.21Å
71	L	86.3	Confident	88.6	Confident	104 Å²	104	96.1 Å²	96.1	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-72.5	-43.8	175.2	-167.6	74.6	0	0	0	111	C67 L68 L69 D73 S74 N77	C67-L71 WeakPolarHBondContact O-CB 3.32Å; C67-L71 PolarHBondContact O-N 2.81Å; L68-L71 WeakPolarHBondContact O-CB 3.36Å; L68-L71 PolarHBondContact O-N 3.33Å; L69-L71 VanDerWaalsContact C-N 3.29Å; L69-L71 PolarHBondContact O-N 2.93Å; L71-D73 VanDerWaalsContact C-N 3.33Å; L71-S74 WeakPolarHBondContact O-CB 3.47Å; L71-S74 PolarHBondContact O-N 3Å; L71-S74 PolarHBondContact O-OG 2.86Å; L71-N77 PolarHBondContact O-ND2 3.32Å
72	V	83.2	Confident	88.4	Confident	79 Å²	79	97.4 Å²	97.4	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-42.9	172	171.6	0	0	0	0	110.6	L68 L69 S74 N77	L68-V72 VanDerWaalsContact O-CG2 3.32Å; L68-V72 WeakPolarHBondContact O-CG2 3.49Å; L68-V72 PolarHBondContact O-N 3.35Å; L69-V72 PolarHBondContact O-N 3.01Å; V72-S74 PolarHBondContact O-N 3.06Å; V72-N77 WeakPolarHBondContact O-CB 3.22Å
73	D	83.1	Confident	88.4	Confident	80 Å²	80	98.9 Å²	98.9	43%	0.428	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.5	177.4	-81.9	-20	0	0	0	114.3	L69 T70 L71 A75 R78	L69-D73 VanDerWaalsContact O-CB 3.22Å; L69-D73 WeakPolarHBondContact O-CB 3.19Å; L69-D73 PolarHBondContact O-N 2.68Å; T70-D73 CarbonylContact O-C 3.57Å; L71-D73 VanDerWaalsContact C-N 3.33Å; D73-A75 PolarHBondContact O-N 2.78Å; D73-R78 IonicContact OD1-CZ 3.31Å; D73-R78 VanDerWaalsContact OD1-CZ 3.31Å; D73-R78 IonicContact OD1-NE 3.13Å; D73-R78 PolarHBondContact OD1-NE 3.21Å; D73-R78 VanDerWaalsContact OD1-NE 3.13Å; D73-R78 IonicContact OD1-NH2 2.68Å; D73-R78 PolarHBondContact OD1-NH2 3.12Å; D73-R78 IonicContact OD2-NH2 3.41Å; D73-R78 PolarHBondContact OD2-NH2 3.38Å
74	S	86.3	Confident	88.4	Confident	36 Å²	36	95.7 Å²	95.7	25%	0.252	50%	0.499	S	S	.	.	S	Bend	trans	-55.4	138.2	176.9	74.9	0	0	0	0	109	T70 L71 V72 Q76 N77 R78	T70-S74 WeakPolarHBondContact O-CA 3.46Å; T70-S74 PolarHBondContact O-N 3.21Å; L71-S74 WeakPolarHBondContact O-CB 3.47Å; L71-S74 PolarHBondContact O-N 3Å; L71-S74 PolarHBondContact O-OG 2.86Å; V72-S74 PolarHBondContact O-N 3.06Å; S74-Q76 PolarHBondContact O-N 3.36Å; S74-N77 PolarHBondContact O-N 2.88Å; S74-N77 PolarHBondContact OG-N 2.98Å; S74-R78 PolarHBondContact O-N 3.38Å
75	A	86	Confident	88.5	Confident	85 Å²	85	93.1 Å²	93.1	70%	0.702	49%	0.489	S	S	*	.	H	α-helix	trans	-55.5	-28.6	-176.3	0	0	0	0	0	112.3	D73 K79	D73-A75 PolarHBondContact O-N 2.78Å; A75-K79 WeakPolarHBondContact O-CB 3.43Å; A75-K79 PolarHBondContact O-N 3.02Å; A75-K79 VanDerWaalsContact O-N 3.12Å
76	Q	87.2	Confident	88.7	Confident	114 Å²	114	95.2 Å²	95.2	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-71.7	-45.5	177	-175.6	65.2	2.9	0	0	112.7	S74 K79 Q80	S74-Q76 PolarHBondContact O-N 3.36Å; Q76-K79 PolarHBondContact O-N 2.8Å; Q76-Q80 WeakPolarHBondContact O-CG 3.29Å; Q76-Q80 PolarHBondContact O-N 2.68Å
77	N	88.8	Confident	88.9	Confident	50 Å²	50	95.1 Å²	95.1	27%	0.267	50%	0.498	S	S	.	.	H	α-helix	trans	-67.3	-46	178.2	-81.2	12.8	0	0	0	111.3	L71 V72 S74 K79 Q80 D81	L71-N77 PolarHBondContact O-ND2 3.32Å; V72-N77 WeakPolarHBondContact O-CB 3.22Å; S74-N77 PolarHBondContact O-N 2.88Å; S74-N77 PolarHBondContact OG-N 2.98Å; N77-K79 PolarHBondContact O-N 3.13Å; N77-Q80 CarbonylContact O-C 3.54Å; N77-Q80 WeakPolarHBondContact O-CA 3.44Å; N77-Q80 WeakPolarHBondContact O-CB 3.43Å; N77-Q80 PolarHBondContact O-N 3.19Å; N77-D81 PolarHBondContact O-N 2.95Å
78	R	88	Confident	89.3	Confident	129 Å²	129	96.2 Å²	96.2	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-56.5	-38.1	173.6	-71.1	-177.2	171.9	-169	2.1	112.4	D73 S74 D81 M82	D73-R78 IonicContact OD1-CZ 3.31Å; D73-R78 VanDerWaalsContact OD1-CZ 3.31Å; D73-R78 IonicContact OD1-NE 3.13Å; D73-R78 PolarHBondContact OD1-NE 3.21Å; D73-R78 VanDerWaalsContact OD1-NE 3.13Å; D73-R78 IonicContact OD1-NH2 2.68Å; D73-R78 PolarHBondContact OD1-NH2 3.12Å; D73-R78 IonicContact OD2-NH2 3.41Å; D73-R78 PolarHBondContact OD2-NH2 3.38Å; S74-R78 PolarHBondContact O-N 3.38Å; R78-D81 PolarHBondContact O-N 3.21Å; R78-M82 WeakPolarHBondContact O-CB 3.48Å; R78-M82 VanDerWaalsContact O-CG 3.22Å; R78-M82 WeakPolarHBondContact O-CG 3.19Å; R78-M82 PolarHBondContact O-N 3.44Å
79	K	90.1	Very high	89.6	Confident	122 Å²	122	97 Å²	97	53%	0.53	50%	0.496	S	S	.	.	H	α-helix	trans	-67.9	-35.9	175.4	-174.5	177	-176.6	177.6	0	112.1	A75 Q76 N77 K83	A75-K79 WeakPolarHBondContact O-CB 3.43Å; A75-K79 PolarHBondContact O-N 3.02Å; A75-K79 VanDerWaalsContact O-N 3.12Å; Q76-K79 PolarHBondContact O-N 2.8Å; N77-K79 PolarHBondContact O-N 3.13Å; K79-K83 VanDerWaalsContact O-CG 3.29Å; K79-K83 WeakPolarHBondContact O-CG 3.22Å; K79-K83 PolarHBondContact O-N 3.41Å
80	Q	89.5	Confident	90.1	Very high	99 Å²	99	97.6 Å²	97.6	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-68.7	-44.2	173	-72.2	-179.2	-4.2	0	0	111.3	Q76 N77 M82 K83 C84	Q76-Q80 WeakPolarHBondContact O-CG 3.29Å; Q76-Q80 PolarHBondContact O-N 2.68Å; N77-Q80 CarbonylContact O-C 3.54Å; N77-Q80 WeakPolarHBondContact O-CA 3.44Å; N77-Q80 WeakPolarHBondContact O-CB 3.43Å; N77-Q80 PolarHBondContact O-N 3.19Å; Q80-M82 PolarHBondContact O-N 3.35Å; Q80-K83 WeakPolarHBondContact O-CB 3.28Å; Q80-K83 PolarHBondContact O-N 2.83Å; Q80-K83 VanDerWaalsContact O-N 3.14Å; Q80-C84 PolarHBondContact O-N 2.85Å; Q80-C84 PolarHBondContact O-SG 2.86Å; Q80-C84 VanDerWaalsContact O-SG 3.35Å
81	D	91.3	Very high	90.5	Very high	81 Å²	81	98 Å²	98	43%	0.433	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-43.8	177.4	-68.5	-19.4	0	0	0	111.8	N77 R78 K83 C84 I85	N77-D81 PolarHBondContact O-N 2.95Å; R78-D81 PolarHBondContact O-N 3.21Å; D81-K83 VanDerWaalsContact C-N 3.31Å; D81-K83 PolarHBondContact O-N 3.42Å; D81-C84 PolarHBondContact O-N 3.46Å; D81-I85 WeakPolarHBondContact O-CB 3.41Å; D81-I85 VanDerWaalsContact O-CG1 3.28Å; D81-I85 WeakPolarHBondContact O-CG1 3.43Å; D81-I85 PolarHBondContact O-N 3.14Å
82	M	90.4	Very high	91	Very high	123 Å²	123	97.1 Å²	97.1	61%	0.606	49%	0.49	S	S	*	.	H	α-helix	trans	-61.5	-40.6	175.4	-72	-64.8	146.5	0	0	111.7	R78 Q80 I85 E86	R78-M82 WeakPolarHBondContact O-CB 3.48Å; R78-M82 VanDerWaalsContact O-CG 3.22Å; R78-M82 WeakPolarHBondContact O-CG 3.19Å; R78-M82 PolarHBondContact O-N 3.44Å; Q80-M82 PolarHBondContact O-N 3.35Å; M82-I85 PolarHBondContact O-N 3.34Å; M82-E86 WeakPolarHBondContact O-CB 3.37Å; M82-E86 PolarHBondContact O-N 2.91Å
83	K	92.6	Very high	91.6	Very high	117 Å²	117	99.3 Å²	99.3	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-43.5	173.5	-74.9	176.9	176	-167.3	0	112.2	K79 Q80 D81 E86 Q87	K79-K83 VanDerWaalsContact O-CG 3.29Å; K79-K83 WeakPolarHBondContact O-CG 3.22Å; K79-K83 PolarHBondContact O-N 3.41Å; Q80-K83 WeakPolarHBondContact O-CB 3.28Å; Q80-K83 PolarHBondContact O-N 2.83Å; Q80-K83 VanDerWaalsContact O-N 3.14Å; D81-K83 VanDerWaalsContact C-N 3.31Å; D81-K83 PolarHBondContact O-N 3.42Å; K83-E86 PolarHBondContact O-N 2.94Å; K83-Q87 WeakPolarHBondContact O-CB 3.49Å; K83-Q87 VanDerWaalsContact O-CG 3.29Å; K83-Q87 WeakPolarHBondContact O-CG 3.33Å; K83-Q87 PolarHBondContact O-N 2.98Å
84	C	92.2	Very high	92.2	Very high	63 Å²	63	100.1 Å²	100.1	43%	0.426	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-42	177.4	-72.2	0	0	0	0	111.6	Q80 D81 Q87 L88	Q80-C84 PolarHBondContact O-N 2.85Å; Q80-C84 PolarHBondContact O-SG 2.86Å; Q80-C84 VanDerWaalsContact O-SG 3.35Å; D81-C84 PolarHBondContact O-N 3.46Å; C84-Q87 PolarHBondContact O-N 2.87Å; C84-L88 WeakPolarHBondContact O-CB 3.29Å; C84-L88 PolarHBondContact O-N 3.43Å
85	I	94.7	Very high	92.7	Very high	77 Å²	77	104 Å²	104	40%	0.395	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-42.5	176.2	-70.5	166.7	0	0	0	110.8	D81 M82 L88 K89	D81-I85 WeakPolarHBondContact O-CB 3.41Å; D81-I85 VanDerWaalsContact O-CG1 3.28Å; D81-I85 WeakPolarHBondContact O-CG1 3.43Å; D81-I85 PolarHBondContact O-N 3.14Å; M82-I85 PolarHBondContact O-N 3.34Å; I85-L88 PolarHBondContact O-N 2.92Å; I85-K89 HydrophobicContact CG2-CD 4.25Å; I85-K89 WeakPolarHBondContact O-CB 3.44Å; I85-K89 WeakPolarHBondContact O-CG 3.35Å; I85-K89 PolarHBondContact O-N 3.45Å
86	E	94.4	Very high	93.2	Very high	138 Å²	138	104.6 Å²	104.6	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-66.4	-41.5	179	-163.8	160.4	-149.1	0	0	111.5	M82 K83 K89 Q90	M82-E86 WeakPolarHBondContact O-CB 3.37Å; M82-E86 PolarHBondContact O-N 2.91Å; K83-E86 PolarHBondContact O-N 2.94Å; E86-K89 PolarHBondContact O-N 3.32Å; E86-Q90 WeakPolarHBondContact O-CB 3.47Å; E86-Q90 PolarHBondContact O-N 3.38Å
87	Q	95.2	Very high	93.6	Very high	117 Å²	117	103.7 Å²	103.7	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-43.9	171.2	-73.2	175.9	-14.4	0	0	112.3	K83 C84 K89 Q90 I91	K83-Q87 WeakPolarHBondContact O-CB 3.49Å; K83-Q87 VanDerWaalsContact O-CG 3.29Å; K83-Q87 WeakPolarHBondContact O-CG 3.33Å; K83-Q87 PolarHBondContact O-N 2.98Å; C84-Q87 PolarHBondContact O-N 2.87Å; Q87-K89 PolarHBondContact O-N 3.46Å; Q87-Q90 PolarHBondContact O-N 3.27Å; Q87-I91 VanDerWaalsContact O-CG1 3.3Å; Q87-I91 WeakPolarHBondContact O-CG1 3.31Å; Q87-I91 PolarHBondContact O-N 3.4Å
88	L	94.8	Very high	94	Very high	104 Å²	104	105.8 Å²	105.8	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.6	-101.2	150.9	0	0	0	112	C84 I85 Q90 I91 L92	C84-L88 WeakPolarHBondContact O-CB 3.29Å; C84-L88 PolarHBondContact O-N 3.43Å; I85-L88 PolarHBondContact O-N 2.92Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; L88-I91 PolarHBondContact O-N 3.28Å; L88-L92 WeakPolarHBondContact O-CB 3.3Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.46Å
89	K	95.5	Very high	94.4	Very high	128 Å²	128	103.9 Å²	103.9	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-62	-42.7	175.4	-76.5	176.4	179.9	179.7	0	111.5	I85 E86 Q87 L92 Q93	I85-K89 HydrophobicContact CG2-CD 4.25Å; I85-K89 WeakPolarHBondContact O-CB 3.44Å; I85-K89 WeakPolarHBondContact O-CG 3.35Å; I85-K89 PolarHBondContact O-N 3.45Å; E86-K89 PolarHBondContact O-N 3.32Å; Q87-K89 PolarHBondContact O-N 3.46Å; K89-L92 PolarHBondContact O-N 2.92Å; K89-Q93 WeakPolarHBondContact O-CB 3.37Å; K89-Q93 VanDerWaalsContact O-CG 3.32Å; K89-Q93 WeakPolarHBondContact O-CG 3.32Å; K89-Q93 PolarHBondContact O-N 3.29Å
90	Q	95.4	Very high	94.7	Very high	111 Å²	111	103.1 Å²	103.1	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-45.9	177.5	-172.3	174.8	-3.8	0	0	111.3	E86 Q87 L88 L92 Q93 E94	E86-Q90 WeakPolarHBondContact O-CB 3.47Å; E86-Q90 PolarHBondContact O-N 3.38Å; Q87-Q90 PolarHBondContact O-N 3.27Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; Q90-L92 PolarHBondContact O-N 2.94Å; Q90-Q93 PolarHBondContact O-N 3.5Å; Q90-E94 PolarHBondContact NE2-OE1 2.9Å; Q90-E94 WeakPolarHBondContact O-CG 3.49Å; Q90-E94 PolarHBondContact O-N 3.34Å
91	I	95.8	Very high	95	Very high	100 Å²	100	104 Å²	104	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-41.4	177	-67.9	165	0	0	0	111.4	Q87 L88 E94 Q95	Q87-I91 VanDerWaalsContact O-CG1 3.3Å; Q87-I91 WeakPolarHBondContact O-CG1 3.31Å; Q87-I91 PolarHBondContact O-N 3.4Å; L88-I91 PolarHBondContact O-N 3.28Å; I91-E94 PolarHBondContact O-N 3.31Å; I91-Q95 WeakPolarHBondContact O-CB 3.4Å; I91-Q95 PolarHBondContact O-N 2.95Å
92	L	96	Very high	95.3	Very high	86 Å²	86	103.2 Å²	103.2	45%	0.45	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176.3	-76.4	169.1	0	0	0	111.7	L88 K89 Q90 E94 Q95 D96	L88-L92 WeakPolarHBondContact O-CB 3.3Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.46Å; K89-L92 PolarHBondContact O-N 2.92Å; Q90-L92 PolarHBondContact O-N 2.94Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-E94 PolarHBondContact O-N 3.49Å; L92-Q95 PolarHBondContact O-N 2.9Å; L92-D96 PolarHBondContact O-N 2.86Å
93	Q	96	Very high	95.6	Very high	126 Å²	126	100.5 Å²	100.5	59%	0.589	50%	0.496	S	S	*	.	H	α-helix	trans	-62.8	-41	174.8	-74.5	175.6	-9.3	0	0	112.1	K89 Q90 D96 N97	K89-Q93 WeakPolarHBondContact O-CB 3.37Å; K89-Q93 VanDerWaalsContact O-CG 3.32Å; K89-Q93 WeakPolarHBondContact O-CG 3.32Å; K89-Q93 PolarHBondContact O-N 3.29Å; Q90-Q93 PolarHBondContact O-N 3.5Å; Q93-D96 PolarHBondContact O-N 2.88Å; Q93-N97 WeakPolarHBondContact O-CB 3.38Å; Q93-N97 PolarHBondContact O-N 3.31Å; Q93-N97 PolarHBondContact O-ND2 2.98Å; Q93-N97 VanDerWaalsContact O-ND2 3.17Å
94	E	96.2	Very high	95.8	Very high	96 Å²	96	101.1 Å²	101.1	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-41.7	174.9	-73.4	173.2	-168.5	0	0	111.7	Q90 I91 L92 N97 I98	Q90-E94 PolarHBondContact NE2-OE1 2.9Å; Q90-E94 WeakPolarHBondContact O-CG 3.49Å; Q90-E94 PolarHBondContact O-N 3.34Å; I91-E94 PolarHBondContact O-N 3.31Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-E94 PolarHBondContact O-N 3.49Å; E94-N97 PolarHBondContact O-N 2.95Å; E94-I98 VanDerWaalsContact O-CG1 3.29Å; E94-I98 WeakPolarHBondContact O-CG1 3.39Å; E94-I98 PolarHBondContact O-N 2.97Å
95	Q	95.8	Very high	96	Very high	119 Å²	119	103.9 Å²	103.9	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-62.1	-46.8	175.5	-176.7	-177	-8.7	0	0	111.6	I91 L92 N97 I98 Q99	I91-Q95 WeakPolarHBondContact O-CB 3.4Å; I91-Q95 PolarHBondContact O-N 2.95Å; L92-Q95 PolarHBondContact O-N 2.9Å; Q95-N97 VanDerWaalsContact C-N 3.32Å; Q95-N97 PolarHBondContact O-N 3.46Å; Q95-I98 PolarHBondContact O-N 3.3Å; Q95-Q99 WeakPolarHBondContact O-CB 3.29Å; Q95-Q99 PolarHBondContact O-N 3.17Å
96	D	96.5	Very high	96.1	Very high	97 Å²	97	105.4 Å²	105.4	52%	0.519	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-41.5	177.9	-72.7	-20.4	0	0	0	111.1	L92 Q93 Q99 L100	L92-D96 PolarHBondContact O-N 2.86Å; Q93-D96 PolarHBondContact O-N 2.88Å; D96-Q99 PolarHBondContact O-N 3.24Å; D96-L100 WeakPolarHBondContact O-CG 3.29Å; D96-L100 PolarHBondContact O-N 3.48Å
97	N	96.8	Very high	96.1	Very high	94 Å²	94	102.5 Å²	102.5	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-63.5	-43.8	176.2	-73.2	-24.9	0	0	0	112.4	Q93 E94 Q95 Q99 L100 Q101	Q93-N97 WeakPolarHBondContact O-CB 3.38Å; Q93-N97 PolarHBondContact O-N 3.31Å; Q93-N97 PolarHBondContact O-ND2 2.98Å; Q93-N97 VanDerWaalsContact O-ND2 3.17Å; E94-N97 PolarHBondContact O-N 2.95Å; Q95-N97 VanDerWaalsContact C-N 3.32Å; Q95-N97 PolarHBondContact O-N 3.46Å; N97-Q99 VanDerWaalsContact C-N 3.32Å; N97-L100 PolarHBondContact O-N 3.38Å; N97-Q101 WeakPolarHBondContact O-CG 3.4Å; N97-Q101 PolarHBondContact O-N 3.47Å
98	I	96.7	Very high	96.2	Very high	95 Å²	95	102.7 Å²	102.7	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.1	-69.6	166.7	0	0	0	110.4	E94 Q95 L100 Q101 I102	E94-I98 VanDerWaalsContact O-CG1 3.29Å; E94-I98 WeakPolarHBondContact O-CG1 3.39Å; E94-I98 PolarHBondContact O-N 2.97Å; Q95-I98 PolarHBondContact O-N 3.3Å; I98-L100 VanDerWaalsContact C-N 3.35Å; I98-L100 PolarHBondContact O-N 3.47Å; I98-Q101 PolarHBondContact O-N 2.89Å; I98-I102 HydrophobicContact CG2-CD1 3.78Å; I98-I102 HydrophobicContact CG2-CG1 4.31Å; I98-I102 VanDerWaalsContact O-CG1 3.29Å; I98-I102 WeakPolarHBondContact O-CG1 3.39Å; I98-I102 PolarHBondContact O-N 3.05Å
99	Q	96.3	Very high	96.2	Very high	88 Å²	88	99 Å²	99	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-42.4	178.4	-174	56.6	40.6	0	0	111.5	Q95 D96 N97 I102 D103	Q95-Q99 WeakPolarHBondContact O-CB 3.29Å; Q95-Q99 PolarHBondContact O-N 3.17Å; D96-Q99 PolarHBondContact O-N 3.24Å; N97-Q99 VanDerWaalsContact C-N 3.32Å; Q99-I102 PolarHBondContact O-N 2.99Å; Q99-D103 PolarHBondContact NE2-OD1 3.39Å; Q99-D103 PolarHBondContact NE2-OD2 2.9Å; Q99-D103 PolarHBondContact O-N 3.3Å
100	L	96.4	Very high	96.3	Very high	107 Å²	107	99.5 Å²	99.5	56%	0.56	49%	0.491	S	S	*	.	H	α-helix	trans	-59.6	-46	172.9	-72.5	172.8	0	0	0	111.8	D96 N97 I98 I102 D103 E104	D96-L100 WeakPolarHBondContact O-CG 3.29Å; D96-L100 PolarHBondContact O-N 3.48Å; N97-L100 PolarHBondContact O-N 3.38Å; I98-L100 VanDerWaalsContact C-N 3.35Å; I98-L100 PolarHBondContact O-N 3.47Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 2.9Å; L100-D103 PolarHBondContact O-N 2.87Å; L100-E104 WeakPolarHBondContact O-CG 3.34Å; L100-E104 PolarHBondContact O-N 3.44Å
101	Q	96.7	Very high	96.4	Very high	116 Å²	116	101 Å²	101	54%	0.542	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-40.3	176.8	-71.3	176.5	4.2	0	0	112.5	N97 I98 D103 E104 L105	N97-Q101 WeakPolarHBondContact O-CG 3.4Å; N97-Q101 PolarHBondContact O-N 3.47Å; I98-Q101 PolarHBondContact O-N 2.89Å; Q101-D103 VanDerWaalsContact C-N 3.31Å; Q101-D103 PolarHBondContact O-N 3.07Å; Q101-E104 PolarHBondContact O-N 3.41Å; Q101-L105 WeakPolarHBondContact O-CB 3.4Å; Q101-L105 VanDerWaalsContact O-CG 3.3Å; Q101-L105 WeakPolarHBondContact O-CG 3.3Å; Q101-L105 PolarHBondContact O-N 3.19Å
102	I	96	Very high	96.4	Very high	66 Å²	66	99.9 Å²	99.9	34%	0.338	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-43	175.6	-72.6	167.8	0	0	0	110.4	I98 Q99 L100 L105 K106	I98-I102 HydrophobicContact CG2-CD1 3.78Å; I98-I102 HydrophobicContact CG2-CG1 4.31Å; I98-I102 VanDerWaalsContact O-CG1 3.29Å; I98-I102 WeakPolarHBondContact O-CG1 3.39Å; I98-I102 PolarHBondContact O-N 3.05Å; Q99-I102 PolarHBondContact O-N 2.99Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 2.9Å; I102-L105 PolarHBondContact O-N 3.41Å; I102-K106 HydrophobicContact CG2-CD 4.23Å; I102-K106 VanDerWaalsContact O-CG 3.31Å; I102-K106 WeakPolarHBondContact O-CG 3.31Å; I102-K106 PolarHBondContact O-N 3.43Å
103	D	96.9	Very high	96.4	Very high	66 Å²	66	100.1 Å²	100.1	35%	0.353	49%	0.489	S	S	.	.	H	α-helix	trans	-72.3	-37.3	-178.8	-68.4	-28.6	0	0	0	111.6	Q99 L100 Q101 K106 T107	Q99-D103 PolarHBondContact NE2-OD1 3.39Å; Q99-D103 PolarHBondContact NE2-OD2 2.9Å; Q99-D103 PolarHBondContact O-N 3.3Å; L100-D103 PolarHBondContact O-N 2.87Å; Q101-D103 VanDerWaalsContact C-N 3.31Å; Q101-D103 PolarHBondContact O-N 3.07Å; D103-K106 PolarHBondContact O-N 2.93Å; D103-K106 IonicContact OD1-NZ 3.21Å; D103-K106 PolarHBondContact OD1-NZ 2.89Å; D103-T107 WeakPolarHBondContact O-CG2 3.4Å; D103-T107 PolarHBondContact O-N 2.73Å
104	E	96.5	Very high	96.4	Very high	129 Å²	129	97.9 Å²	97.9	60%	0.603	48%	0.481	S	S	*	.	H	α-helix	trans	-57.7	-49.2	168.4	-74.2	179.5	178.5	0	0	111.6	L100 Q101 K106 T107 Y108	L100-E104 WeakPolarHBondContact O-CG 3.34Å; L100-E104 PolarHBondContact O-N 3.44Å; Q101-E104 PolarHBondContact O-N 3.41Å; E104-K106 VanDerWaalsContact C-N 3.33Å; E104-K106 PolarHBondContact O-N 3.4Å; E104-T107 PolarHBondContact O-N 2.98Å; E104-T107 VanDerWaalsContact O-N 3.13Å; E104-T107 PolarHBondContact O-OG1 3.21Å; E104-Y108 PolarHBondContact O-N 2.82Å
105	L	96.3	Very high	96.4	Very high	121 Å²	121	97.3 Å²	97.3	63%	0.634	48%	0.478	S	S	*	.	H	α-helix	trans	-61.5	-39.1	177.1	-74.8	173.5	0	0	0	112.3	Q101 I102 Y108 G109	Q101-L105 WeakPolarHBondContact O-CB 3.4Å; Q101-L105 VanDerWaalsContact O-CG 3.3Å; Q101-L105 WeakPolarHBondContact O-CG 3.3Å; Q101-L105 PolarHBondContact O-N 3.19Å; I102-L105 PolarHBondContact O-N 3.41Å; L105-Y108 PolarHBondContact O-N 3.32Å; L105-G109 PolarHBondContact O-N 3.13Å
106	K	96.7	Very high	96.4	Very high	109 Å²	109	95.7 Å²	95.7	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-41.2	173.6	-75.5	171.4	-172.2	161.3	0	111.9	I102 D103 E104 Y108 G109 K110	I102-K106 HydrophobicContact CG2-CD 4.23Å; I102-K106 VanDerWaalsContact O-CG 3.31Å; I102-K106 WeakPolarHBondContact O-CG 3.31Å; I102-K106 PolarHBondContact O-N 3.43Å; D103-K106 PolarHBondContact O-N 2.93Å; D103-K106 IonicContact OD1-NZ 3.21Å; D103-K106 PolarHBondContact OD1-NZ 2.89Å; E104-K106 VanDerWaalsContact C-N 3.33Å; E104-K106 PolarHBondContact O-N 3.4Å; K106-Y108 VanDerWaalsContact C-N 3.32Å; K106-G109 PolarHBondContact O-N 3.04Å; K106-K110 VanDerWaalsContact O-CG 3.31Å; K106-K110 WeakPolarHBondContact O-CG 3.31Å; K106-K110 PolarHBondContact O-N 3.3Å
107	T	95.7	Very high	96.4	Very high	77 Å²	77	97.6 Å²	97.6	47%	0.472	47%	0.472	S	S	.	.	H	α-helix	trans	-66.8	-36.4	176.3	66.2	0	0	0	0	111.8	D103 E104 R111	D103-T107 WeakPolarHBondContact O-CG2 3.4Å; D103-T107 PolarHBondContact O-N 2.73Å; E104-T107 PolarHBondContact O-N 2.98Å; E104-T107 VanDerWaalsContact O-N 3.13Å; E104-T107 PolarHBondContact O-OG1 3.21Å; T107-R111 PolarHBondContact O-N 3.45Å
108	Y	96.4	Very high	96.4	Very high	121 Å²	121	98.6 Å²	98.6	48%	0.475	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-44.7	174	-177.2	-105.9	0	0	0	111.9	E104 L105 K106 K110 R111 L112	E104-Y108 PolarHBondContact O-N 2.82Å; L105-Y108 PolarHBondContact O-N 3.32Å; K106-Y108 VanDerWaalsContact C-N 3.32Å; Y108-K110 PolarHBondContact O-N 2.95Å; Y108-R111 WeakPolarHBondContact O-CB 3.35Å; Y108-R111 PolarHBondContact O-N 3.09Å; Y108-R111 VanDerWaalsContact O-N 3.09Å; Y108-L112 HydrophobicContact CD1-CD1 3.96Å; Y108-L112 HydrophobicContact CD1-CG 4.43Å; Y108-L112 HydrophobicContact CE1-CD1 3.38Å; Y108-L112 HydrophobicContact CE1-CG 4.03Å; Y108-L112 PolarHBondContact O-N 3.48Å
109	G	96.2	Very high	96.3	Very high	26 Å²	26	98.5 Å²	98.5	27%	0.268	47%	0.472	S	S	.	.	H	α-helix	trans	-57.6	-48.1	173.9	0	0	0	0	0	112.2	L105 K106 R111 L112 D113	L105-G109 PolarHBondContact O-N 3.13Å; K106-G109 PolarHBondContact O-N 3.04Å; G109-R111 VanDerWaalsContact C-N 3.25Å; G109-R111 PolarHBondContact O-N 3.12Å; G109-L112 PolarHBondContact O-N 3Å; G109-L112 VanDerWaalsContact O-N 3.12Å; G109-D113 PolarHBondContact O-N 3.27Å
110	K	96.9	Very high	96.2	Very high	139 Å²	139	99.1 Å²	99.1	60%	0.604	48%	0.475	S	S	*	.	H	α-helix	trans	-58.8	-35.8	174.2	-72.1	175.1	-176.5	179.7	0	112.8	K106 Y108 N114	K106-K110 VanDerWaalsContact O-CG 3.31Å; K106-K110 WeakPolarHBondContact O-CG 3.31Å; K106-K110 PolarHBondContact O-N 3.3Å; Y108-K110 PolarHBondContact O-N 2.95Å; K110-N114 VanDerWaalsContact O-CG 3.29Å; K110-N114 PolarHBondContact O-N 3.08Å; K110-N114 VanDerWaalsContact O-N 3.15Å; K110-N114 PolarHBondContact O-ND2 2.86Å
111	R	96.9	Very high	96.2	Very high	144 Å²	144	98.4 Å²	98.4	54%	0.543	47%	0.471	S	S	.	.	H	α-helix	trans	-66.6	-46	176	-170.7	-176.5	-63.2	128.4	2.7	110.7	T107 Y108 G109 N114 E115	T107-R111 PolarHBondContact O-N 3.45Å; Y108-R111 WeakPolarHBondContact O-CB 3.35Å; Y108-R111 PolarHBondContact O-N 3.09Å; Y108-R111 VanDerWaalsContact O-N 3.09Å; G109-R111 VanDerWaalsContact C-N 3.25Å; G109-R111 PolarHBondContact O-N 3.12Å; R111-N114 PolarHBondContact O-N 3.3Å; R111-E115 PolarHBondContact O-N 3.09Å; R111-E115 VanDerWaalsContact O-N 3.09Å
112	L	96.2	Very high	96.1	Very high	75 Å²	75	97.6 Å²	97.6	39%	0.393	47%	0.47	S	S	.	.	H	α-helix	trans	-63	-43.2	176	-69.9	179.7	0	0	0	112.1	Y108 G109 N114 E115 I116	Y108-L112 HydrophobicContact CD1-CD1 3.96Å; Y108-L112 HydrophobicContact CD1-CG 4.43Å; Y108-L112 HydrophobicContact CE1-CD1 3.38Å; Y108-L112 HydrophobicContact CE1-CG 4.03Å; Y108-L112 PolarHBondContact O-N 3.48Å; G109-L112 PolarHBondContact O-N 3Å; G109-L112 VanDerWaalsContact O-N 3.12Å; L112-N114 PolarHBondContact O-N 3.44Å; L112-E115 PolarHBondContact O-N 2.8Å; L112-E115 VanDerWaalsContact O-N 3.08Å; L112-I116 VanDerWaalsContact O-CG1 3.31Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.32Å
113	D	96.4	Very high	96	Very high	91 Å²	91	98.3 Å²	98.3	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-36.7	176.7	-69.9	-25.8	0	0	0	112.2	G109 R117	G109-D113 PolarHBondContact O-N 3.27Å; D113-R117 WeakPolarHBondContact O-CB 3.31Å; D113-R117 PolarHBondContact O-N 3.15Å
114	N	96.1	Very high	95.9	Very high	79 Å²	79	100.3 Å²	100.3	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-68.6	-39.8	174.7	-74.9	-25	0	0	0	112.1	K110 R111 L112 K118	K110-N114 VanDerWaalsContact O-CG 3.29Å; K110-N114 PolarHBondContact O-N 3.08Å; K110-N114 VanDerWaalsContact O-N 3.15Å; K110-N114 PolarHBondContact O-ND2 2.86Å; R111-N114 PolarHBondContact O-N 3.3Å; L112-N114 PolarHBondContact O-N 3.44Å; N114-K118 WeakPolarHBondContact O-CG 3.48Å; N114-K118 PolarHBondContact O-N 3.47Å
115	E	96.3	Very high	95.7	Very high	84 Å²	84	99.4 Å²	99.4	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-68.6	-41.3	175.5	-67.2	-52.3	134.4	0	0	112.1	R111 L112 R117 K118 I119	R111-E115 PolarHBondContact O-N 3.09Å; R111-E115 VanDerWaalsContact O-N 3.09Å; L112-E115 PolarHBondContact O-N 2.8Å; L112-E115 VanDerWaalsContact O-N 3.08Å; E115-R117 VanDerWaalsContact C-N 3.32Å; E115-R117 PolarHBondContact O-N 3.27Å; E115-K118 WeakPolarHBondContact O-CB 3.33Å; E115-K118 PolarHBondContact O-N 2.81Å; E115-K118 IonicContact OE1-NZ 3.75Å; E115-K118 PolarHBondContact OE1-NZ 3.22Å; E115-K118 IonicContact OE2-NZ 2.67Å; E115-I119 WeakPolarHBondContact O-CG1 3.32Å; E115-I119 PolarHBondContact O-N 3.07Å
116	I	95.2	Very high	95.6	Very high	85 Å²	85	101.2 Å²	101.2	44%	0.436	48%	0.479	S	S	.	.	H	α-helix	trans	-58.1	-47.7	174	-70	167.2	0	0	0	109.6	L112 K118 I119 E120	L112-I116 VanDerWaalsContact O-CG1 3.31Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.32Å; I116-K118 VanDerWaalsContact C-N 3.33Å; I116-K118 PolarHBondContact O-N 3.11Å; I116-I119 PolarHBondContact O-N 2.72Å; I116-I119 VanDerWaalsContact O-N 3.11Å; I116-E120 HydrophobicContact CG2-CG 4.24Å; I116-E120 WeakPolarHBondContact O-CG 3.47Å; I116-E120 PolarHBondContact O-N 2.88Å
117	R	96.6	Very high	95.4	Very high	138 Å²	138	101.4 Å²	101.4	52%	0.521	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-38.7	178.4	-164.3	-176.8	-48.9	166.3	10.9	113	D113 E115 I119 E120 N121	D113-R117 WeakPolarHBondContact O-CB 3.31Å; D113-R117 PolarHBondContact O-N 3.15Å; E115-R117 VanDerWaalsContact C-N 3.32Å; E115-R117 PolarHBondContact O-N 3.27Å; R117-I119 VanDerWaalsContact C-N 3.35Å; R117-E120 PolarHBondContact O-N 3.46Å; R117-N121 WeakPolarHBondContact O-CB 3.37Å; R117-N121 PolarHBondContact O-N 3.2Å; R117-N121 PolarHBondContact O-ND2 3.44Å
118	K	96	Very high	95.2	Very high	114 Å²	114	103.7 Å²	103.7	50%	0.496	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-44.9	173.8	-72.9	171.1	-172.8	172.5	0	110.9	N114 E115 I116 N121 L122	N114-K118 WeakPolarHBondContact O-CG 3.48Å; N114-K118 PolarHBondContact O-N 3.47Å; E115-K118 WeakPolarHBondContact O-CB 3.33Å; E115-K118 PolarHBondContact O-N 2.81Å; E115-K118 IonicContact OE1-NZ 3.75Å; E115-K118 PolarHBondContact OE1-NZ 3.22Å; E115-K118 IonicContact OE2-NZ 2.67Å; I116-K118 VanDerWaalsContact C-N 3.33Å; I116-K118 PolarHBondContact O-N 3.11Å; K118-N121 PolarHBondContact O-N 2.98Å; K118-L122 WeakPolarHBondContact O-CG 3.31Å; K118-L122 PolarHBondContact O-N 3.37Å; K118-L122 VanDerWaalsContact O-N 3.09Å
119	I	95	Very high	95	Very high	94 Å²	94	102.3 Å²	102.3	48%	0.482	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-42.7	178.6	-67.1	169.1	0	0	0	111	E115 I116 R117 N121 L122 I123	E115-I119 WeakPolarHBondContact O-CG1 3.32Å; E115-I119 PolarHBondContact O-N 3.07Å; I116-I119 PolarHBondContact O-N 2.72Å; I116-I119 VanDerWaalsContact O-N 3.11Å; R117-I119 VanDerWaalsContact C-N 3.35Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 3.39Å; I119-L122 PolarHBondContact O-N 3Å; I119-I123 HydrophobicContact CG2-CD1 3.82Å; I119-I123 HydrophobicContact CG2-CG1 4.36Å; I119-I123 VanDerWaalsContact O-CG1 3.31Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 3.42Å
120	E	95.1	Very high	94.6	Very high	101 Å²	101	109.9 Å²	109.9	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-59.2	-43.6	175.7	-74.1	174.5	161.4	0	0	111.9	I116 R117 L122 I123 Q124	I116-E120 HydrophobicContact CG2-CG 4.24Å; I116-E120 WeakPolarHBondContact O-CG 3.47Å; I116-E120 PolarHBondContact O-N 2.88Å; R117-E120 PolarHBondContact O-N 3.46Å; E120-L122 PolarHBondContact O-N 3.22Å; E120-I123 PolarHBondContact O-N 2.92Å; E120-Q124 WeakPolarHBondContact O-CG 3.45Å; E120-Q124 PolarHBondContact O-N 2.95Å
121	N	95.7	Very high	94.2	Very high	91 Å²	91	108.7 Å²	108.7	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-43.7	175.4	-71	-15.9	0	0	0	111.7	R117 K118 I119 I123 Q124 E125	R117-N121 WeakPolarHBondContact O-CB 3.37Å; R117-N121 PolarHBondContact O-N 3.2Å; R117-N121 PolarHBondContact O-ND2 3.44Å; K118-N121 PolarHBondContact O-N 2.98Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 3.39Å; N121-I123 VanDerWaalsContact C-N 3.33Å; N121-I123 PolarHBondContact O-N 3.25Å; N121-Q124 PolarHBondContact O-N 3.31Å; N121-E125 PolarHBondContact O-N 3.47Å
122	L	95.7	Very high	93.8	Very high	99 Å²	99	106.4 Å²	106.4	52%	0.518	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-36.9	176	-69.9	172	0	0	0	112.3	K118 I119 E120 K126	K118-L122 WeakPolarHBondContact O-CG 3.31Å; K118-L122 PolarHBondContact O-N 3.37Å; K118-L122 VanDerWaalsContact O-N 3.09Å; I119-L122 PolarHBondContact O-N 3Å; E120-L122 PolarHBondContact O-N 3.22Å; L122-K126 WeakPolarHBondContact O-CB 3.36Å; L122-K126 WeakPolarHBondContact O-CG 3.43Å; L122-K126 PolarHBondContact O-N 3.09Å
123	I	93.6	Very high	93.4	Very high	82 Å²	82	107.6 Å²	107.6	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-45.6	175.5	-70.7	168.1	0	0	0	110.1	I119 E120 N121 K126 Q127	I119-I123 HydrophobicContact CG2-CD1 3.82Å; I119-I123 HydrophobicContact CG2-CG1 4.36Å; I119-I123 VanDerWaalsContact O-CG1 3.31Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 3.42Å; E120-I123 PolarHBondContact O-N 2.92Å; N121-I123 VanDerWaalsContact C-N 3.33Å; N121-I123 PolarHBondContact O-N 3.25Å; I123-K126 PolarHBondContact O-N 2.89Å; I123-Q127 HydrophobicContact CG2-CG 4.38Å; I123-Q127 WeakPolarHBondContact O-CB 3.48Å; I123-Q127 VanDerWaalsContact O-CG 3.27Å; I123-Q127 WeakPolarHBondContact O-CG 3.37Å; I123-Q127 PolarHBondContact O-N 3.35Å
124	Q	93.8	Very high	93	Very high	108 Å²	108	106.3 Å²	106.3	51%	0.505	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-44	177.8	-72	177.7	11.3	0	0	111.7	E120 N121 Q127 Q128	E120-Q124 WeakPolarHBondContact O-CG 3.45Å; E120-Q124 PolarHBondContact O-N 2.95Å; N121-Q124 PolarHBondContact O-N 3.31Å; Q124-Q127 PolarHBondContact O-N 2.9Å; Q124-Q128 WeakPolarHBondContact O-CG 3.27Å; Q124-Q128 PolarHBondContact O-N 3.03Å
125	E	93.8	Very high	92.5	Very high	109 Å²	109	109.1 Å²	109.1	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-59.8	-48.1	175.9	-172.7	-176.7	171.5	0	0	111.3	N121 Q127 Q128 I129	N121-E125 PolarHBondContact O-N 3.47Å; E125-Q127 VanDerWaalsContact C-N 3.32Å; E125-Q127 PolarHBondContact O-N 3.25Å; E125-Q128 PolarHBondContact O-N 2.95Å; E125-I129 HydrophobicContact CG-CD1 4.12Å; E125-I129 WeakPolarHBondContact O-CG1 3.4Å; E125-I129 PolarHBondContact O-N 3.34Å
126	K	93	Very high	92	Very high	159 Å²	159	111.1 Å²	111.1	69%	0.691	52%	0.52	S	S	*	.	H	α-helix	trans	-62.2	-37.4	176.2	-77.2	-170.3	176	-174.5	0	112.9	L122 I123 R130	L122-K126 WeakPolarHBondContact O-CB 3.36Å; L122-K126 WeakPolarHBondContact O-CG 3.43Å; L122-K126 PolarHBondContact O-N 3.09Å; I123-K126 PolarHBondContact O-N 2.89Å; K126-R130 WeakPolarHBondContact O-CB 3.35Å; K126-R130 PolarHBondContact O-N 3.46Å
127	Q	92.6	Very high	91.5	Very high	114 Å²	114	111.8 Å²	111.8	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-65.9	-41.7	175.7	-75.4	175	-1.4	0	0	111.5	I123 Q124 E125 R130 L131	I123-Q127 HydrophobicContact CG2-CG 4.38Å; I123-Q127 WeakPolarHBondContact O-CB 3.48Å; I123-Q127 VanDerWaalsContact O-CG 3.27Å; I123-Q127 WeakPolarHBondContact O-CG 3.37Å; I123-Q127 PolarHBondContact O-N 3.35Å; Q124-Q127 PolarHBondContact O-N 2.9Å; E125-Q127 VanDerWaalsContact C-N 3.32Å; E125-Q127 PolarHBondContact O-N 3.25Å; Q127-R130 PolarHBondContact O-N 2.93Å; Q127-L131 WeakPolarHBondContact O-CG 3.35Å; Q127-L131 PolarHBondContact O-N 2.86Å
128	Q	92.4	Very high	91	Very high	125 Å²	125	108.8 Å²	108.8	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-62.8	-46.1	175.1	-72.2	-178	6.7	0	0	111.8	Q124 E125 R130 L131 I132	Q124-Q128 WeakPolarHBondContact O-CG 3.27Å; Q124-Q128 PolarHBondContact O-N 3.03Å; E125-Q128 PolarHBondContact O-N 2.95Å; Q128-R130 VanDerWaalsContact C-N 3.32Å; Q128-R130 PolarHBondContact O-N 3.02Å; Q128-L131 PolarHBondContact O-N 3.38Å; Q128-I132 WeakPolarHBondContact O-CG1 3.34Å; Q128-I132 PolarHBondContact O-N 3.22Å
129	I	90.5	Very high	90.6	Very high	91 Å²	91	108.9 Å²	108.9	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-58.1	-45.8	175.5	-67.3	166.6	0	0	0	110.4	E125 L131 I132 Q133	E125-I129 HydrophobicContact CG-CD1 4.12Å; E125-I129 WeakPolarHBondContact O-CG1 3.4Å; E125-I129 PolarHBondContact O-N 3.34Å; I129-L131 PolarHBondContact O-N 3.42Å; I129-I132 PolarHBondContact O-N 3.38Å; I129-Q133 WeakPolarHBondContact O-CB 3.36Å; I129-Q133 PolarHBondContact O-N 2.95Å
130	R	89.6	Confident	90.2	Very high	185 Å²	185	108.4 Å²	108.4	70%	0.698	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-40.4	178.6	-172.7	178.2	-178.3	-179.7	1.3	112.6	K126 Q127 Q128 Q133 T134	K126-R130 WeakPolarHBondContact O-CB 3.35Å; K126-R130 PolarHBondContact O-N 3.46Å; Q127-R130 PolarHBondContact O-N 2.93Å; Q128-R130 VanDerWaalsContact C-N 3.32Å; Q128-R130 PolarHBondContact O-N 3.02Å; R130-Q133 PolarHBondContact O-N 2.7Å; R130-T134 WeakPolarHBondContact O-CB 3.44Å; R130-T134 PolarHBondContact O-N 3.38Å; R130-T134 PolarHBondContact O-OG1 2.88Å
131	L	87.6	Confident	89.9	Confident	115 Å²	115	105.9 Å²	105.9	60%	0.602	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-42.9	175.8	-76	171.8	0	0	0	111.5	Q127 Q128 I129 K135	Q127-L131 WeakPolarHBondContact O-CG 3.35Å; Q127-L131 PolarHBondContact O-N 2.86Å; Q128-L131 PolarHBondContact O-N 3.38Å; I129-L131 PolarHBondContact O-N 3.42Å; L131-K135 WeakPolarHBondContact O-CG 3.43Å; L131-K135 PolarHBondContact O-N 2.82Å; L131-K135 VanDerWaalsContact O-N 3.12Å
132	I	89.4	Confident	89.6	Confident	95 Å²	95	107.3 Å²	107.3	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-43.3	176.4	-65.4	164.7	0	0	0	110.5	Q128 I129 K135 K136	Q128-I132 WeakPolarHBondContact O-CG1 3.34Å; Q128-I132 PolarHBondContact O-N 3.22Å; I129-I132 PolarHBondContact O-N 3.38Å; I132-K135 PolarHBondContact O-N 3.16Å; I132-K136 HydrophobicContact CG2-CD 4.37Å; I132-K136 WeakPolarHBondContact O-CG 3.41Å; I132-K136 PolarHBondContact O-N 2.84Å
133	Q	87.7	Confident	89.4	Confident	100 Å²	100	107.4 Å²	107.4	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-62.6	-45.7	178	179.7	173.3	-3.1	0	0	111.6	I129 R130 K135 K136 E137	I129-Q133 WeakPolarHBondContact O-CB 3.36Å; I129-Q133 PolarHBondContact O-N 2.95Å; R130-Q133 PolarHBondContact O-N 2.7Å; Q133-K135 VanDerWaalsContact C-N 3.31Å; Q133-K135 PolarHBondContact O-N 3.27Å; Q133-K136 PolarHBondContact O-N 3.2Å; Q133-K136 VanDerWaalsContact O-N 3.16Å; Q133-E137 HydrophobicContact CG-CG 4.37Å; Q133-E137 VanDerWaalsContact CG-OE1 3.26Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.43Å; Q133-E137 PolarHBondContact NE2-OE1 2.72Å; Q133-E137 WeakPolarHBondContact O-CB 3.37Å; Q133-E137 WeakPolarHBondContact O-CG 3.34Å; Q133-E137 PolarHBondContact O-N 2.97Å
134	T	86.9	Confident	89.4	Confident	64 Å²	64	109.7 Å²	109.7	39%	0.393	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-40.9	178.9	-50.1	0	0	0	0	110.9	R130 E137 T138	R130-T134 WeakPolarHBondContact O-CB 3.44Å; R130-T134 PolarHBondContact O-N 3.38Å; R130-T134 PolarHBondContact O-OG1 2.88Å; T134-E137 PolarHBondContact O-N 3.39Å; T134-T138 WeakPolarHBondContact O-CG2 3.34Å; T134-T138 PolarHBondContact O-N 3.12Å; T134-T138 PolarHBondContact O-OG1 3.01Å
135	K	86.2	Confident	89.4	Confident	138 Å²	138	108.5 Å²	108.5	60%	0.6	53%	0.526	S	S	*	.	H	α-helix	trans	-62.4	-45.4	174.2	-74.6	-178.5	177.8	-173.4	0	112.3	L131 I132 Q133 E137 T138 E139	L131-K135 WeakPolarHBondContact O-CG 3.43Å; L131-K135 PolarHBondContact O-N 2.82Å; L131-K135 VanDerWaalsContact O-N 3.12Å; I132-K135 PolarHBondContact O-N 3.16Å; Q133-K135 VanDerWaalsContact C-N 3.31Å; Q133-K135 PolarHBondContact O-N 3.27Å; K135-E137 PolarHBondContact O-N 3.38Å; K135-T138 WeakPolarHBondContact CA-OG1 3.39Å; K135-T138 PolarHBondContact O-N 3.48Å; K135-T138 PolarHBondContact O-OG1 3.07Å; K135-E139 WeakPolarHBondContact O-CG 3.41Å; K135-E139 PolarHBondContact O-N 2.84Å
136	K	85.1	Confident	89.4	Confident	126 Å²	126	108.1 Å²	108.1	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-42.3	176	-72.8	-178.3	178.4	-175.5	0	111.7	I132 Q133 T138 E139 T140	I132-K136 HydrophobicContact CG2-CD 4.37Å; I132-K136 WeakPolarHBondContact O-CG 3.41Å; I132-K136 PolarHBondContact O-N 2.84Å; Q133-K136 PolarHBondContact O-N 3.2Å; Q133-K136 VanDerWaalsContact O-N 3.16Å; K136-T138 VanDerWaalsContact C-N 3.35Å; K136-T138 PolarHBondContact O-N 3.3Å; K136-E139 PolarHBondContact O-N 3.49Å; K136-T140 WeakPolarHBondContact O-CB 3.49Å; K136-T140 WeakPolarHBondContact O-CG2 3.38Å; K136-T140 PolarHBondContact O-N 2.95Å; K136-T140 PolarHBondContact O-OG1 3.29Å; K136-T140 VanDerWaalsContact O-OG1 3.07Å
137	E	86	Confident	89.5	Confident	100 Å²	100	105.8 Å²	105.8	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-59.8	-44.9	175.8	-75.2	170.3	-172.1	0	0	111	Q133 T134 K135 T140 A141	Q133-E137 HydrophobicContact CG-CG 4.37Å; Q133-E137 VanDerWaalsContact CG-OE1 3.26Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.43Å; Q133-E137 PolarHBondContact NE2-OE1 2.72Å; Q133-E137 WeakPolarHBondContact O-CB 3.37Å; Q133-E137 WeakPolarHBondContact O-CG 3.34Å; Q133-E137 PolarHBondContact O-N 2.97Å; T134-E137 PolarHBondContact O-N 3.39Å; K135-E137 PolarHBondContact O-N 3.38Å; E137-T140 WeakPolarHBondContact CA-OG1 3.26Å; E137-T140 PolarHBondContact O-N 3.46Å; E137-T140 PolarHBondContact O-OG1 3.33Å; E137-A141 WeakPolarHBondContact O-CB 3.4Å; E137-A141 PolarHBondContact O-N 2.93Å
138	T	84.7	Confident	89.6	Confident	75 Å²	75	105 Å²	105	46%	0.46	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.5	51.5	0	0	0	0	112.8	T134 K135 K136 T140 A141 E142	T134-T138 WeakPolarHBondContact O-CG2 3.34Å; T134-T138 PolarHBondContact O-N 3.12Å; T134-T138 PolarHBondContact O-OG1 3.01Å; K135-T138 WeakPolarHBondContact CA-OG1 3.39Å; K135-T138 PolarHBondContact O-N 3.48Å; K135-T138 PolarHBondContact O-OG1 3.07Å; K136-T138 VanDerWaalsContact C-N 3.35Å; K136-T138 PolarHBondContact O-N 3.3Å; T138-T140 PolarHBondContact O-N 2.89Å; T138-A141 PolarHBondContact O-N 2.81Å; T138-E142 WeakPolarHBondContact O-CG 3.2Å; T138-E142 PolarHBondContact O-N 3.38Å
139	E	87.3	Confident	89.7	Confident	115 Å²	115	105.5 Å²	105.5	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.8	-72.4	168.8	-170.8	0	0	111.2	K135 K136 E142 L143	K135-E139 WeakPolarHBondContact O-CG 3.41Å; K135-E139 PolarHBondContact O-N 2.84Å; K136-E139 PolarHBondContact O-N 3.49Å; E139-E142 PolarHBondContact O-N 3.34Å; E139-L143 WeakPolarHBondContact O-CB 3.31Å; E139-L143 VanDerWaalsContact O-CG 3.29Å; E139-L143 WeakPolarHBondContact O-CG 3.38Å; E139-L143 PolarHBondContact O-N 3.32Å
140	T	88	Confident	89.9	Confident	85 Å²	85	107.9 Å²	107.9	52%	0.521	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-37.4	177.1	59.2	0	0	0	0	112.5	K136 E137 T138 L143 K144	K136-T140 WeakPolarHBondContact O-CB 3.49Å; K136-T140 WeakPolarHBondContact O-CG2 3.38Å; K136-T140 PolarHBondContact O-N 2.95Å; K136-T140 PolarHBondContact O-OG1 3.29Å; K136-T140 VanDerWaalsContact O-OG1 3.07Å; E137-T140 WeakPolarHBondContact CA-OG1 3.26Å; E137-T140 PolarHBondContact O-N 3.46Å; E137-T140 PolarHBondContact O-OG1 3.33Å; T138-T140 PolarHBondContact O-N 2.89Å; T140-L143 PolarHBondContact O-N 2.86Å; T140-K144 WeakPolarHBondContact O-CB 3.33Å; T140-K144 PolarHBondContact O-N 3.45Å
141	A	88.4	Confident	90.2	Very high	47 Å²	47	103.4 Å²	103.4	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-42.2	175.8	0	0	0	0	0	111.4	E137 T138 K144 I145	E137-A141 WeakPolarHBondContact O-CB 3.4Å; E137-A141 PolarHBondContact O-N 2.93Å; T138-A141 PolarHBondContact O-N 2.81Å; A141-K144 PolarHBondContact O-N 2.94Å; A141-I145 VanDerWaalsContact O-CG1 3.31Å; A141-I145 WeakPolarHBondContact O-CG1 3.46Å; A141-I145 PolarHBondContact O-N 2.97Å
142	E	90.3	Very high	90.6	Very high	122 Å²	122	102.4 Å²	102.4	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-44.8	174.2	-73.8	179.7	-175.9	0	0	112	T138 E139 K144 I145 Q146	T138-E142 WeakPolarHBondContact O-CG 3.2Å; T138-E142 PolarHBondContact O-N 3.38Å; E139-E142 PolarHBondContact O-N 3.34Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 3.48Å; E142-I145 PolarHBondContact O-N 3.42Å; E142-Q146 WeakPolarHBondContact O-CG 3.46Å; E142-Q146 PolarHBondContact O-N 2.96Å
143	L	91.2	Very high	90.9	Very high	101 Å²	101	103.5 Å²	103.5	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-60.8	-42.3	174.5	-73.4	174.4	0	0	0	111.6	E139 T140 Q146 I147	E139-L143 WeakPolarHBondContact O-CB 3.31Å; E139-L143 VanDerWaalsContact O-CG 3.29Å; E139-L143 WeakPolarHBondContact O-CG 3.38Å; E139-L143 PolarHBondContact O-N 3.32Å; T140-L143 PolarHBondContact O-N 2.86Å; L143-Q146 PolarHBondContact O-N 3.24Å; L143-I147 VanDerWaalsContact O-CG1 3.29Å; L143-I147 WeakPolarHBondContact O-CG1 3.29Å; L143-I147 PolarHBondContact O-N 3.43Å
144	K	93.2	Very high	91.3	Very high	129 Å²	129	105.1 Å²	105.1	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-59.7	-48.3	176	-173.6	-177.8	178.5	-170	0	111.3	T140 A141 E142 Q146 I147 E148	T140-K144 WeakPolarHBondContact O-CB 3.33Å; T140-K144 PolarHBondContact O-N 3.45Å; A141-K144 PolarHBondContact O-N 2.94Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 3.48Å; K144-Q146 VanDerWaalsContact C-N 3.3Å; K144-Q146 PolarHBondContact O-N 3.25Å; K144-I147 PolarHBondContact O-N 3.14Å; K144-I147 VanDerWaalsContact O-N 3.14Å; K144-E148 WeakPolarHBondContact CE-OE1 3.32Å; K144-E148 IonicContact NZ-OE1 3.19Å; K144-E148 WeakPolarHBondContact O-CG 3.16Å; K144-E148 PolarHBondContact O-N 3.43Å
145	I	94.1	Very high	91.7	Very high	83 Å²	83	107 Å²	107	43%	0.426	53%	0.525	S	S	.	.	H	α-helix	trans	-60.8	-39.6	177	-68.8	164.1	0	0	0	111.2	A141 E142 K149	A141-I145 VanDerWaalsContact O-CG1 3.31Å; A141-I145 WeakPolarHBondContact O-CG1 3.46Å; A141-I145 PolarHBondContact O-N 2.97Å; E142-I145 PolarHBondContact O-N 3.42Å; I145-K149 HydrophobicContact CG2-CD 4.28Å; I145-K149 WeakPolarHBondContact O-CB 3.41Å; I145-K149 VanDerWaalsContact O-CG 3.32Å; I145-K149 WeakPolarHBondContact O-CG 3.48Å; I145-K149 PolarHBondContact O-N 2.81Å
146	Q	94.1	Very high	92.2	Very high	102 Å²	102	105 Å²	105	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-39.4	175.9	-72.6	-177.1	32.2	0	0	112.4	E142 L143 K144 K150	E142-Q146 WeakPolarHBondContact O-CG 3.46Å; E142-Q146 PolarHBondContact O-N 2.96Å; L143-Q146 PolarHBondContact O-N 3.24Å; K144-Q146 VanDerWaalsContact C-N 3.3Å; K144-Q146 PolarHBondContact O-N 3.25Å; Q146-K150 WeakPolarHBondContact O-CG 3.42Å; Q146-K150 PolarHBondContact O-N 3.43Å
147	I	93.8	Very high	92.8	Very high	110 Å²	110	102.9 Å²	102.9	56%	0.564	52%	0.515	S	S	*	.	H	α-helix	trans	-64.6	-47.5	175.6	-69.8	166	0	0	0	110.1	L143 K144 K149 K150 L151	L143-I147 VanDerWaalsContact O-CG1 3.29Å; L143-I147 WeakPolarHBondContact O-CG1 3.29Å; L143-I147 PolarHBondContact O-N 3.43Å; K144-I147 PolarHBondContact O-N 3.14Å; K144-I147 VanDerWaalsContact O-N 3.14Å; I147-K149 VanDerWaalsContact C-N 3.33Å; I147-K149 PolarHBondContact O-N 2.85Å; I147-K150 PolarHBondContact O-N 2.78Å; I147-K150 VanDerWaalsContact O-N 3.14Å; I147-L151 WeakPolarHBondContact O-CB 3.29Å; I147-L151 PolarHBondContact O-N 3.27Å
148	E	94.8	Very high	93.3	Very high	98 Å²	98	103.8 Å²	103.8	46%	0.458	52%	0.523	S	S	.	.	H	α-helix	trans	-58.9	-42.6	177.2	-73.6	172.3	178.5	0	0	111.8	K144 L151 L152	K144-E148 WeakPolarHBondContact CE-OE1 3.32Å; K144-E148 IonicContact NZ-OE1 3.19Å; K144-E148 WeakPolarHBondContact O-CG 3.16Å; K144-E148 PolarHBondContact O-N 3.43Å; E148-L151 PolarHBondContact O-N 2.79Å; E148-L152 WeakPolarHBondContact O-CB 3.33Å; E148-L152 PolarHBondContact O-N 3.4Å
149	K	95.4	Very high	93.9	Very high	134 Å²	134	105.6 Å²	105.6	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-62	-43.9	174.2	-75.6	176.8	179.4	179.8	0	112.4	I145 I147 L151 L152 I153	I145-K149 HydrophobicContact CG2-CD 4.28Å; I145-K149 WeakPolarHBondContact O-CB 3.41Å; I145-K149 VanDerWaalsContact O-CG 3.32Å; I145-K149 WeakPolarHBondContact O-CG 3.48Å; I145-K149 PolarHBondContact O-N 2.81Å; I147-K149 VanDerWaalsContact C-N 3.33Å; I147-K149 PolarHBondContact O-N 2.85Å; K149-L151 VanDerWaalsContact C-N 3.34Å; K149-L152 PolarHBondContact O-N 3.14Å; K149-I153 WeakPolarHBondContact O-CD1 3.49Å; K149-I153 VanDerWaalsContact O-CG1 3.26Å; K149-I153 WeakPolarHBondContact O-CG1 3.37Å; K149-I153 PolarHBondContact O-N 2.92Å; K149-I153 VanDerWaalsContact O-N 3.07Å
150	K	95.2	Very high	94.4	Very high	141 Å²	141	104.3 Å²	104.3	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-64.6	-40.1	176.7	-76.3	178.4	178.9	177.4	0	111.6	Q146 I147 I153 M154	Q146-K150 WeakPolarHBondContact O-CG 3.42Å; Q146-K150 PolarHBondContact O-N 3.43Å; I147-K150 PolarHBondContact O-N 2.78Å; I147-K150 VanDerWaalsContact O-N 3.14Å; K150-I153 PolarHBondContact O-N 3.37Å; K150-M154 WeakPolarHBondContact O-CB 3.44Å; K150-M154 PolarHBondContact O-N 2.88Å
151	L	94.7	Very high	94.8	Very high	91 Å²	91	105.8 Å²	105.8	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-49.4	176.8	-176.8	136.2	0	0	0	110.5	I147 E148 K149 I153 M154 E155	I147-L151 WeakPolarHBondContact O-CB 3.29Å; I147-L151 PolarHBondContact O-N 3.27Å; E148-L151 PolarHBondContact O-N 2.79Å; K149-L151 VanDerWaalsContact C-N 3.34Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.09Å; L151-M154 CarbonylContact O-C 3.54Å; L151-M154 WeakPolarHBondContact O-CB 3.38Å; L151-M154 PolarHBondContact O-N 2.98Å; L151-E155 VanDerWaalsContact CD2-CD 3.46Å; L151-E155 HydrophobicContact CD2-CG 4.31Å; L151-E155 WeakPolarHBondContact CD2-OE1 3.44Å; L151-E155 WeakPolarHBondContact O-CB 3.26Å; L151-E155 WeakPolarHBondContact O-CG 3.39Å; L151-E155 PolarHBondContact O-N 3.02Å
152	L	96.9	Very high	95.2	Very high	95 Å²	95	107.6 Å²	107.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-58.2	-42.3	176.4	-173.3	74.1	0	0	0	112.6	E148 K149 M154 E155 N156	E148-L152 WeakPolarHBondContact O-CB 3.33Å; E148-L152 PolarHBondContact O-N 3.4Å; K149-L152 PolarHBondContact O-N 3.14Å; L152-M154 VanDerWaalsContact C-N 3.34Å; L152-E155 PolarHBondContact O-N 3.37Å; L152-N156 WeakPolarHBondContact O-CB 3.4Å; L152-N156 VanDerWaalsContact O-CG 3.26Å; L152-N156 PolarHBondContact O-N 2.84Å; L152-N156 PolarHBondContact O-ND2 3.15Å
153	I	96	Very high	95.5	Very high	118 Å²	118	106.1 Å²	106.1	61%	0.605	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-42.7	176.2	-68.5	164.6	0	0	0	110.7	K149 K150 L151 N157	K149-I153 WeakPolarHBondContact O-CD1 3.49Å; K149-I153 VanDerWaalsContact O-CG1 3.26Å; K149-I153 WeakPolarHBondContact O-CG1 3.37Å; K149-I153 PolarHBondContact O-N 2.92Å; K149-I153 VanDerWaalsContact O-N 3.07Å; K150-I153 PolarHBondContact O-N 3.37Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.09Å; I153-N157 WeakPolarHBondContact O-CB 3.42Å; I153-N157 PolarHBondContact O-N 3.25Å
154	M	95.6	Very high	95.8	Very high	134 Å²	134	106.3 Å²	106.3	66%	0.66	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-40.9	179.2	-169.3	177.4	-61.3	0	0	111.7	K150 L151 L152 N157 L158	K150-M154 WeakPolarHBondContact O-CB 3.44Å; K150-M154 PolarHBondContact O-N 2.88Å; L151-M154 CarbonylContact O-C 3.54Å; L151-M154 WeakPolarHBondContact O-CB 3.38Å; L151-M154 PolarHBondContact O-N 2.98Å; L152-M154 VanDerWaalsContact C-N 3.34Å; M154-N157 PolarHBondContact O-N 2.93Å; M154-L158 VanDerWaalsContact O-CB 3.31Å; M154-L158 WeakPolarHBondContact O-CB 3.43Å; M154-L158 PolarHBondContact O-N 2.9Å
155	E	96	Very high	96	Very high	104 Å²	104	105.5 Å²	105.5	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-45.7	175.1	-73.8	179.3	159.5	0	0	111.9	L151 L152 N157 L158 H159	L151-E155 VanDerWaalsContact CD2-CD 3.46Å; L151-E155 HydrophobicContact CD2-CG 4.31Å; L151-E155 WeakPolarHBondContact CD2-OE1 3.44Å; L151-E155 WeakPolarHBondContact O-CB 3.26Å; L151-E155 WeakPolarHBondContact O-CG 3.39Å; L151-E155 PolarHBondContact O-N 3.02Å; L152-E155 PolarHBondContact O-N 3.37Å; E155-N157 PolarHBondContact O-N 3.44Å; E155-L158 WeakPolarHBondContact O-CB 3.33Å; E155-L158 PolarHBondContact O-N 3.38Å; E155-H159 WeakPolarHBondContact O-CB 3.46Å; E155-H159 PolarHBondContact O-N 2.98Å
156	N	96.1	Very high	96.1	Very high	96 Å²	96	104.3 Å²	104.3	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-43.3	176	-77	-23.1	0	0	0	111.7	L152 H159 E160	L152-N156 WeakPolarHBondContact O-CB 3.4Å; L152-N156 VanDerWaalsContact O-CG 3.26Å; L152-N156 PolarHBondContact O-N 2.84Å; L152-N156 PolarHBondContact O-ND2 3.15Å; N156-H159 PolarHBondContact O-N 3.12Å; N156-E160 WeakPolarHBondContact O-CB 3.42Å; N156-E160 PolarHBondContact O-N 3.42Å
157	N	97.7	Very high	96.2	Very high	80 Å²	80	104.1 Å²	104.1	43%	0.428	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-42	175.3	175.3	62	0	0	0	111.3	I153 M154 E155 H159 E160 K161	I153-N157 WeakPolarHBondContact O-CB 3.42Å; I153-N157 PolarHBondContact O-N 3.25Å; M154-N157 PolarHBondContact O-N 2.93Å; E155-N157 PolarHBondContact O-N 3.44Å; N157-H159 VanDerWaalsContact C-N 3.33Å; N157-H159 PolarHBondContact O-N 3.2Å; N157-E160 PolarHBondContact O-N 3.37Å; N157-K161 VanDerWaalsContact O-CG 3.3Å; N157-K161 WeakPolarHBondContact O-CG 3.21Å; N157-K161 PolarHBondContact O-N 3.12Å
158	L	96.9	Very high	96.3	Very high	119 Å²	119	102.9 Å²	102.9	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-59.1	-45.7	174.3	176.6	63	0	0	0	111	M154 E155 K161 N162	M154-L158 VanDerWaalsContact O-CB 3.31Å; M154-L158 WeakPolarHBondContact O-CB 3.43Å; M154-L158 PolarHBondContact O-N 2.9Å; E155-L158 WeakPolarHBondContact O-CB 3.33Å; E155-L158 PolarHBondContact O-N 3.38Å; L158-K161 PolarHBondContact O-N 3.42Å; L158-N162 WeakPolarHBondContact O-CB 3.37Å; L158-N162 PolarHBondContact O-N 3.02Å
159	H	96.3	Very high	96.5	Very high	113 Å²	113	101.8 Å²	101.8	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-44.7	177.5	-174.4	71	0	0	0	111.8	E155 N156 N157 K161 N162 M163	E155-H159 WeakPolarHBondContact O-CB 3.46Å; E155-H159 PolarHBondContact O-N 2.98Å; N156-H159 PolarHBondContact O-N 3.12Å; N157-H159 VanDerWaalsContact C-N 3.33Å; N157-H159 PolarHBondContact O-N 3.2Å; H159-K161 VanDerWaalsContact C-N 3.35Å; H159-K161 PolarHBondContact O-N 3.48Å; H159-N162 PolarHBondContact O-N 2.87Å; H159-M163 WeakPolarHBondContact O-CG 3.4Å; H159-M163 PolarHBondContact O-N 3.49Å
160	E	97.2	Very high	96.6	Very high	88 Å²	88	97.6 Å²	97.6	41%	0.411	50%	0.495	S	S	.	.	H	α-helix	trans	-59.6	-44.1	175.9	-169.3	-160.8	136.6	0	0	111.7	N156 N157 K164	N156-E160 WeakPolarHBondContact O-CB 3.42Å; N156-E160 PolarHBondContact O-N 3.42Å; N157-E160 PolarHBondContact O-N 3.37Å; E160-K164 WeakPolarHBondContact O-CG 3.42Å; E160-K164 PolarHBondContact O-N 3.5Å; E160-K164 VanDerWaalsContact O-N 3.08Å; E160-K164 WeakPolarHBondContact OE1-CE 3.43Å; E160-K164 IonicContact OE1-NZ 3.74Å; E160-K164 PolarHBondContact OE1-NZ 3.45Å
161	K	97.4	Very high	96.7	Very high	116 Å²	116	98.2 Å²	98.2	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-39.5	176	-64.2	-55.4	178.5	-173.8	0	111.7	N157 L158 H159 K164 F165	N157-K161 VanDerWaalsContact O-CG 3.3Å; N157-K161 WeakPolarHBondContact O-CG 3.21Å; N157-K161 PolarHBondContact O-N 3.12Å; L158-K161 PolarHBondContact O-N 3.42Å; H159-K161 VanDerWaalsContact C-N 3.35Å; H159-K161 PolarHBondContact O-N 3.48Å; K161-K164 PolarHBondContact O-N 2.88Å; K161-F165 WeakPolarHBondContact O-CB 3.26Å; K161-F165 PolarHBondContact O-N 3.02Å
162	N	96.8	Very high	96.8	Very high	85 Å²	85	97.2 Å²	97.2	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-67.3	-40.5	178.4	-165.3	39.5	0	0	0	111.8	L158 H159 F165 C166	L158-N162 WeakPolarHBondContact O-CB 3.37Å; L158-N162 PolarHBondContact O-N 3.02Å; H159-N162 PolarHBondContact O-N 2.87Å; N162-F165 WeakPolarHBondContact O-CB 3.31Å; N162-F165 PolarHBondContact O-N 3.21Å; N162-C166 WeakPolarHBondContact O-CB 3.37Å; N162-C166 PolarHBondContact O-N 2.87Å; N162-C166 PolarHBondContact O-SG 3.03Å
163	M	97	Very high	96.9	Very high	91 Å²	91	97.1 Å²	97.1	45%	0.448	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-50.2	172.6	-78.2	-111.6	70.2	0	0	111.1	H159 F165 C166 D167	H159-M163 WeakPolarHBondContact O-CG 3.4Å; H159-M163 PolarHBondContact O-N 3.49Å; M163-F165 VanDerWaalsContact C-N 3.29Å; M163-F165 PolarHBondContact O-N 3.29Å; M163-C166 PolarHBondContact O-N 3.36Å; M163-C166 VanDerWaalsContact O-N 3.16Å; M163-D167 VanDerWaalsContact O-CG 3.31Å; M163-D167 PolarHBondContact O-N 3.18Å
164	K	97.4	Very high	97	Very high	105 Å²	105	98.1 Å²	98.1	46%	0.457	49%	0.49	S	S	.	.	H	α-helix	trans	-59.1	-40.1	175.8	-72.7	173.4	176.2	175	0	112.2	E160 K161 D167 T168	E160-K164 WeakPolarHBondContact O-CG 3.42Å; E160-K164 PolarHBondContact O-N 3.5Å; E160-K164 VanDerWaalsContact O-N 3.08Å; E160-K164 WeakPolarHBondContact OE1-CE 3.43Å; E160-K164 IonicContact OE1-NZ 3.74Å; E160-K164 PolarHBondContact OE1-NZ 3.45Å; K161-K164 PolarHBondContact O-N 2.88Å; K164-D167 PolarHBondContact O-N 2.97Å; K164-T168 VanDerWaalsContact O-CG2 3.28Å; K164-T168 WeakPolarHBondContact O-CG2 3.48Å; K164-T168 PolarHBondContact O-N 3.5Å; K164-T168 PolarHBondContact O-OG1 3.2Å
165	F	96.4	Very high	97.1	Very high	113 Å²	113	94.3 Å²	94.3	50%	0.496	47%	0.472	S	S	.	.	H	α-helix	trans	-63	-48	174.8	178.7	-107.5	0	0	0	111.6	K161 N162 M163 D167 T168 L169	K161-F165 WeakPolarHBondContact O-CB 3.26Å; K161-F165 PolarHBondContact O-N 3.02Å; N162-F165 WeakPolarHBondContact O-CB 3.31Å; N162-F165 PolarHBondContact O-N 3.21Å; M163-F165 VanDerWaalsContact C-N 3.29Å; M163-F165 PolarHBondContact O-N 3.29Å; F165-D167 VanDerWaalsContact C-N 3.33Å; F165-D167 PolarHBondContact O-N 2.88Å; F165-T168 WeakPolarHBondContact CA-OG1 3.49Å; F165-T168 PolarHBondContact O-N 3.33Å; F165-T168 PolarHBondContact O-OG1 3.26Å; F165-L169 HydrophobicContact CD1-CD1 3.88Å; F165-L169 HydrophobicContact CD1-CG 4.38Å; F165-L169 HydrophobicContact CE1-CD1 3.3Å; F165-L169 HydrophobicContact CE1-CG 4.02Å; F165-L169 HydrophobicContact CE2-CD1 4.33Å; F165-L169 HydrophobicContact CE2-CD2 4.36Å; F165-L169 HydrophobicContact CE2-CG 4.21Å; F165-L169 HydrophobicContact CZ-CD1 3.57Å; F165-L169 HydrophobicContact CZ-CD2 4.13Å; F165-L169 HydrophobicContact CZ-CG 3.92Å; F165-L169 WeakPolarHBondContact O-CG 3.47Å; F165-L169 PolarHBondContact O-N 3.08Å
166	C	96	Very high	97.2	Very high	57 Å²	57	95.9 Å²	95.9	39%	0.385	47%	0.473	S	S	.	.	H	α-helix	trans	-59.3	-41.9	174.9	-71.8	0	0	0	0	112.4	N162 M163 L169 A170	N162-C166 WeakPolarHBondContact O-CB 3.37Å; N162-C166 PolarHBondContact O-N 2.87Å; N162-C166 PolarHBondContact O-SG 3.03Å; M163-C166 PolarHBondContact O-N 3.36Å; M163-C166 VanDerWaalsContact O-N 3.16Å; C166-L169 PolarHBondContact O-N 2.84Å; C166-A170 WeakPolarHBondContact O-CB 3.46Å; C166-A170 PolarHBondContact O-N 3.46Å
167	D	97.4	Very high	97.3	Very high	98 Å²	98	96.9 Å²	96.9	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-45.2	176.1	-70.4	-22.6	0	0	0	111.4	M163 K164 F165 L169 A170 Y171	M163-D167 VanDerWaalsContact O-CG 3.31Å; M163-D167 PolarHBondContact O-N 3.18Å; K164-D167 PolarHBondContact O-N 2.97Å; F165-D167 VanDerWaalsContact C-N 3.33Å; F165-D167 PolarHBondContact O-N 2.88Å; D167-L169 VanDerWaalsContact C-N 3.35Å; D167-L169 PolarHBondContact O-N 3.14Å; D167-A170 PolarHBondContact O-N 3.19Å; D167-Y171 WeakPolarHBondContact O-CB 3.43Å; D167-Y171 PolarHBondContact O-N 3.23Å
168	T	96.6	Very high	97.3	Very high	84 Å²	84	99.1 Å²	99.1	52%	0.515	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-36	176.2	58.7	0	0	0	0	112.4	K164 F165 Y171 N172	K164-T168 VanDerWaalsContact O-CG2 3.28Å; K164-T168 WeakPolarHBondContact O-CG2 3.48Å; K164-T168 PolarHBondContact O-N 3.5Å; K164-T168 PolarHBondContact O-OG1 3.2Å; F165-T168 WeakPolarHBondContact CA-OG1 3.49Å; F165-T168 PolarHBondContact O-N 3.33Å; F165-T168 PolarHBondContact O-OG1 3.26Å; T168-Y171 PolarHBondContact O-N 3.47Å; T168-N172 VanDerWaalsContact O-CB 3.28Å; T168-N172 WeakPolarHBondContact O-CB 3.36Å; T168-N172 PolarHBondContact O-N 2.81Å
169	L	97.5	Very high	97.4	Very high	75 Å²	75	97.1 Å²	97.1	39%	0.393	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-43.3	173	-75.6	-177.6	0	0	0	112	F165 C166 D167 Y171 N172 N173	F165-L169 HydrophobicContact CD1-CD1 3.88Å; F165-L169 HydrophobicContact CD1-CG 4.38Å; F165-L169 HydrophobicContact CE1-CD1 3.3Å; F165-L169 HydrophobicContact CE1-CG 4.02Å; F165-L169 HydrophobicContact CE2-CD1 4.33Å; F165-L169 HydrophobicContact CE2-CD2 4.36Å; F165-L169 HydrophobicContact CE2-CG 4.21Å; F165-L169 HydrophobicContact CZ-CD1 3.57Å; F165-L169 HydrophobicContact CZ-CD2 4.13Å; F165-L169 HydrophobicContact CZ-CG 3.92Å; F165-L169 WeakPolarHBondContact O-CG 3.47Å; F165-L169 PolarHBondContact O-N 3.08Å; C166-L169 PolarHBondContact O-N 2.84Å; D167-L169 VanDerWaalsContact C-N 3.35Å; D167-L169 PolarHBondContact O-N 3.14Å; L169-Y171 VanDerWaalsContact C-N 3.34Å; L169-Y171 PolarHBondContact O-N 2.83Å; L169-N172 PolarHBondContact O-N 3.43Å; L169-N173 WeakPolarHBondContact O-CB 3.37Å; L169-N173 PolarHBondContact O-N 3.07Å; L169-N173 PolarHBondContact O-ND2 2.87Å
170	A	97.3	Very high	97.5	Very high	47 Å²	47	97.6 Å²	97.6	39%	0.388	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-42.8	176.2	0	0	0	0	0	111	C166 D167 N173 K174	C166-A170 WeakPolarHBondContact O-CB 3.46Å; C166-A170 PolarHBondContact O-N 3.46Å; D167-A170 PolarHBondContact O-N 3.19Å; A170-N173 PolarHBondContact O-N 3.47Å; A170-K174 WeakPolarHBondContact O-CG 3.43Å; A170-K174 PolarHBondContact O-N 2.93Å
171	Y	97.9	Very high	97.5	Very high	154 Å²	154	95.9 Å²	95.9	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-64.9	-41.8	174.2	-176.7	-112.9	0	0	0	112.4	D167 T168 L169 N173 K174 I175	D167-Y171 WeakPolarHBondContact O-CB 3.43Å; D167-Y171 PolarHBondContact O-N 3.23Å; T168-Y171 PolarHBondContact O-N 3.47Å; L169-Y171 VanDerWaalsContact C-N 3.34Å; L169-Y171 PolarHBondContact O-N 2.83Å; Y171-N173 VanDerWaalsContact C-N 3.34Å; Y171-N173 PolarHBondContact O-N 3.36Å; Y171-K174 WeakPolarHBondContact O-CB 3.33Å; Y171-K174 PolarHBondContact O-N 3.17Å; Y171-I175 HydrophobicContact CD1-CD1 3.71Å; Y171-I175 HydrophobicContact CE1-CD1 3.2Å; Y171-I175 HydrophobicContact CE1-CG1 4.21Å; Y171-I175 HydrophobicContact CE2-CD1 4.21Å; Y171-I175 HydrophobicContact CE2-CG1 4.4Å; Y171-I175 HydrophobicContact CG-CD1 4.4Å; Y171-I175 VanDerWaalsContact CZ-CD1 3.48Å; Y171-I175 PolarHBondContact O-N 2.89Å
172	N	97.7	Very high	97.5	Very high	69 Å²	69	92.9 Å²	92.9	37%	0.369	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-42.3	175.5	-162.6	-58.7	0	0	0	111.4	T168 L169 K174 I175 R176	T168-N172 VanDerWaalsContact O-CB 3.28Å; T168-N172 WeakPolarHBondContact O-CB 3.36Å; T168-N172 PolarHBondContact O-N 2.81Å; L169-N172 PolarHBondContact O-N 3.43Å; N172-K174 VanDerWaalsContact C-N 3.35Å; N172-K174 PolarHBondContact O-N 3.37Å; N172-I175 PolarHBondContact O-N 2.93Å; N172-R176 WeakPolarHBondContact O-CG 3.38Å; N172-R176 PolarHBondContact O-N 2.92Å; N172-R176 VanDerWaalsContact OD1-CZ 3.24Å; N172-R176 PolarHBondContact OD1-NE 3.25Å; N172-R176 PolarHBondContact OD1-NH2 3.35Å
173	N	98	Very high	97.5	Very high	94 Å²	94	95.9 Å²	95.9	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-62	-40.1	174.5	-78.8	-28.8	0	0	0	112.3	L169 A170 Y171 R176 H177	L169-N173 WeakPolarHBondContact O-CB 3.37Å; L169-N173 PolarHBondContact O-N 3.07Å; L169-N173 PolarHBondContact O-ND2 2.87Å; A170-N173 PolarHBondContact O-N 3.47Å; Y171-N173 VanDerWaalsContact C-N 3.34Å; Y171-N173 PolarHBondContact O-N 3.36Å; N173-R176 PolarHBondContact O-N 3.45Å; N173-H177 WeakPolarHBondContact O-CB 3.33Å; N173-H177 PolarHBondContact O-N 2.97Å
174	K	98	Very high	97.6	Very high	138 Å²	138	96.1 Å²	96.1	60%	0.6	48%	0.476	S	S	*	.	H	α-helix	trans	-60.9	-48.6	173.5	-72.2	176	-180	179.9	0	111.8	A170 Y171 N172 R176 H177 E178	A170-K174 WeakPolarHBondContact O-CG 3.43Å; A170-K174 PolarHBondContact O-N 2.93Å; Y171-K174 WeakPolarHBondContact O-CB 3.33Å; Y171-K174 PolarHBondContact O-N 3.17Å; N172-K174 VanDerWaalsContact C-N 3.35Å; N172-K174 PolarHBondContact O-N 3.37Å; K174-R176 VanDerWaalsContact C-N 3.34Å; K174-R176 PolarHBondContact O-N 3.31Å; K174-H177 WeakPolarHBondContact O-CB 3.49Å; K174-H177 PolarHBondContact O-N 3.03Å; K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 2.86Å
175	I	98.2	Very high	97.6	Very high	55 Å²	55	96.3 Å²	96.3	28%	0.282	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-42.1	177	-68.2	167.9	0	0	0	111.4	Y171 N172 H177 E178 I179	Y171-I175 HydrophobicContact CD1-CD1 3.71Å; Y171-I175 HydrophobicContact CE1-CD1 3.2Å; Y171-I175 HydrophobicContact CE1-CG1 4.21Å; Y171-I175 HydrophobicContact CE2-CD1 4.21Å; Y171-I175 HydrophobicContact CE2-CG1 4.4Å; Y171-I175 HydrophobicContact CG-CD1 4.4Å; Y171-I175 VanDerWaalsContact CZ-CD1 3.48Å; Y171-I175 PolarHBondContact O-N 2.89Å; N172-I175 PolarHBondContact O-N 2.93Å; I175-H177 VanDerWaalsContact C-N 3.31Å; I175-H177 PolarHBondContact O-N 3.47Å; I175-E178 PolarHBondContact O-N 3.29Å; I175-I179 HydrophobicContact CG2-CD1 3.67Å; I175-I179 HydrophobicContact CG2-CG1 4.2Å; I175-I179 WeakPolarHBondContact O-CB 3.47Å; I175-I179 VanDerWaalsContact O-CG1 3.27Å; I175-I179 WeakPolarHBondContact O-CG1 3.39Å; I175-I179 PolarHBondContact O-N 3.02Å
176	R	98.3	Very high	97.6	Very high	136 Å²	136	97.3 Å²	97.3	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-59.6	-44.4	176.8	-75.2	177.5	-167.6	171.8	1	111.3	N172 N173 K174 I179 E180	N172-R176 WeakPolarHBondContact O-CG 3.38Å; N172-R176 PolarHBondContact O-N 2.92Å; N172-R176 VanDerWaalsContact OD1-CZ 3.24Å; N172-R176 PolarHBondContact OD1-NE 3.25Å; N172-R176 PolarHBondContact OD1-NH2 3.35Å; N173-R176 PolarHBondContact O-N 3.45Å; K174-R176 VanDerWaalsContact C-N 3.34Å; K174-R176 PolarHBondContact O-N 3.31Å; R176-I179 PolarHBondContact O-N 3.28Å; R176-E180 WeakPolarHBondContact O-CG 3.35Å; R176-E180 PolarHBondContact O-N 3.09Å
177	H	97.8	Very high	97.7	Very high	117 Å²	117	98.1 Å²	98.1	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-45.3	175.9	-174.7	63.8	0	0	0	111.8	N173 K174 I175 I179 E180 C181	N173-H177 WeakPolarHBondContact O-CB 3.33Å; N173-H177 PolarHBondContact O-N 2.97Å; K174-H177 WeakPolarHBondContact O-CB 3.49Å; K174-H177 PolarHBondContact O-N 3.03Å; I175-H177 VanDerWaalsContact C-N 3.31Å; I175-H177 PolarHBondContact O-N 3.47Å; H177-I179 VanDerWaalsContact C-N 3.34Å; H177-I179 PolarHBondContact O-N 3.09Å; H177-E180 PolarHBondContact O-N 3.41Å; H177-E180 VanDerWaalsContact O-N 3.17Å; H177-C181 PolarHBondContact O-N 2.94Å; H177-C181 PolarHBondContact O-SG 3.12Å; H177-C181 VanDerWaalsContact O-SG 3.36Å
178	E	98.3	Very high	97.7	Very high	128 Å²	128	97.4 Å²	97.4	60%	0.598	48%	0.475	S	S	*	.	H	α-helix	trans	-60.3	-41.6	175.3	-72	172.8	-169.5	0	0	112.5	K174 I175 E180 C181 A182	K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 2.86Å; I175-E178 PolarHBondContact O-N 3.29Å; E178-E180 VanDerWaalsContact C-N 3.34Å; E178-E180 PolarHBondContact O-N 2.72Å; E178-C181 PolarHBondContact O-N 3.45Å; E178-A182 WeakPolarHBondContact O-CB 3.43Å; E178-A182 PolarHBondContact O-N 2.81Å
179	I	98.1	Very high	97.8	Very high	77 Å²	77	101.2 Å²	101.2	40%	0.395	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-41.4	175.2	-70.5	168.8	0	0	0	110.9	I175 R176 H177 R183	I175-I179 HydrophobicContact CG2-CD1 3.67Å; I175-I179 HydrophobicContact CG2-CG1 4.2Å; I175-I179 WeakPolarHBondContact O-CB 3.47Å; I175-I179 VanDerWaalsContact O-CG1 3.27Å; I175-I179 WeakPolarHBondContact O-CG1 3.39Å; I175-I179 PolarHBondContact O-N 3.02Å; R176-I179 PolarHBondContact O-N 3.28Å; H177-I179 VanDerWaalsContact C-N 3.34Å; H177-I179 PolarHBondContact O-N 3.09Å; I179-R183 HydrophobicContact CG2-CG 4.45Å; I179-R183 WeakPolarHBondContact O-CB 3.39Å; I179-R183 WeakPolarHBondContact O-CG 3.42Å; I179-R183 PolarHBondContact O-N 2.79Å
180	E	97.7	Very high	97.8	Very high	122 Å²	122	104.8 Å²	104.8	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-66	-44.7	176.5	-75.7	178.9	177.6	0	0	112	R176 H177 E178 R183 N184	R176-E180 WeakPolarHBondContact O-CG 3.35Å; R176-E180 PolarHBondContact O-N 3.09Å; H177-E180 PolarHBondContact O-N 3.41Å; H177-E180 VanDerWaalsContact O-N 3.17Å; E178-E180 VanDerWaalsContact C-N 3.34Å; E178-E180 PolarHBondContact O-N 2.72Å; E180-R183 PolarHBondContact O-N 2.76Å; E180-N184 WeakPolarHBondContact O-CB 3.28Å; E180-N184 PolarHBondContact O-N 2.76Å
181	C	97.6	Very high	97.8	Very high	52 Å²	52	105.7 Å²	105.7	35%	0.351	49%	0.494	S	S	.	.	H	α-helix	trans	-56.9	-50.1	173.1	-71.6	0	0	0	0	111.2	H177 E178 R183 N184 E185	H177-C181 PolarHBondContact O-N 2.94Å; H177-C181 PolarHBondContact O-SG 3.12Å; H177-C181 VanDerWaalsContact O-SG 3.36Å; E178-C181 PolarHBondContact O-N 3.45Å; C181-R183 VanDerWaalsContact C-N 3.33Å; C181-R183 PolarHBondContact O-N 3.43Å; C181-N184 PolarHBondContact O-N 3.42Å; C181-E185 WeakPolarHBondContact O-CG 3.36Å; C181-E185 PolarHBondContact O-N 2.99Å
182	A	97.5	Very high	97.8	Very high	54 Å²	54	102.3 Å²	102.3	45%	0.446	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-38	178.1	0	0	0	0	0	112.5	E178 R186	E178-A182 WeakPolarHBondContact O-CB 3.43Å; E178-A182 PolarHBondContact O-N 2.81Å; A182-R186 VanDerWaalsContact O-CB 3.24Å; A182-R186 WeakPolarHBondContact O-CB 3.28Å; A182-R186 PolarHBondContact O-N 3.14Å
183	R	97.9	Very high	97.9	Very high	148 Å²	148	104.6 Å²	104.6	56%	0.558	49%	0.493	S	S	*	.	H	α-helix	trans	-65	-42.7	174.1	-78.1	170.8	176.9	176.5	0.3	111.7	I179 E180 C181 R186 N187	I179-R183 HydrophobicContact CG2-CG 4.45Å; I179-R183 WeakPolarHBondContact O-CB 3.39Å; I179-R183 WeakPolarHBondContact O-CG 3.42Å; I179-R183 PolarHBondContact O-N 2.79Å; E180-R183 PolarHBondContact O-N 2.76Å; C181-R183 VanDerWaalsContact C-N 3.33Å; C181-R183 PolarHBondContact O-N 3.43Å; R183-R186 PolarHBondContact O-N 3.27Å; R183-N187 WeakPolarHBondContact O-CB 3.46Å; R183-N187 PolarHBondContact O-N 2.81Å; R183-N187 PolarHBondContact O-ND2 3.47Å; R183-N187 PolarHBondContact O-OD1 3.49Å
184	N	97.4	Very high	97.9	Very high	95 Å²	95	104.2 Å²	104.2	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-48	177.4	-175.3	47.9	0	0	0	111.1	E180 C181 R186 N187 I188	E180-N184 WeakPolarHBondContact O-CB 3.28Å; E180-N184 PolarHBondContact O-N 2.76Å; C181-N184 PolarHBondContact O-N 3.42Å; N184-R186 VanDerWaalsContact C-N 3.34Å; N184-R186 PolarHBondContact O-N 2.92Å; N184-N187 WeakPolarHBondContact O-CB 3.45Å; N184-N187 PolarHBondContact O-N 3.25Å; N184-N187 VanDerWaalsContact O-N 3.11Å; N184-I188 WeakPolarHBondContact O-CG1 3.46Å; N184-I188 PolarHBondContact O-N 2.7Å
185	E	97.4	Very high	97.9	Very high	110 Å²	110	104 Å²	104	51%	0.514	49%	0.488	S	S	.	.	H	α-helix	trans	-55.9	-49.1	174.1	-74.7	-178	-179.6	0	0	111.3	C181 N187 I188 Y189	C181-E185 WeakPolarHBondContact O-CG 3.36Å; C181-E185 PolarHBondContact O-N 2.99Å; E185-N187 VanDerWaalsContact C-N 3.28Å; E185-N187 PolarHBondContact O-N 2.91Å; E185-I188 WeakPolarHBondContact O-CB 3.41Å; E185-I188 PolarHBondContact O-N 2.82Å; E185-I188 VanDerWaalsContact O-N 3.1Å; E185-Y189 HydrophobicContact CB-CD2 4.36Å; E185-Y189 HydrophobicContact CB-CE2 4.32Å; E185-Y189 WeakPolarHBondContact O-CD2 3.31Å; E185-Y189 PolarHBondContact O-N 3.08Å
186	R	98	Very high	97.8	Very high	133 Å²	133	106.3 Å²	106.3	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-55.6	-43.3	176.1	-170.1	-161.6	71.8	179.1	0.4	111.7	A182 R183 N184 Y189 Y190	A182-R186 VanDerWaalsContact O-CB 3.24Å; A182-R186 WeakPolarHBondContact O-CB 3.28Å; A182-R186 PolarHBondContact O-N 3.14Å; R183-R186 PolarHBondContact O-N 3.27Å; N184-R186 VanDerWaalsContact C-N 3.34Å; N184-R186 PolarHBondContact O-N 2.92Å; R186-Y189 PolarHBondContact O-N 2.95Å; R186-Y190 HydrophobicContact CG-CD2 3.75Å; R186-Y190 HydrophobicContact CG-CE2 3.49Å; R186-Y190 VanDerWaalsContact CG-CE2 3.49Å; R186-Y190 WeakPolarHBondContact O-CD2 3.35Å; R186-Y190 PolarHBondContact O-N 3.4Å
187	N	97.8	Very high	97.8	Very high	75 Å²	75	105 Å²	105	40%	0.401	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-38.9	178.3	-67.7	-14.5	0	0	0	111.9	R183 N184 E185 Y190 S191	R183-N187 WeakPolarHBondContact O-CB 3.46Å; R183-N187 PolarHBondContact O-N 2.81Å; R183-N187 PolarHBondContact O-ND2 3.47Å; R183-N187 PolarHBondContact O-OD1 3.49Å; N184-N187 WeakPolarHBondContact O-CB 3.45Å; N184-N187 PolarHBondContact O-N 3.25Å; N184-N187 VanDerWaalsContact O-N 3.11Å; E185-N187 VanDerWaalsContact C-N 3.28Å; E185-N187 PolarHBondContact O-N 2.91Å; N187-Y190 PolarHBondContact O-N 3.4Å; N187-S191 WeakPolarHBondContact O-CB 3.42Å; N187-S191 PolarHBondContact O-N 3.34Å; N187-S191 PolarHBondContact O-OG 2.91Å
188	I	97.5	Very high	97.8	Very high	83 Å²	83	104.4 Å²	104.4	43%	0.426	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-47.7	173.8	-66.3	164.7	0	0	0	109.9	N184 E185 Y190 S191 I192	N184-I188 WeakPolarHBondContact O-CG1 3.46Å; N184-I188 PolarHBondContact O-N 2.7Å; E185-I188 WeakPolarHBondContact O-CB 3.41Å; E185-I188 PolarHBondContact O-N 2.82Å; E185-I188 VanDerWaalsContact O-N 3.1Å; I188-Y190 PolarHBondContact O-N 3.06Å; I188-S191 WeakPolarHBondContact O-CB 3.46Å; I188-S191 PolarHBondContact O-N 3.33Å; I188-I192 HydrophobicContact CG2-CD1 3.86Å; I188-I192 WeakPolarHBondContact O-CG1 3.47Å; I188-I192 PolarHBondContact O-N 2.96Å
189	Y	97.8	Very high	97.8	Very high	164 Å²	164	105.4 Å²	105.4	64%	0.643	50%	0.498	S	S	*	.	H	α-helix	trans	-58.9	-46.3	176.4	-80.8	-65.2	0	0	0	112.2	E185 R186 S191 I192 H193	E185-Y189 HydrophobicContact CB-CD2 4.36Å; E185-Y189 HydrophobicContact CB-CE2 4.32Å; E185-Y189 WeakPolarHBondContact O-CD2 3.31Å; E185-Y189 PolarHBondContact O-N 3.08Å; R186-Y189 PolarHBondContact O-N 2.95Å; Y189-S191 VanDerWaalsContact C-N 3.32Å; Y189-S191 PolarHBondContact O-N 2.69Å; Y189-I192 PolarHBondContact O-N 3.21Å; Y189-H193 VanDerWaalsContact O-CB 3.27Å; Y189-H193 WeakPolarHBondContact O-CB 3.49Å; Y189-H193 PolarHBondContact O-N 3.01Å
190	Y	98.2	Very high	97.7	Very high	150 Å²	150	106.6 Å²	106.6	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-59.6	-42.5	175	-85.3	-62.2	0	0	0	112.2	R186 N187 I188 I192 H193 Q194	R186-Y190 HydrophobicContact CG-CD2 3.75Å; R186-Y190 HydrophobicContact CG-CE2 3.49Å; R186-Y190 VanDerWaalsContact CG-CE2 3.49Å; R186-Y190 WeakPolarHBondContact O-CD2 3.35Å; R186-Y190 PolarHBondContact O-N 3.4Å; N187-Y190 PolarHBondContact O-N 3.4Å; I188-Y190 PolarHBondContact O-N 3.06Å; Y190-I192 PolarHBondContact O-N 3.36Å; Y190-H193 PolarHBondContact O-N 3.39Å; Y190-Q194 WeakPolarHBondContact O-CB 3.3Å; Y190-Q194 PolarHBondContact O-N 2.95Å
191	S	97.7	Very high	97.7	Very high	65 Å²	65	104.5 Å²	104.5	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-42.5	178.3	-57.5	0	0	0	0	111.9	N187 I188 Y189 K195	N187-S191 WeakPolarHBondContact O-CB 3.42Å; N187-S191 PolarHBondContact O-N 3.34Å; N187-S191 PolarHBondContact O-OG 2.91Å; I188-S191 WeakPolarHBondContact O-CB 3.46Å; I188-S191 PolarHBondContact O-N 3.33Å; Y189-S191 VanDerWaalsContact C-N 3.32Å; Y189-S191 PolarHBondContact O-N 2.69Å; S191-K195 WeakPolarHBondContact O-CG 3.46Å; S191-K195 PolarHBondContact O-N 3.5Å
192	I	97.9	Very high	97.7	Very high	83 Å²	83	107.5 Å²	107.5	43%	0.426	51%	0.505	S	S	.	.	H	α-helix	trans	-67.9	-45.7	176.8	-66.9	168.8	0	0	0	110.5	I188 Y189 Y190 Q194 K195 L196	I188-I192 HydrophobicContact CG2-CD1 3.86Å; I188-I192 WeakPolarHBondContact O-CG1 3.47Å; I188-I192 PolarHBondContact O-N 2.96Å; Y189-I192 PolarHBondContact O-N 3.21Å; Y190-I192 PolarHBondContact O-N 3.36Å; I192-Q194 VanDerWaalsContact C-N 3.33Å; I192-Q194 PolarHBondContact O-N 2.88Å; I192-K195 PolarHBondContact O-N 2.9Å; I192-L196 HydrophobicContact CG2-CD1 3.95Å; I192-L196 HydrophobicContact CG2-CG 4.41Å; I192-L196 WeakPolarHBondContact O-CG 3.27Å; I192-L196 PolarHBondContact O-N 3.34Å
193	H	98	Very high	97.7	Very high	117 Å²	117	109.9 Å²	109.9	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-59.8	-43.1	179.1	-175.3	74.1	0	0	0	111.7	Y189 Y190 L196 K197	Y189-H193 VanDerWaalsContact O-CB 3.27Å; Y189-H193 WeakPolarHBondContact O-CB 3.49Å; Y189-H193 PolarHBondContact O-N 3.01Å; Y190-H193 PolarHBondContact O-N 3.39Å; H193-L196 PolarHBondContact O-N 2.96Å; H193-K197 WeakPolarHBondContact O-CB 3.31Å; H193-K197 PolarHBondContact O-N 3.03Å
194	Q	98.1	Very high	97.7	Very high	86 Å²	86	106.4 Å²	106.4	40%	0.402	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-44.9	176.7	-177.3	59.3	23.8	0	0	111.7	Y190 I192 L196 K197 E198	Y190-Q194 WeakPolarHBondContact O-CB 3.3Å; Y190-Q194 PolarHBondContact O-N 2.95Å; I192-Q194 VanDerWaalsContact C-N 3.33Å; I192-Q194 PolarHBondContact O-N 2.88Å; Q194-L196 VanDerWaalsContact C-N 3.33Å; Q194-L196 PolarHBondContact O-N 2.99Å; Q194-K197 WeakPolarHBondContact O-CB 3.04Å; Q194-K197 PolarHBondContact O-N 3.28Å; Q194-E198 PolarHBondContact NE2-OE1 2.77Å; Q194-E198 WeakPolarHBondContact O-CG 3.31Å; Q194-E198 PolarHBondContact O-N 2.87Å
195	K	97.8	Very high	97.7	Very high	135 Å²	135	108.2 Å²	108.2	59%	0.587	51%	0.506	S	S	*	.	H	α-helix	trans	-60.2	-41.6	174.6	-72.6	174.1	-178.4	-179.8	0	112.2	S191 I192 K199	S191-K195 WeakPolarHBondContact O-CG 3.46Å; S191-K195 PolarHBondContact O-N 3.5Å; I192-K195 PolarHBondContact O-N 2.9Å; K195-K199 WeakPolarHBondContact O-CG 3.42Å; K195-K199 PolarHBondContact O-N 3.38Å
196	L	97.2	Very high	97.6	Very high	102 Å²	102	107.3 Å²	107.3	53%	0.534	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-39.6	176.7	-72.7	172.3	0	0	0	111.9	I192 H193 Q194 K199 L200	I192-L196 HydrophobicContact CG2-CD1 3.95Å; I192-L196 HydrophobicContact CG2-CG 4.41Å; I192-L196 WeakPolarHBondContact O-CG 3.27Å; I192-L196 PolarHBondContact O-N 3.34Å; H193-L196 PolarHBondContact O-N 2.96Å; Q194-L196 VanDerWaalsContact C-N 3.33Å; Q194-L196 PolarHBondContact O-N 2.99Å; L196-K199 PolarHBondContact O-N 3.41Å; L196-L200 WeakPolarHBondContact O-CB 3.26Å; L196-L200 PolarHBondContact O-N 3.38Å
197	K	98.1	Very high	97.5	Very high	108 Å²	108	106.8 Å²	106.8	47%	0.47	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-44.7	175.2	-176.3	179.7	178.8	-179.1	0	111.5	H193 Q194 L200 I201	H193-K197 WeakPolarHBondContact O-CB 3.31Å; H193-K197 PolarHBondContact O-N 3.03Å; Q194-K197 WeakPolarHBondContact O-CB 3.04Å; Q194-K197 PolarHBondContact O-N 3.28Å; K197-L200 PolarHBondContact O-N 3.02Å; K197-I201 HydrophobicContact CG-CD1 4.11Å; K197-I201 VanDerWaalsContact O-CG1 3.29Å; K197-I201 WeakPolarHBondContact O-CG1 3.47Å; K197-I201 PolarHBondContact O-N 2.96Å
198	E	97.8	Very high	97.5	Very high	106 Å²	106	106.7 Å²	106.7	50%	0.495	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-44.3	175.7	-74.5	170.6	-168.9	0	0	112	Q194 L200 I201 H202	Q194-E198 PolarHBondContact NE2-OE1 2.77Å; Q194-E198 WeakPolarHBondContact O-CG 3.31Å; Q194-E198 PolarHBondContact O-N 2.87Å; E198-L200 VanDerWaalsContact C-N 3.35Å; E198-L200 PolarHBondContact O-N 3.4Å; E198-I201 PolarHBondContact O-N 2.88Å; E198-H202 WeakPolarHBondContact O-CB 3.45Å; E198-H202 PolarHBondContact O-N 3.42Å
199	K	98	Very high	97.4	Very high	148 Å²	148	109.3 Å²	109.3	64%	0.643	52%	0.516	S	S	*	.	H	α-helix	trans	-60.5	-42	174	-74.7	179.3	179.2	-173.8	0	112.2	K195 L196 H202 L203	K195-K199 WeakPolarHBondContact O-CG 3.42Å; K195-K199 PolarHBondContact O-N 3.38Å; L196-K199 PolarHBondContact O-N 3.41Å; K199-H202 PolarHBondContact O-N 3.14Å; K199-L203 WeakPolarHBondContact O-CB 3.33Å; K199-L203 PolarHBondContact O-N 3.05Å
200	L	97.1	Very high	97.4	Very high	102 Å²	102	107.4 Å²	107.4	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-44	177	-178.6	65.3	0	0	0	111.5	L196 K197 E198 H202 L203 N204	L196-L200 WeakPolarHBondContact O-CB 3.26Å; L196-L200 PolarHBondContact O-N 3.38Å; K197-L200 PolarHBondContact O-N 3.02Å; E198-L200 VanDerWaalsContact C-N 3.35Å; E198-L200 PolarHBondContact O-N 3.4Å; L200-H202 VanDerWaalsContact C-N 3.34Å; L200-L203 PolarHBondContact O-N 3.47Å; L200-N204 WeakPolarHBondContact O-CB 3.44Å; L200-N204 PolarHBondContact O-N 3.15Å; L200-N204 PolarHBondContact O-ND2 2.63Å
201	I	97.9	Very high	97.3	Very high	78 Å²	78	104.2 Å²	104.2	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-44.4	175.3	-69.5	165.4	0	0	0	110.4	K197 E198 N204 K205	K197-I201 HydrophobicContact CG-CD1 4.11Å; K197-I201 VanDerWaalsContact O-CG1 3.29Å; K197-I201 WeakPolarHBondContact O-CG1 3.47Å; K197-I201 PolarHBondContact O-N 2.96Å; E198-I201 PolarHBondContact O-N 2.88Å; I201-N204 PolarHBondContact O-N 3.33Å; I201-K205 HydrophobicContact CG2-CD 4.37Å; I201-K205 WeakPolarHBondContact O-CG 3.38Å; I201-K205 PolarHBondContact O-N 3.33Å
202	H	97.5	Very high	97.2	Very high	116 Å²	116	106.5 Å²	106.5	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-47	177.6	-178.3	-91.1	0	0	0	112	E198 K199 L200 N204 K205 L206	E198-H202 WeakPolarHBondContact O-CB 3.45Å; E198-H202 PolarHBondContact O-N 3.42Å; K199-H202 PolarHBondContact O-N 3.14Å; L200-H202 VanDerWaalsContact C-N 3.34Å; H202-N204 VanDerWaalsContact C-N 3.34Å; H202-N204 PolarHBondContact O-N 2.81Å; H202-K205 WeakPolarHBondContact O-CB 3.34Å; H202-K205 PolarHBondContact O-N 3.46Å; H202-L206 VanDerWaalsContact CE1-CD1 3.48Å; H202-L206 WeakPolarHBondContact CE1-CD1 3.27Å; H202-L206 PolarHBondContact O-N 3.24Å
203	L	97.1	Very high	97.2	Very high	103 Å²	103	107.7 Å²	107.7	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-41.2	177.4	-173.9	147.4	0	0	0	111.6	K199 L200 K205 L206 K207	K199-L203 WeakPolarHBondContact O-CB 3.33Å; K199-L203 PolarHBondContact O-N 3.05Å; L200-L203 PolarHBondContact O-N 3.47Å; L203-K205 PolarHBondContact O-N 2.84Å; L203-L206 PolarHBondContact O-N 2.96Å; L203-K207 WeakPolarHBondContact O-CB 3.35Å; L203-K207 PolarHBondContact O-N 3.46Å
204	N	96.9	Very high	97.1	Very high	75 Å²	75	103.8 Å²	103.8	40%	0.401	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-39.5	174.7	-80.3	-30	0	0	0	112.2	L200 I201 H202 L206 K207 T208	L200-N204 WeakPolarHBondContact O-CB 3.44Å; L200-N204 PolarHBondContact O-N 3.15Å; L200-N204 PolarHBondContact O-ND2 2.63Å; I201-N204 PolarHBondContact O-N 3.33Å; H202-N204 VanDerWaalsContact C-N 3.34Å; H202-N204 PolarHBondContact O-N 2.81Å; N204-L206 VanDerWaalsContact C-N 3.35Å; N204-L206 PolarHBondContact O-N 3.39Å; N204-K207 PolarHBondContact O-N 3.49Å; N204-T208 PolarHBondContact O-N 2.87Å; N204-T208 PolarHBondContact O-OG1 3.33Å; N204-T208 VanDerWaalsContact O-OG1 3.05Å
205	K	97.1	Very high	97	Very high	133 Å²	133	103.8 Å²	103.8	58%	0.578	51%	0.506	S	S	*	.	H	α-helix	trans	-60.8	-43.5	172.9	-73.2	175.6	-179.2	-179.5	0	111.6	I201 H202 L203 T208 K209	I201-K205 HydrophobicContact CG2-CD 4.37Å; I201-K205 WeakPolarHBondContact O-CG 3.38Å; I201-K205 PolarHBondContact O-N 3.33Å; H202-K205 WeakPolarHBondContact O-CB 3.34Å; H202-K205 PolarHBondContact O-N 3.46Å; L203-K205 PolarHBondContact O-N 2.84Å; K205-T208 PolarHBondContact O-N 3.05Å; K205-K209 WeakPolarHBondContact O-CG 3.5Å; K205-K209 PolarHBondContact O-N 3.38Å
206	L	97	Very high	96.9	Very high	92 Å²	92	101.1 Å²	101.1	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-44.8	175.3	-71.7	179.7	0	0	0	111.9	H202 L203 N204 T208 K209 L210	H202-L206 VanDerWaalsContact CE1-CD1 3.48Å; H202-L206 WeakPolarHBondContact CE1-CD1 3.27Å; H202-L206 PolarHBondContact O-N 3.24Å; L203-L206 PolarHBondContact O-N 2.96Å; N204-L206 VanDerWaalsContact C-N 3.35Å; N204-L206 PolarHBondContact O-N 3.39Å; L206-T208 VanDerWaalsContact C-N 3.34Å; L206-T208 PolarHBondContact O-N 2.89Å; L206-K209 PolarHBondContact O-N 3.29Å; L206-L210 WeakPolarHBondContact O-CB 3.38Å; L206-L210 PolarHBondContact O-N 3.38Å
207	K	95.3	Very high	96.9	Very high	121 Å²	121	99.7 Å²	99.7	53%	0.526	49%	0.493	S	S	.	.	H	α-helix	trans	-57.6	-45.8	175.2	-179.9	179.8	175.3	-178.9	0	111.4	L203 N204 L210 I211	L203-K207 WeakPolarHBondContact O-CB 3.35Å; L203-K207 PolarHBondContact O-N 3.46Å; N204-K207 PolarHBondContact O-N 3.49Å; K207-L210 PolarHBondContact O-N 2.89Å; K207-I211 HydrophobicContact CG-CD1 3.95Å; K207-I211 VanDerWaalsContact O-CG1 3.29Å; K207-I211 WeakPolarHBondContact O-CG1 3.48Å; K207-I211 PolarHBondContact O-N 2.85Å
208	T	97.1	Very high	96.8	Very high	73 Å²	73	101.7 Å²	101.7	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-43.6	177.3	-59.7	0	0	0	0	111.9	N204 K205 L206 L210 I211 Q212	N204-T208 PolarHBondContact O-N 2.87Å; N204-T208 PolarHBondContact O-OG1 3.33Å; N204-T208 VanDerWaalsContact O-OG1 3.05Å; K205-T208 PolarHBondContact O-N 3.05Å; L206-T208 VanDerWaalsContact C-N 3.34Å; L206-T208 PolarHBondContact O-N 2.89Å; T208-L210 VanDerWaalsContact C-N 3.33Å; T208-L210 PolarHBondContact O-N 3.47Å; T208-I211 PolarHBondContact O-N 3.2Å; T208-Q212 WeakPolarHBondContact O-CG 3.28Å; T208-Q212 PolarHBondContact O-N 2.92Å
209	K	96.9	Very high	96.7	Very high	139 Å²	139	101.6 Å²	101.6	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-60.6	-41.9	175	-73.3	179.6	178.7	-173.3	0	112	K205 L206 Q212 Q213	K205-K209 WeakPolarHBondContact O-CG 3.5Å; K205-K209 PolarHBondContact O-N 3.38Å; L206-K209 PolarHBondContact O-N 3.29Å; K209-Q212 PolarHBondContact O-N 3.33Å; K209-Q213 WeakPolarHBondContact O-CB 3.49Å; K209-Q213 PolarHBondContact O-N 2.91Å
210	L	97	Very high	96.7	Very high	124 Å²	124	100.2 Å²	100.2	65%	0.649	50%	0.498	S	S	*	.	H	α-helix	trans	-63.7	-42.6	176.7	-179	62.3	0	0	0	111.7	L206 K207 T208 Q213 A214	L206-L210 WeakPolarHBondContact O-CB 3.38Å; L206-L210 PolarHBondContact O-N 3.38Å; K207-L210 PolarHBondContact O-N 2.89Å; T208-L210 VanDerWaalsContact C-N 3.33Å; T208-L210 PolarHBondContact O-N 3.47Å; L210-Q213 PolarHBondContact O-N 3.37Å; L210-A214 VanDerWaalsContact O-CB 3.32Å; L210-A214 WeakPolarHBondContact O-CB 3.38Å; L210-A214 PolarHBondContact O-N 3.25Å
211	I	95.7	Very high	96.7	Very high	83 Å²	83	103.8 Å²	103.8	43%	0.426	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-43.7	175.5	-67.9	165.3	0	0	0	110.8	K207 T208 Q213 A214 N215	K207-I211 HydrophobicContact CG-CD1 3.95Å; K207-I211 VanDerWaalsContact O-CG1 3.29Å; K207-I211 WeakPolarHBondContact O-CG1 3.48Å; K207-I211 PolarHBondContact O-N 2.85Å; T208-I211 PolarHBondContact O-N 3.2Å; I211-Q213 PolarHBondContact O-N 3.49Å; I211-A214 PolarHBondContact O-N 2.82Å; I211-N215 WeakPolarHBondContact O-CB 3.45Å; I211-N215 VanDerWaalsContact O-CG 3.25Å; I211-N215 PolarHBondContact O-N 3.34Å
212	Q	96.3	Very high	96.6	Very high	112 Å²	112	102.2 Å²	102.2	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-60	-46.4	175.8	-73.9	172.6	-12.5	0	0	111.5	T208 K209 A214 N215 I216	T208-Q212 WeakPolarHBondContact O-CG 3.28Å; T208-Q212 PolarHBondContact O-N 2.92Å; K209-Q212 PolarHBondContact O-N 3.33Å; Q212-A214 VanDerWaalsContact C-N 3.34Å; Q212-A214 PolarHBondContact O-N 3.2Å; Q212-N215 PolarHBondContact O-N 2.84Å; Q212-I216 VanDerWaalsContact O-CG1 3.31Å; Q212-I216 WeakPolarHBondContact O-CG1 3.3Å; Q212-I216 PolarHBondContact O-N 3.32Å
213	Q	96.6	Very high	96.6	Very high	108 Å²	108	101 Å²	101	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-39.8	176.9	-175.4	58.4	35.9	0	0	112.1	K209 L210 I211 I216 T217	K209-Q213 WeakPolarHBondContact O-CB 3.49Å; K209-Q213 PolarHBondContact O-N 2.91Å; L210-Q213 PolarHBondContact O-N 3.37Å; I211-Q213 PolarHBondContact O-N 3.49Å; Q213-I216 PolarHBondContact O-N 3.43Å; Q213-T217 WeakPolarHBondContact O-CB 3.42Å; Q213-T217 PolarHBondContact O-N 2.97Å; Q213-T217 PolarHBondContact O-OG1 2.98Å
214	A	95.7	Very high	96.6	Very high	35 Å²	35	98.8 Å²	98.8	29%	0.289	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-45.9	175.6	0	0	0	0	0	111	L210 I211 Q212 I216 T217 Y218	L210-A214 VanDerWaalsContact O-CB 3.32Å; L210-A214 WeakPolarHBondContact O-CB 3.38Å; L210-A214 PolarHBondContact O-N 3.25Å; I211-A214 PolarHBondContact O-N 2.82Å; Q212-A214 VanDerWaalsContact C-N 3.34Å; Q212-A214 PolarHBondContact O-N 3.2Å; A214-I216 PolarHBondContact O-N 3.08Å; A214-T217 WeakPolarHBondContact O-CB 3.48Å; A214-T217 PolarHBondContact O-N 3.44Å; A214-T217 VanDerWaalsContact O-N 3.15Å; A214-Y218 WeakPolarHBondContact O-CD2 3.35Å; A214-Y218 PolarHBondContact O-N 3.45Å
215	N	96.2	Very high	96.6	Very high	87 Å²	87	101.6 Å²	101.6	47%	0.465	51%	0.505	S	S	.	.	H	α-helix	trans	-59.8	-47.4	177	-70.8	-11.6	0	0	0	111.8	I211 Q212 T217 Y218 D219	I211-N215 WeakPolarHBondContact O-CB 3.45Å; I211-N215 VanDerWaalsContact O-CG 3.25Å; I211-N215 PolarHBondContact O-N 3.34Å; Q212-N215 PolarHBondContact O-N 2.84Å; N215-T217 PolarHBondContact O-N 3.27Å; N215-Y218 PolarHBondContact O-N 3.01Å; N215-Y218 VanDerWaalsContact O-N 3.11Å; N215-D219 VanDerWaalsContact O-CG 3.31Å; N215-D219 PolarHBondContact O-N 3.43Å
216	I	96.9	Very high	96.6	Very high	79 Å²	79	99.9 Å²	99.9	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-56.7	-42.3	175.2	-67.7	164.9	0	0	0	110.8	Q212 Q213 A214 D219 Q220	Q212-I216 VanDerWaalsContact O-CG1 3.31Å; Q212-I216 WeakPolarHBondContact O-CG1 3.3Å; Q212-I216 PolarHBondContact O-N 3.32Å; Q213-I216 PolarHBondContact O-N 3.43Å; A214-I216 PolarHBondContact O-N 3.08Å; I216-D219 PolarHBondContact O-N 2.87Å; I216-Q220 HydrophobicContact CG2-CG 4.42Å; I216-Q220 WeakPolarHBondContact O-CB 3.43Å; I216-Q220 VanDerWaalsContact O-CG 3.23Å; I216-Q220 WeakPolarHBondContact O-CG 3.38Å; I216-Q220 PolarHBondContact O-N 3.21Å
217	T	95.9	Very high	96.5	Very high	71 Å²	71	102.3 Å²	102.3	44%	0.436	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-38.9	179.2	-53.5	0	0	0	0	111.7	Q213 A214 N215 R221	Q213-T217 WeakPolarHBondContact O-CB 3.42Å; Q213-T217 PolarHBondContact O-N 2.97Å; Q213-T217 PolarHBondContact O-OG1 2.98Å; A214-T217 WeakPolarHBondContact O-CB 3.48Å; A214-T217 PolarHBondContact O-N 3.44Å; A214-T217 VanDerWaalsContact O-N 3.15Å; N215-T217 PolarHBondContact O-N 3.27Å; T217-R221 VanDerWaalsContact O-CB 3.3Å; T217-R221 WeakPolarHBondContact O-CB 3.28Å; T217-R221 PolarHBondContact O-N 2.84Å
218	Y	96.8	Very high	96.5	Very high	150 Å²	150	100.1 Å²	100.1	59%	0.588	51%	0.509	S	S	*	.	H	α-helix	trans	-65.5	-42.6	174.7	-83.5	-66.7	0	0	0	112	A214 N215 R221 A222	A214-Y218 WeakPolarHBondContact O-CD2 3.35Å; A214-Y218 PolarHBondContact O-N 3.45Å; N215-Y218 PolarHBondContact O-N 3.01Å; N215-Y218 VanDerWaalsContact O-N 3.11Å; Y218-R221 PolarHBondContact O-N 2.74Å; Y218-A222 WeakPolarHBondContact O-CB 3.41Å; Y218-A222 PolarHBondContact O-N 3.45Å
219	D	96.8	Very high	96.5	Very high	105 Å²	105	100.6 Å²	100.6	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-64.1	-46.9	176.7	-67.5	-22.5	0	0	0	110.7	N215 I216 R221 A222 D223	N215-D219 VanDerWaalsContact O-CG 3.31Å; N215-D219 PolarHBondContact O-N 3.43Å; I216-D219 PolarHBondContact O-N 2.87Å; D219-R221 VanDerWaalsContact C-N 3.3Å; D219-R221 PolarHBondContact O-N 2.75Å; D219-A222 WeakPolarHBondContact O-CB 3.27Å; D219-A222 PolarHBondContact O-N 3.41Å; D219-A222 VanDerWaalsContact O-N 3.13Å; D219-D223 PolarHBondContact O-N 3.48Å
220	Q	97.1	Very high	96.5	Very high	118 Å²	118	96.7 Å²	96.7	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-59.2	-40.5	174.7	-74.7	174.2	-0.2	0	0	112.3	I216 D223 A224	I216-Q220 HydrophobicContact CG2-CG 4.42Å; I216-Q220 WeakPolarHBondContact O-CB 3.43Å; I216-Q220 VanDerWaalsContact O-CG 3.23Å; I216-Q220 WeakPolarHBondContact O-CG 3.38Å; I216-Q220 PolarHBondContact O-N 3.21Å; Q220-D223 PolarHBondContact O-N 2.83Å; Q220-A224 VanDerWaalsContact O-CB 3.29Å; Q220-A224 WeakPolarHBondContact O-CB 3.45Å; Q220-A224 PolarHBondContact O-N 2.89Å
221	R	96.5	Very high	96.5	Very high	178 Å²	178	96.4 Å²	96.4	67%	0.672	50%	0.501	S	S	*	.	H	α-helix	trans	-64.7	-42.7	175.3	-179	-178.1	179.2	-177.4	1	111.4	T217 Y218 D219 K225	T217-R221 VanDerWaalsContact O-CB 3.3Å; T217-R221 WeakPolarHBondContact O-CB 3.28Å; T217-R221 PolarHBondContact O-N 2.84Å; Y218-R221 PolarHBondContact O-N 2.74Å; D219-R221 VanDerWaalsContact C-N 3.3Å; D219-R221 PolarHBondContact O-N 2.75Å; R221-K225 VanDerWaalsContact O-CB 3.28Å; R221-K225 WeakPolarHBondContact O-CB 3.36Å; R221-K225 PolarHBondContact O-N 2.84Å
222	A	96.8	Very high	96.5	Very high	44 Å²	44	98.8 Å²	98.8	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-44.7	177	0	0	0	0	0	111.1	Y218 D219 K225 N226	Y218-A222 WeakPolarHBondContact O-CB 3.41Å; Y218-A222 PolarHBondContact O-N 3.45Å; D219-A222 WeakPolarHBondContact O-CB 3.27Å; D219-A222 PolarHBondContact O-N 3.41Å; D219-A222 VanDerWaalsContact O-N 3.13Å; A222-K225 PolarHBondContact O-N 3.31Å; A222-N226 WeakPolarHBondContact O-CB 3.47Å; A222-N226 PolarHBondContact O-N 3.24Å; A222-N226 PolarHBondContact O-ND2 2.84Å
223	D	96.6	Very high	96.6	Very high	90 Å²	90	98.5 Å²	98.5	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-45.6	176.1	-78.5	-12.1	0	0	0	112.5	D219 Q220 K225 N226 K227	D219-D223 PolarHBondContact O-N 3.48Å; Q220-D223 PolarHBondContact O-N 2.83Å; D223-K225 VanDerWaalsContact C-N 3.31Å; D223-K225 PolarHBondContact O-N 2.83Å; D223-N226 PolarHBondContact O-N 3.19Å; D223-K227 WeakPolarHBondContact O-CB 3.43Å; D223-K227 VanDerWaalsContact O-CG 3.29Å; D223-K227 WeakPolarHBondContact O-CG 3.46Å; D223-K227 PolarHBondContact O-N 3.3Å
224	A	96.8	Very high	96.6	Very high	57 Å²	57	99.2 Å²	99.2	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-62.5	-40.2	176.2	0	0	0	0	0	111.4	Q220 K227 S228	Q220-A224 VanDerWaalsContact O-CB 3.29Å; Q220-A224 WeakPolarHBondContact O-CB 3.45Å; Q220-A224 PolarHBondContact O-N 2.89Å; A224-K227 PolarHBondContact O-N 3.33Å; A224-S228 WeakPolarHBondContact O-CB 3.46Å; A224-S228 PolarHBondContact O-N 3.16Å
225	K	97.1	Very high	96.6	Very high	134 Å²	134	102 Å²	102	58%	0.583	52%	0.518	S	S	*	.	H	α-helix	trans	-65.5	-43.5	175.3	-174.7	176.2	-179.8	-178	0	111.7	R221 A222 D223 S228 N229	R221-K225 VanDerWaalsContact O-CB 3.28Å; R221-K225 WeakPolarHBondContact O-CB 3.36Å; R221-K225 PolarHBondContact O-N 2.84Å; A222-K225 PolarHBondContact O-N 3.31Å; D223-K225 VanDerWaalsContact C-N 3.31Å; D223-K225 PolarHBondContact O-N 2.83Å; K225-S228 PolarHBondContact O-N 3.27Å; K225-N229 WeakPolarHBondContact O-CB 3.49Å; K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 2.94Å
226	N	96.7	Very high	96.6	Very high	98 Å²	98	102 Å²	102	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-62.7	-43	176.6	-71	-17.9	0	0	0	111.2	A222 D223 N229 A230	A222-N226 WeakPolarHBondContact O-CB 3.47Å; A222-N226 PolarHBondContact O-N 3.24Å; A222-N226 PolarHBondContact O-ND2 2.84Å; D223-N226 PolarHBondContact O-N 3.19Å; N226-N229 PolarHBondContact O-N 3.33Å; N226-A230 WeakPolarHBondContact O-CB 3.34Å; N226-A230 PolarHBondContact O-N 2.8Å
227	K	96.7	Very high	96.6	Very high	143 Å²	143	104.3 Å²	104.3	62%	0.622	53%	0.525	S	S	*	.	H	α-helix	trans	-61.6	-44.3	173.1	-73.5	169.6	-178	172.6	0	112.1	D223 A224 A230 L231	D223-K227 WeakPolarHBondContact O-CB 3.43Å; D223-K227 VanDerWaalsContact O-CG 3.29Å; D223-K227 WeakPolarHBondContact O-CG 3.46Å; D223-K227 PolarHBondContact O-N 3.3Å; A224-K227 PolarHBondContact O-N 3.33Å; K227-A230 PolarHBondContact O-N 2.87Å; K227-L231 WeakPolarHBondContact O-CB 3.34Å; K227-L231 WeakPolarHBondContact O-CG 3.37Å; K227-L231 PolarHBondContact O-N 3.02Å
228	S	95.4	Very high	96.5	Very high	74 Å²	74	104.2 Å²	104.2	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.8	179.2	0	0	0	0	111.7	A224 K225 L231 K232	A224-S228 WeakPolarHBondContact O-CB 3.46Å; A224-S228 PolarHBondContact O-N 3.16Å; K225-S228 PolarHBondContact O-N 3.27Å; S228-L231 PolarHBondContact O-N 3.26Å; S228-K232 WeakPolarHBondContact O-CB 3.42Å; S228-K232 PolarHBondContact O-N 3.49Å
229	N	96.9	Very high	96.5	Very high	83 Å²	83	99.8 Å²	99.8	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-44.2	176	-72.2	-12.7	0	0	0	112	K225 N226 K232 E233	K225-N229 WeakPolarHBondContact O-CB 3.49Å; K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 2.94Å; N226-N229 PolarHBondContact O-N 3.33Å; N229-K232 PolarHBondContact O-N 2.88Å; N229-E233 WeakPolarHBondContact O-CB 3.34Å; N229-E233 PolarHBondContact O-N 3.1Å
230	A	96.9	Very high	96.4	Very high	58 Å²	58	97.3 Å²	97.3	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-40.5	178.2	0	0	0	0	0	112.4	N226 K227 E233 K234	N226-A230 WeakPolarHBondContact O-CB 3.34Å; N226-A230 PolarHBondContact O-N 2.8Å; K227-A230 PolarHBondContact O-N 2.87Å; A230-E233 PolarHBondContact O-N 2.87Å; A230-K234 WeakPolarHBondContact O-CB 3.2Å; A230-K234 PolarHBondContact O-N 2.75Å
231	L	96.4	Very high	96.3	Very high	118 Å²	118	92.9 Å²	92.9	62%	0.618	49%	0.493	S	S	*	.	H	α-helix	trans	-65.9	-38.9	173.9	-74.1	174.4	0	0	0	111.8	K227 S228 K234 N235	K227-L231 WeakPolarHBondContact O-CB 3.34Å; K227-L231 WeakPolarHBondContact O-CG 3.37Å; K227-L231 PolarHBondContact O-N 3.02Å; S228-L231 PolarHBondContact O-N 3.26Å; L231-K234 PolarHBondContact O-N 2.88Å; L231-N235 VanDerWaalsContact O-CB 3.28Å; L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 PolarHBondContact O-N 3.47Å
232	K	96.6	Very high	96.2	Very high	132 Å²	132	90.1 Å²	90.1	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-63.5	-48.7	174.8	-172.6	-179.3	177.8	-176.1	0	111.3	S228 N229 K234 N235 D236	S228-K232 WeakPolarHBondContact O-CB 3.42Å; S228-K232 PolarHBondContact O-N 3.49Å; N229-K232 PolarHBondContact O-N 2.88Å; K232-K234 VanDerWaalsContact C-N 3.32Å; K232-K234 PolarHBondContact O-N 2.9Å; K232-N235 PolarHBondContact O-N 3.35Å; K232-N235 VanDerWaalsContact O-N 3.14Å; K232-D236 WeakPolarHBondContact O-CB 3.27Å; K232-D236 PolarHBondContact O-N 2.83Å
233	E	96.8	Very high	96.1	Very high	106 Å²	106	93 Å²	93	50%	0.495	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-41.5	177.1	-173.6	-172.2	159.1	0	0	111.7	N229 A230 D236 K237	N229-E233 WeakPolarHBondContact O-CB 3.34Å; N229-E233 PolarHBondContact O-N 3.1Å; A230-E233 PolarHBondContact O-N 2.87Å; E233-D236 PolarHBondContact O-N 3.03Å; E233-K237 WeakPolarHBondContact O-CG 3.49Å; E233-K237 PolarHBondContact O-N 3.1Å; E233-K237 VanDerWaalsContact OE1-CE 3.23Å; E233-K237 WeakPolarHBondContact OE1-CE 3.4Å; E233-K237 IonicContact OE1-NZ 3.9Å; E233-K237 PolarHBondContact OE1-NZ 2.88Å
234	K	96.5	Very high	96	Very high	123 Å²	123	92.5 Å²	92.5	54%	0.535	49%	0.493	S	S	.	.	H	α-helix	trans	-61.1	-47.9	173.3	-176	-172.2	172.1	-171.5	0	111.1	A230 L231 K232 D236 K237 D238	A230-K234 WeakPolarHBondContact O-CB 3.2Å; A230-K234 PolarHBondContact O-N 2.75Å; L231-K234 PolarHBondContact O-N 2.88Å; K232-K234 VanDerWaalsContact C-N 3.32Å; K232-K234 PolarHBondContact O-N 2.9Å; K234-D236 VanDerWaalsContact C-N 3.3Å; K234-D236 PolarHBondContact O-N 3.41Å; K234-K237 PolarHBondContact O-N 3.5Å; K234-D238 VanDerWaalsContact CE-OD2 3.3Å; K234-D238 WeakPolarHBondContact CE-OD2 3.35Å; K234-D238 WeakPolarHBondContact O-CB 3.43Å; K234-D238 VanDerWaalsContact O-CG 3.3Å; K234-D238 PolarHBondContact O-N 3.32Å
235	N	96.2	Very high	96	Very high	94 Å²	94	95 Å²	95	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-62.6	-37.7	179.6	-173.6	68.2	0	0	0	112.1	L231 K232 S239	L231-N235 VanDerWaalsContact O-CB 3.28Å; L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 PolarHBondContact O-N 3.47Å; K232-N235 PolarHBondContact O-N 3.35Å; K232-N235 VanDerWaalsContact O-N 3.14Å; N235-S239 WeakPolarHBondContact O-CB 3.2Å; N235-S239 PolarHBondContact O-N 3.29Å; N235-S239 PolarHBondContact O-OG 2.84Å
236	D	96.3	Very high	95.9	Very high	87 Å²	87	93.8 Å²	93.8	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-41	175.8	-66.4	-16.4	0	0	0	110.8	K232 E233 K234 A240	K232-D236 WeakPolarHBondContact O-CB 3.27Å; K232-D236 PolarHBondContact O-N 2.83Å; E233-D236 PolarHBondContact O-N 3.03Å; K234-D236 VanDerWaalsContact C-N 3.3Å; K234-D236 PolarHBondContact O-N 3.41Å; D236-A240 WeakPolarHBondContact O-CB 3.36Å; D236-A240 PolarHBondContact O-N 3.25Å
237	K	96.1	Very high	95.8	Very high	127 Å²	127	94.1 Å²	94.1	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-65.3	-46.7	173.9	-73.4	174.2	-174.2	169.8	0	112.6	E233 K234 S239 A240 G241	E233-K237 WeakPolarHBondContact O-CG 3.49Å; E233-K237 PolarHBondContact O-N 3.1Å; E233-K237 VanDerWaalsContact OE1-CE 3.23Å; E233-K237 WeakPolarHBondContact OE1-CE 3.4Å; E233-K237 IonicContact OE1-NZ 3.9Å; E233-K237 PolarHBondContact OE1-NZ 2.88Å; K234-K237 PolarHBondContact O-N 3.5Å; K237-S239 VanDerWaalsContact C-N 3.32Å; K237-A240 PolarHBondContact O-N 2.94Å; K237-G241 PolarHBondContact O-N 3.48Å
238	D	95.5	Very high	95.6	Very high	69 Å²	69	90.8 Å²	90.8	37%	0.369	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-41.1	178.1	-69.6	-10.4	0	0	0	110	K234 G241 F242	K234-D238 VanDerWaalsContact CE-OD2 3.3Å; K234-D238 WeakPolarHBondContact CE-OD2 3.35Å; K234-D238 WeakPolarHBondContact O-CB 3.43Å; K234-D238 VanDerWaalsContact O-CG 3.3Å; K234-D238 PolarHBondContact O-N 3.32Å; D238-G241 PolarHBondContact O-N 3.43Å; D238-F242 HydrophobicContact CB-CE2 4.24Å; D238-F242 WeakPolarHBondContact O-CD2 3.45Å; D238-F242 WeakPolarHBondContact O-CG 3.16Å; D238-F242 PolarHBondContact O-N 2.88Å
239	S	95	Very high	95.6	Very high	57 Å²	57	92 Å²	92	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-43.5	175	-61	0	0	0	0	112	N235 K237 G241 F242 E243	N235-S239 WeakPolarHBondContact O-CB 3.2Å; N235-S239 PolarHBondContact O-N 3.29Å; N235-S239 PolarHBondContact O-OG 2.84Å; K237-S239 VanDerWaalsContact C-N 3.32Å; S239-G241 VanDerWaalsContact C-N 3.35Å; S239-F242 PolarHBondContact O-N 3.49Å; S239-E243 WeakPolarHBondContact O-CB 3.47Å; S239-E243 PolarHBondContact O-N 3.26Å
240	A	95.8	Very high	95.4	Very high	53 Å²	53	92.7 Å²	92.7	44%	0.438	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-39.7	174.3	0	0	0	0	0	111.9	D236 K237 E243 T244	D236-A240 WeakPolarHBondContact O-CB 3.36Å; D236-A240 PolarHBondContact O-N 3.25Å; K237-A240 PolarHBondContact O-N 2.94Å; A240-E243 PolarHBondContact O-N 2.95Å; A240-T244 PolarHBondContact O-N 2.88Å; A240-T244 VanDerWaalsContact O-N 3.08Å
241	G	95.2	Very high	95.2	Very high	25 Å²	25	97.2 Å²	97.2	26%	0.258	49%	0.485	S	S	.	.	H	α-helix	trans	-59.8	-52.4	173.3	0	0	0	0	0	112	K237 D238 S239 E243 T244 E245	K237-G241 PolarHBondContact O-N 3.48Å; D238-G241 PolarHBondContact O-N 3.43Å; S239-G241 VanDerWaalsContact C-N 3.35Å; G241-E243 VanDerWaalsContact C-N 3.28Å; G241-E243 PolarHBondContact O-N 3.46Å; G241-T244 PolarHBondContact O-N 3.06Å; G241-T244 PolarHBondContact O-OG1 2.92Å; G241-E245 WeakPolarHBondContact O-CG 3.35Å; G241-E245 PolarHBondContact O-N 2.88Å
242	F	94.1	Very high	95.1	Very high	120 Å²	120	96 Å²	96	53%	0.526	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-37.1	175.9	-68.5	-45	0	0	0	112.5	D238 S239 T244 E245 I246	D238-F242 HydrophobicContact CB-CE2 4.24Å; D238-F242 WeakPolarHBondContact O-CD2 3.45Å; D238-F242 WeakPolarHBondContact O-CG 3.16Å; D238-F242 PolarHBondContact O-N 2.88Å; S239-F242 PolarHBondContact O-N 3.49Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.22Å; F242-E245 PolarHBondContact O-N 2.9Å; F242-I246 VanDerWaalsContact O-CB 3.31Å; F242-I246 WeakPolarHBondContact O-CB 3.48Å; F242-I246 WeakPolarHBondContact O-CG1 3.24Å; F242-I246 PolarHBondContact O-N 3.38Å
243	E	95.8	Very high	94.8	Very high	105 Å²	105	93.6 Å²	93.6	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-63.1	-39.5	175.3	-163.8	-171	153.2	0	0	111.7	S239 A240 G241 K247	S239-E243 WeakPolarHBondContact O-CB 3.47Å; S239-E243 PolarHBondContact O-N 3.26Å; A240-E243 PolarHBondContact O-N 2.95Å; G241-E243 VanDerWaalsContact C-N 3.28Å; G241-E243 PolarHBondContact O-N 3.46Å; E243-K247 VanDerWaalsContact O-CG 3.28Å; E243-K247 WeakPolarHBondContact O-CG 3.25Å; E243-K247 PolarHBondContact O-N 3.19Å; E243-K247 VanDerWaalsContact O-N 3.12Å; E243-K247 VanDerWaalsContact OE1-CE 3.32Å; E243-K247 WeakPolarHBondContact OE1-CE 3.39Å; E243-K247 IonicContact OE1-NZ 3.46Å; E243-K247 PolarHBondContact OE1-NZ 3.45Å
244	T	94.4	Very high	94.6	Very high	80 Å²	80	92.4 Å²	92.4	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-44.1	174.1	58.6	0	0	0	0	112.5	A240 G241 F242 I246 K247 D248	A240-T244 PolarHBondContact O-N 2.88Å; A240-T244 VanDerWaalsContact O-N 3.08Å; G241-T244 PolarHBondContact O-N 3.06Å; G241-T244 PolarHBondContact O-OG1 2.92Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.22Å; T244-I246 PolarHBondContact O-N 2.94Å; T244-K247 WeakPolarHBondContact O-CB 3.31Å; T244-K247 PolarHBondContact O-N 3.48Å; T244-K247 VanDerWaalsContact O-N 3.17Å; T244-D248 PolarHBondContact O-N 2.77Å
245	E	95.2	Very high	94.2	Very high	108 Å²	108	92.5 Å²	92.5	51%	0.505	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-42.3	177	-70.4	177.4	-172	0	0	111.8	G241 F242 K247 D248 L249	G241-E245 WeakPolarHBondContact O-CG 3.35Å; G241-E245 PolarHBondContact O-N 2.88Å; F242-E245 PolarHBondContact O-N 2.9Å; E245-K247 VanDerWaalsContact C-N 3.31Å; E245-K247 PolarHBondContact O-N 2.99Å; E245-D248 PolarHBondContact O-N 2.97Å; E245-L249 WeakPolarHBondContact O-CB 3.44Å; E245-L249 WeakPolarHBondContact O-CG 3.49Å; E245-L249 PolarHBondContact O-N 2.77Å
246	I	94.8	Very high	94	Very high	110 Å²	110	91 Å²	91	56%	0.564	46%	0.462	S	S	*	.	H	α-helix	trans	-61.2	-41.5	175.3	-72.7	168	0	0	0	110.3	F242 T244 L249 Q250	F242-I246 VanDerWaalsContact O-CB 3.31Å; F242-I246 WeakPolarHBondContact O-CB 3.48Å; F242-I246 WeakPolarHBondContact O-CG1 3.24Å; F242-I246 PolarHBondContact O-N 3.38Å; T244-I246 PolarHBondContact O-N 2.94Å; I246-L249 PolarHBondContact O-N 3.21Å; I246-Q250 VanDerWaalsContact O-CB 3.27Å; I246-Q250 WeakPolarHBondContact O-CB 3.1Å; I246-Q250 PolarHBondContact O-N 3.42Å
247	K	94.8	Very high	93.6	Very high	105 Å²	105	89.7 Å²	89.7	46%	0.457	46%	0.455	S	S	.	.	H	α-helix	trans	-66.4	-35	175.9	-73	170.1	-173.8	167.5	0	112.7	E243 T244 E245 R251	E243-K247 VanDerWaalsContact O-CG 3.28Å; E243-K247 WeakPolarHBondContact O-CG 3.25Å; E243-K247 PolarHBondContact O-N 3.19Å; E243-K247 VanDerWaalsContact O-N 3.12Å; E243-K247 VanDerWaalsContact OE1-CE 3.32Å; E243-K247 WeakPolarHBondContact OE1-CE 3.39Å; E243-K247 IonicContact OE1-NZ 3.46Å; E243-K247 PolarHBondContact OE1-NZ 3.45Å; T244-K247 WeakPolarHBondContact O-CB 3.31Å; T244-K247 PolarHBondContact O-N 3.48Å; T244-K247 VanDerWaalsContact O-N 3.17Å; E245-K247 VanDerWaalsContact C-N 3.31Å; E245-K247 PolarHBondContact O-N 2.99Å; K247-R251 WeakPolarHBondContact O-CG 3.39Å; K247-R251 PolarHBondContact O-N 3.39Å; K247-R251 VanDerWaalsContact O-N 3.12Å; K247-R251 PolarHBondContact O-NE 3.39Å
248	D	93.8	Very high	93.2	Very high	72 Å²	72	90.2 Å²	90.2	39%	0.385	46%	0.459	S	S	.	.	H	α-helix	trans	-69	-47.3	173.7	-79	-32.6	0	0	0	111.6	T244 E245 Q250 R251 I252	T244-D248 PolarHBondContact O-N 2.77Å; E245-D248 PolarHBondContact O-N 2.97Å; D248-Q250 VanDerWaalsContact C-N 3.31Å; D248-Q250 PolarHBondContact O-N 2.76Å; D248-R251 WeakPolarHBondContact O-CB 3.45Å; D248-R251 PolarHBondContact O-N 3.02Å; D248-R251 VanDerWaalsContact O-N 3.15Å; D248-R251 IonicContact OD1-CZ 2.81Å; D248-R251 IonicContact OD1-NE 3.28Å; D248-R251 IonicContact OD1-NH1 3.16Å; D248-R251 PolarHBondContact OD1-NH1 3.17Å; D248-R251 IonicContact OD1-NH2 2.69Å; D248-R251 PolarHBondContact OD1-NH2 3.26Å; D248-I252 WeakPolarHBondContact O-CG1 3.46Å; D248-I252 PolarHBondContact O-N 3.31Å
249	L	93.8	Very high	92.6	Very high	101 Å²	101	90.5 Å²	90.5	53%	0.529	46%	0.46	S	S	.	.	H	α-helix	trans	-61.2	-41.1	176.3	-72.3	174.4	0	0	0	111.3	E245 I246 R251 I252 I253	E245-L249 WeakPolarHBondContact O-CB 3.44Å; E245-L249 WeakPolarHBondContact O-CG 3.49Å; E245-L249 PolarHBondContact O-N 2.77Å; I246-L249 PolarHBondContact O-N 3.21Å; L249-R251 VanDerWaalsContact C-N 3.35Å; L249-R251 PolarHBondContact O-N 3.26Å; L249-I252 PolarHBondContact O-N 3.24Å; L249-I253 WeakPolarHBondContact O-CB 3.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 2.87Å
250	Q	93.5	Very high	91.9	Very high	96 Å²	96	94.2 Å²	94.2	45%	0.449	47%	0.465	S	S	.	.	H	α-helix	trans	-61.4	-43.4	174.6	-170.9	62.3	37.6	0	0	111.1	I246 D248 I252 I253 D254	I246-Q250 VanDerWaalsContact O-CB 3.27Å; I246-Q250 WeakPolarHBondContact O-CB 3.1Å; I246-Q250 PolarHBondContact O-N 3.42Å; D248-Q250 VanDerWaalsContact C-N 3.31Å; D248-Q250 PolarHBondContact O-N 2.76Å; Q250-I252 VanDerWaalsContact C-N 3.35Å; Q250-I252 PolarHBondContact O-N 3.02Å; Q250-I253 PolarHBondContact O-N 2.94Å; Q250-D254 PolarHBondContact NE2-OD1 3.19Å; Q250-D254 WeakPolarHBondContact O-CB 3.15Å; Q250-D254 PolarHBondContact O-N 3.49Å
251	R	93	Very high	91.3	Very high	153 Å²	153	97.8 Å²	97.8	58%	0.577	47%	0.471	S	S	*	.	H	α-helix	trans	-60.9	-41	174	-81.3	-178.3	-84.3	158.6	-11.6	112.6	K247 D248 L249 H255	K247-R251 WeakPolarHBondContact O-CG 3.39Å; K247-R251 PolarHBondContact O-N 3.39Å; K247-R251 VanDerWaalsContact O-N 3.12Å; K247-R251 PolarHBondContact O-NE 3.39Å; D248-R251 WeakPolarHBondContact O-CB 3.45Å; D248-R251 PolarHBondContact O-N 3.02Å; D248-R251 VanDerWaalsContact O-N 3.15Å; D248-R251 IonicContact OD1-CZ 2.81Å; D248-R251 IonicContact OD1-NE 3.28Å; D248-R251 IonicContact OD1-NH1 3.16Å; D248-R251 PolarHBondContact OD1-NH1 3.17Å; D248-R251 IonicContact OD1-NH2 2.69Å; D248-R251 PolarHBondContact OD1-NH2 3.26Å; L249-R251 VanDerWaalsContact C-N 3.35Å; L249-R251 PolarHBondContact O-N 3.26Å; R251-H255 VanDerWaalsContact O-CB 3.27Å; R251-H255 WeakPolarHBondContact O-CB 3.41Å; R251-H255 PolarHBondContact O-N 2.93Å
252	I	93.9	Very high	90.4	Very high	93 Å²	93	102.4 Å²	102.4	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-66.2	-41.6	176	-67.2	166.1	0	0	0	110.6	D248 L249 Q250 H255 N256	D248-I252 WeakPolarHBondContact O-CG1 3.46Å; D248-I252 PolarHBondContact O-N 3.31Å; L249-I252 PolarHBondContact O-N 3.24Å; Q250-I252 VanDerWaalsContact C-N 3.35Å; Q250-I252 PolarHBondContact O-N 3.02Å; I252-H255 PolarHBondContact O-N 3.31Å; I252-N256 VanDerWaalsContact O-CB 3.22Å; I252-N256 WeakPolarHBondContact O-CB 3.44Å; I252-N256 VanDerWaalsContact O-CG 3.31Å; I252-N256 PolarHBondContact O-N 2.86Å; I252-N256 PolarHBondContact O-ND2 3.49Å
253	I	90.4	Very high	89.4	Confident	81 Å²	81	101.5 Å²	101.5	42%	0.415	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-49.3	176.7	-70.8	164.4	0	0	0	109.6	L249 Q250 H255 N256 D257	L249-I253 WeakPolarHBondContact O-CB 3.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 2.87Å; Q250-I253 PolarHBondContact O-N 2.94Å; I253-H255 VanDerWaalsContact C-N 3.35Å; I253-H255 PolarHBondContact O-N 3.17Å; I253-N256 CarbonylContact O-C 3.6Å; I253-N256 PolarHBondContact O-N 3.42Å; I253-D257 WeakPolarHBondContact O-CB 3.44Å; I253-D257 PolarHBondContact O-N 3.36Å
254	D	92.3	Very high	88.3	Confident	81 Å²	81	100.1 Å²	100.1	43%	0.433	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-43.7	178.7	-66.8	-19.1	0	0	0	110.9	Q250 D257 Q258	Q250-D254 PolarHBondContact NE2-OD1 3.19Å; Q250-D254 WeakPolarHBondContact O-CB 3.15Å; Q250-D254 PolarHBondContact O-N 3.49Å; D254-D257 PolarHBondContact O-N 3.37Å; D254-Q258 WeakPolarHBondContact O-CB 3.37Å; D254-Q258 PolarHBondContact O-N 3.44Å
255	H	88.7	Confident	87.4	Confident	126 Å²	126	100.9 Å²	100.9	58%	0.583	49%	0.486	S	S	*	.	H	α-helix	trans	-63.5	-44	174.4	179.4	-84.4	0	0	0	112.2	R251 I252 I253 D257 Q258 L259	R251-H255 VanDerWaalsContact O-CB 3.27Å; R251-H255 WeakPolarHBondContact O-CB 3.41Å; R251-H255 PolarHBondContact O-N 2.93Å; I252-H255 PolarHBondContact O-N 3.31Å; I253-H255 VanDerWaalsContact C-N 3.35Å; I253-H255 PolarHBondContact O-N 3.17Å; H255-D257 VanDerWaalsContact C-N 3.31Å; H255-D257 PolarHBondContact O-N 2.97Å; H255-Q258 WeakPolarHBondContact O-CB 3.27Å; H255-Q258 PolarHBondContact O-N 2.94Å; H255-L259 WeakPolarHBondContact O-CB 3.37Å; H255-L259 PolarHBondContact O-N 2.98Å
256	N	90.6	Very high	86	Confident	62 Å²	62	101.9 Å²	101.9	33%	0.332	49%	0.489	S	S	.	.	H	α-helix	trans	-67.7	-31.8	176.6	-81.7	-21.1	0	0	0	112.2	I252 I253 L259 R260	I252-N256 VanDerWaalsContact O-CB 3.22Å; I252-N256 WeakPolarHBondContact O-CB 3.44Å; I252-N256 VanDerWaalsContact O-CG 3.31Å; I252-N256 PolarHBondContact O-N 2.86Å; I252-N256 PolarHBondContact O-ND2 3.49Å; I253-N256 CarbonylContact O-C 3.6Å; I253-N256 PolarHBondContact O-N 3.42Å; N256-L259 PolarHBondContact O-N 2.85Å; N256-R260 VanDerWaalsContact O-CB 3.26Å; N256-R260 WeakPolarHBondContact O-CB 3.38Å; N256-R260 WeakPolarHBondContact O-CG 3.34Å; N256-R260 PolarHBondContact O-N 2.87Å
257	D	89.3	Confident	84.2	Confident	60 Å²	60	99.7 Å²	99.7	32%	0.321	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-38.3	172.5	-103.5	27.5	0	0	0	111.2	I253 D254 H255 L259 R260 K261	I253-D257 WeakPolarHBondContact O-CB 3.44Å; I253-D257 PolarHBondContact O-N 3.36Å; D254-D257 PolarHBondContact O-N 3.37Å; H255-D257 VanDerWaalsContact C-N 3.31Å; H255-D257 PolarHBondContact O-N 2.97Å; D257-L259 VanDerWaalsContact C-N 3.33Å; D257-R260 PolarHBondContact O-N 3.49Å; D257-R260 IonicContact OD1-CZ 3.4Å; D257-R260 IonicContact OD1-NE 2.81Å; D257-R260 PolarHBondContact OD1-NE 2.99Å; D257-R260 VanDerWaalsContact OD1-NE 3.09Å; D257-R260 IonicContact OD1-NH2 3.44Å; D257-R260 PolarHBondContact OD1-NH2 3.44Å; D257-K261 VanDerWaalsContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CG 3.5Å; D257-K261 PolarHBondContact O-N 2.87Å
258	Q	87.2	Confident	82.5	Confident	137 Å²	137	98.3 Å²	98.3	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-60.8	-45.1	170.4	-155	88.9	6.8	0	0	110.4	D254 H255 K261 F262	D254-Q258 WeakPolarHBondContact O-CB 3.37Å; D254-Q258 PolarHBondContact O-N 3.44Å; H255-Q258 WeakPolarHBondContact O-CB 3.27Å; H255-Q258 PolarHBondContact O-N 2.94Å; Q258-K261 PolarHBondContact O-N 2.87Å; Q258-F262 WeakPolarHBondContact O-CB 3.42Å; Q258-F262 PolarHBondContact O-N 3.25Å
259	L	83.2	Confident	80.5	Confident	75 Å²	75	102 Å²	102	39%	0.393	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-41.8	177.7	-176.6	63.4	0	0	0	111.6	H255 N256 D257 F262 M263	H255-L259 WeakPolarHBondContact O-CB 3.37Å; H255-L259 PolarHBondContact O-N 2.98Å; N256-L259 PolarHBondContact O-N 2.85Å; D257-L259 VanDerWaalsContact C-N 3.33Å; L259-F262 PolarHBondContact O-N 3.4Å; L259-M263 HydrophobicContact CD1-CE 4.27Å; L259-M263 HydrophobicContact CD1-CG 4.47Å; L259-M263 HydrophobicContact CG-CG 4.49Å; L259-M263 WeakPolarHBondContact O-CB 3.4Å; L259-M263 VanDerWaalsContact O-CG 3.24Å; L259-M263 WeakPolarHBondContact O-CG 3.34Å; L259-M263 PolarHBondContact O-N 2.86Å
260	R	80.7	Confident	78.4	Confident	135 Å²	135	107.1 Å²	107.1	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-47.4	173.6	-87.2	-172.7	-76	-92.8	1.6	110.7	N256 D257 F262 M263 V264	N256-R260 VanDerWaalsContact O-CB 3.26Å; N256-R260 WeakPolarHBondContact O-CB 3.38Å; N256-R260 WeakPolarHBondContact O-CG 3.34Å; N256-R260 PolarHBondContact O-N 2.87Å; D257-R260 PolarHBondContact O-N 3.49Å; D257-R260 IonicContact OD1-CZ 3.4Å; D257-R260 IonicContact OD1-NE 2.81Å; D257-R260 PolarHBondContact OD1-NE 2.99Å; D257-R260 VanDerWaalsContact OD1-NE 3.09Å; D257-R260 IonicContact OD1-NH2 3.44Å; D257-R260 PolarHBondContact OD1-NH2 3.44Å; R260-F262 VanDerWaalsContact C-N 3.31Å; R260-F262 PolarHBondContact O-N 3.42Å; R260-M263 CarbonylContact O-C 3.57Å; R260-M263 PolarHBondContact O-N 3.37Å; R260-V264 WeakPolarHBondContact O-CB 3.34Å; R260-V264 VanDerWaalsContact O-CG2 3.22Å; R260-V264 WeakPolarHBondContact O-CG2 3.44Å; R260-V264 PolarHBondContact O-N 3.49Å
261	K	81.8	Confident	76.3	Confident	129 Å²	129	105.6 Å²	105.6	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-58.4	-44.4	175.1	-74.5	167.5	-173.3	169	0	110.5	D257 Q258 V264 T265	D257-K261 VanDerWaalsContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CG 3.5Å; D257-K261 PolarHBondContact O-N 2.87Å; Q258-K261 PolarHBondContact O-N 2.87Å; K261-V264 PolarHBondContact O-N 2.81Å; K261-T265 WeakPolarHBondContact O-CB 3.31Å; K261-T265 PolarHBondContact O-N 3.17Å; K261-T265 PolarHBondContact O-OG1 3.39Å
262	F	76.5	Confident	74.3	Confident	122 Å²	122	106 Å²	106	54%	0.535	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-44.9	174.6	179.7	-98.2	0	0	0	112.7	Q258 L259 R260 V264 T265 K266	Q258-F262 WeakPolarHBondContact O-CB 3.42Å; Q258-F262 PolarHBondContact O-N 3.25Å; L259-F262 PolarHBondContact O-N 3.4Å; R260-F262 VanDerWaalsContact C-N 3.31Å; R260-F262 PolarHBondContact O-N 3.42Å; F262-V264 VanDerWaalsContact C-N 3.33Å; F262-T265 PolarHBondContact O-N 2.91Å; F262-K266 HydrophobicContact CE1-CD 4.33Å; F262-K266 VanDerWaalsContact O-CB 3.3Å; F262-K266 WeakPolarHBondContact O-CB 3.33Å; F262-K266 PolarHBondContact O-N 3.29Å
263	M	73.7	Confident	71.9	Confident	100 Å²	100	112.1 Å²	112.1	49%	0.493	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-34.3	176.5	-73.9	-65.9	-174.1	0	0	112.1	L259 R260 S267	L259-M263 HydrophobicContact CD1-CE 4.27Å; L259-M263 HydrophobicContact CD1-CG 4.47Å; L259-M263 HydrophobicContact CG-CG 4.49Å; L259-M263 WeakPolarHBondContact O-CB 3.4Å; L259-M263 VanDerWaalsContact O-CG 3.24Å; L259-M263 WeakPolarHBondContact O-CG 3.34Å; L259-M263 PolarHBondContact O-N 2.86Å; R260-M263 CarbonylContact O-C 3.57Å; R260-M263 PolarHBondContact O-N 3.37Å; M263-S267 WeakPolarHBondContact O-CA 3.29Å; M263-S267 WeakPolarHBondContact O-CB 3.49Å; M263-S267 PolarHBondContact O-N 3.32Å; M263-S267 PolarHBondContact O-OG 3.26Å
264	V	73.6	Confident	69.9	Low	77 Å²	77	114 Å²	114	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-69.5	-49.6	173.9	168.4	0	0	0	0	109	R260 K261 F262 K266 S267 D268	R260-V264 WeakPolarHBondContact O-CB 3.34Å; R260-V264 VanDerWaalsContact O-CG2 3.22Å; R260-V264 WeakPolarHBondContact O-CG2 3.44Å; R260-V264 PolarHBondContact O-N 3.49Å; K261-V264 PolarHBondContact O-N 2.81Å; F262-V264 VanDerWaalsContact C-N 3.33Å; V264-K266 VanDerWaalsContact C-N 3.3Å; V264-K266 PolarHBondContact O-N 2.89Å; V264-S267 CarbonylContact O-C 3.58Å; V264-S267 PolarHBondContact O-N 2.91Å; V264-S267 VanDerWaalsContact O-N 3.15Å; V264-D268 VanDerWaalsContact CG1-OD2 3.24Å; V264-D268 WeakPolarHBondContact CG1-OD2 3.35Å; V264-D268 WeakPolarHBondContact O-CA 3.38Å; V264-D268 WeakPolarHBondContact O-CB 3.47Å; V264-D268 PolarHBondContact O-N 2.89Å
265	T	73.8	Confident	67.8	Low	96 Å²	96	115 Å²	115	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-56.9	-43.7	174.7	-54.8	0	0	0	0	111.8	K261 F262 E269	K261-T265 WeakPolarHBondContact O-CB 3.31Å; K261-T265 PolarHBondContact O-N 3.17Å; K261-T265 PolarHBondContact O-OG1 3.39Å; F262-T265 PolarHBondContact O-N 2.91Å; T265-E269 PolarHBondContact O-N 3.05Å
266	K	65.9	Low	66	Low	128 Å²	128	118 Å²	118	56%	0.557	55%	0.547	S	S	*	.	H	α-helix	trans	-72.9	-33.1	178.3	-151.8	-170.3	-168.2	-171.5	0	113.1	F262 V264 R270	F262-K266 HydrophobicContact CE1-CD 4.33Å; F262-K266 VanDerWaalsContact O-CB 3.3Å; F262-K266 WeakPolarHBondContact O-CB 3.33Å; F262-K266 PolarHBondContact O-N 3.29Å; V264-K266 VanDerWaalsContact C-N 3.3Å; V264-K266 PolarHBondContact O-N 2.89Å; K266-R270 PolarHBondContact O-N 3.06Å
267	S	58.5	Low	63.9	Low	65 Å²	65	118.3 Å²	118.3	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-77.7	-33	176	-64.4	0	0	0	0	111.3	M263 V264 R270 L271	M263-S267 WeakPolarHBondContact O-CA 3.29Å; M263-S267 WeakPolarHBondContact O-CB 3.49Å; M263-S267 PolarHBondContact O-N 3.32Å; M263-S267 PolarHBondContact O-OG 3.26Å; V264-S267 CarbonylContact O-C 3.58Å; V264-S267 PolarHBondContact O-N 2.91Å; V264-S267 VanDerWaalsContact O-N 3.15Å; S267-R270 CarbonylContact O-C 3.26Å; S267-R270 VanDerWaalsContact O-C 3.26Å; S267-R270 VanDerWaalsContact O-CA 3.28Å; S267-R270 WeakPolarHBondContact O-CA 3.45Å; S267-R270 VanDerWaalsContact O-CB 3.3Å; S267-R270 WeakPolarHBondContact O-CB 3.4Å; S267-R270 PolarHBondContact O-N 2.97Å; S267-L271 WeakPolarHBondContact O-CA 3.46Å; S267-L271 WeakPolarHBondContact O-CB 3.37Å; S267-L271 PolarHBondContact O-N 2.92Å
268	D	57.4	Low	61.9	Low	76 Å²	76	118 Å²	118	41%	0.406	56%	0.555	S	S	.	*	H	α-helix	trans	-68.8	-38	175.1	-76.4	-14.3	0	0	0	109.6	V264 R270 L271 E272	V264-D268 VanDerWaalsContact CG1-OD2 3.24Å; V264-D268 WeakPolarHBondContact CG1-OD2 3.35Å; V264-D268 WeakPolarHBondContact O-CA 3.38Å; V264-D268 WeakPolarHBondContact O-CB 3.47Å; V264-D268 PolarHBondContact O-N 2.89Å; D268-R270 PolarHBondContact O-N 3.21Å; D268-L271 PolarHBondContact O-N 2.96Å; D268-E272 PolarHBondContact O-N 2.78Å
269	E	52.8	Low	59.9	Low	150 Å²	150	117.5 Å²	117.5	70%	0.701	56%	0.557	S	S	*	*	H	α-helix	trans	-61.7	-25.5	168.7	-150.5	178.6	-162.7	0	0	112	T265	T265-E269 PolarHBondContact O-N 3.05Å
270	R	48.8	Very low	57.9	Low	208 Å²	208	125 Å²	125	79%	0.785	58%	0.58	S	S	*	*	H	α-helix	trans	-88.2	-26.1	170	-104.3	-177	172.1	-151.1	-2.5	114.3	K266 S267 D268 K274	K266-R270 PolarHBondContact O-N 3.06Å; S267-R270 CarbonylContact O-C 3.26Å; S267-R270 VanDerWaalsContact O-C 3.26Å; S267-R270 VanDerWaalsContact O-CA 3.28Å; S267-R270 WeakPolarHBondContact O-CA 3.45Å; S267-R270 VanDerWaalsContact O-CB 3.3Å; S267-R270 WeakPolarHBondContact O-CB 3.4Å; S267-R270 PolarHBondContact O-N 2.97Å; D268-R270 PolarHBondContact O-N 3.21Å; R270-K274 PolarHBondContact O-N 2.91Å
271	L	50.6	Low	56	Low	63 Å²	63	127.2 Å²	127.2	33%	0.33	59%	0.588	S	S	.	*	H	α-helix	trans	-92.9	-28.6	-171.4	-162.1	77.6	0	0	0	110.7	S267 D268 W273 K274 Q275	S267-L271 WeakPolarHBondContact O-CA 3.46Å; S267-L271 WeakPolarHBondContact O-CB 3.37Å; S267-L271 PolarHBondContact O-N 2.92Å; D268-L271 PolarHBondContact O-N 2.96Å; L271-W273 PolarHBondContact O-N 3.11Å; L271-W273 VanDerWaalsContact O-N 3.15Å; L271-K274 HydrophobicContact CD1-CB 4.2Å; L271-K274 CarbonylContact O-C 3.54Å; L271-K274 PolarHBondContact O-N 3.42Å; L271-Q275 VanDerWaalsContact CD2-OE1 3.26Å; L271-Q275 HydrophobicContact CG-CB 4.38Å; L271-Q275 WeakPolarHBondContact O-CB 3.45Å; L271-Q275 PolarHBondContact O-N 3.17Å
272	E	49.8	Very low	54	Low	162 Å²	162	132 Å²	132	76%	0.757	60%	0.603	S	S	*	*	H	α-helix	trans	-56	-31.6	166	-74.2	-160.6	158.8	0	0	111	D268	D268-E272 PolarHBondContact O-N 2.78Å
273	W	45.1	Very low	51.8	Low	222 Å²	222	134.2 Å²	134.2	84%	0.841	61%	0.612	S	S	*	*	H	α-helix	trans	-75.7	-35.8	170.9	-79.6	88	0	0	0	114.3	L271	L271-W273 PolarHBondContact O-N 3.11Å; L271-W273 VanDerWaalsContact O-N 3.15Å
274	K	47.2	Very low	50	Low	120 Å²	120	140.3 Å²	140.3	52%	0.522	63%	0.631	S	S	.	*	H	α-helix	trans	-85.9	-30.4	-178.2	-165.4	-178.7	177.4	-162.9	0	113.9	R270 L271 K276 A277 E278	R270-K274 PolarHBondContact O-N 2.91Å; L271-K274 HydrophobicContact CD1-CB 4.2Å; L271-K274 CarbonylContact O-C 3.54Å; L271-K274 PolarHBondContact O-N 3.42Å; K274-K276 VanDerWaalsContact C-N 3.3Å; K274-K276 PolarHBondContact O-N 3.45Å; K274-A277 CarbonylContact O-C 3.59Å; K274-A277 WeakPolarHBondContact O-CA 3.4Å; K274-A277 VanDerWaalsContact O-CB 3.31Å; K274-A277 WeakPolarHBondContact O-CB 3.38Å; K274-A277 PolarHBondContact O-N 3.3Å; K274-E278 WeakPolarHBondContact CE-OE2 3.47Å; K274-E278 IonicContact NZ-OE2 3.58Å; K274-E278 PolarHBondContact NZ-OE2 2.96Å; K274-E278 PolarHBondContact O-N 3.36Å
275	Q	49.7	Very low	47.8	Very low	103 Å²	103	140.5 Å²	140.5	48%	0.481	65%	0.648	S	S	.	*	H	α-helix	trans	-75.8	-22.4	-173.9	-154.4	148.9	12.6	0	0	112.2	L271 A277 N279	L271-Q275 VanDerWaalsContact CD2-OE1 3.26Å; L271-Q275 HydrophobicContact CG-CB 4.38Å; L271-Q275 WeakPolarHBondContact O-CB 3.45Å; L271-Q275 PolarHBondContact O-N 3.17Å; Q275-A277 PolarHBondContact O-N 2.82Å; Q275-N279 PolarHBondContact O-N 3.32Å
276	K	49.4	Very low	46.3	Very low	188 Å²	188	140.8 Å²	140.8	82%	0.817	66%	0.66	S	S	*	*	H	α-helix	trans	-62.7	-23.9	162.2	-118	176.6	-176	171.4	0	112.9	K274	K274-K276 VanDerWaalsContact C-N 3.3Å; K274-K276 PolarHBondContact O-N 3.45Å
277	A	47.3	Very low	45.3	Very low	68 Å²	68	140.3 Å²	140.3	56%	0.562	67%	0.668	S	S	*	*	H	α-helix	trans	-93.7	-33.2	176.4	0	0	0	0	0	113.6	K274 Q275	K274-A277 CarbonylContact O-C 3.59Å; K274-A277 WeakPolarHBondContact O-CA 3.4Å; K274-A277 VanDerWaalsContact O-CB 3.31Å; K274-A277 WeakPolarHBondContact O-CB 3.38Å; K274-A277 PolarHBondContact O-N 3.3Å; Q275-A277 PolarHBondContact O-N 2.82Å
278	E	46.1	Very low	44.5	Very low	55 Å²	55	139.9 Å²	139.9	26%	0.257	68%	0.675	S	S	.	*	H	α-helix	trans	-85.8	-16	-170.5	-159.1	129.1	-151.8	0	0	114.7	K274 R280 R281	K274-E278 WeakPolarHBondContact CE-OE2 3.47Å; K274-E278 IonicContact NZ-OE2 3.58Å; K274-E278 PolarHBondContact NZ-OE2 2.96Å; K274-E278 PolarHBondContact O-N 3.36Å; E278-R280 PolarHBondContact O-N 2.92Å; E278-R281 PolarHBondContact O-N 3.47Å; E278-R281 IonicContact OE1-CZ 3.64Å; E278-R281 IonicContact OE1-NH1 3.15Å; E278-R281 IonicContact OE1-NH2 2.65Å; E278-R281 PolarHBondContact OE1-NH2 3.4Å
279	N	45.2	Very low	44.3	Very low	126 Å²	126	143.7 Å²	143.7	67%	0.674	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-3.8	172.9	-81.4	-9.5	0	0	0	114.3	Q275	Q275-N279 PolarHBondContact O-N 3.32Å
280	R	42.5	Very low	44.2	Very low	232 Å²	232	143.4 Å²	143.4	88%	0.875	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-6.7	169.5	-78.9	-169	-97.2	-151.6	-3.8	115.5	E278	E278-R280 PolarHBondContact O-N 2.92Å
281	R	40.3	Very low	44.3	Very low	181 Å²	181	136.8 Å²	136.8	68%	0.683	68%	0.682	S	S	*	*	S	Bend	trans	-117.9	14.3	-172.3	-146.4	173.2	70.2	-112.5	-8.9	116.1	E278	E278-R281 PolarHBondContact O-N 3.47Å; E278-R281 IonicContact OE1-CZ 3.64Å; E278-R281 IonicContact OE1-NH1 3.15Å; E278-R281 IonicContact OE1-NH2 2.65Å; E278-R281 PolarHBondContact OE1-NH2 3.4Å
282	R	40.1	Very low	44.5	Very low	230 Å²	230	138.8 Å²	138.8	87%	0.868	69%	0.689	S	S	*	*			trans	-104.2	37.4	-179.3	-84.3	-164.2	167.6	-168.4	-1.6	115.3
283	K	30.2	Very low	44.9	Very low	168 Å²	168	137.7 Å²	137.7	73%	0.73	68%	0.684	S	S	*	*	S	Bend	trans	-117.8	137.2	156.6	-69.8	-175.7	178.4	-177.9	0	106.6
284	Y	34.9	Very low	45.5	Very low	229 Å²	229	134.4 Å²	134.4	90%	0.898	68%	0.678	S	S	*	*			trans	98.7	111.1	173.5	-44.5	-61.5	0	0	0	118.2
285	G	27.9	Very low	46.1	Very low	80 Å²	80	137.5 Å²	137.5	83%	0.825	69%	0.687	S	S	*	*			trans	103	133.8	149	0	0	0	0	0	115.2
286	A	42.8	Very low	46.8	Very low	102 Å²	102	135.8 Å²	135.8	84%	0.843	69%	0.686	S	S	*	*			cis	-160.7	113.7	2.8	0	0	0	0	0	107.8
287	T	43.9	Very low	47.5	Very low	118 Å²	118	132.1 Å²	132.1	72%	0.724	68%	0.675	S	S	*	*			trans	-116.2	100.8	177.7	-52.9	0	0	0	0	107.5
288	G	43.5	Very low	48.4	Very low	57 Å²	57	134.6 Å²	134.6	59%	0.588	67%	0.673	S	S	*	*			trans	-74.5	127.7	-173.1	0	0	0	0	0	113.1	I290	G288-I290 PolarHBondContact O-N 3.36Å
289	E	52.3	Low	49.4	Very low	155 Å²	155	136.4 Å²	136.4	72%	0.724	68%	0.683	S	S	*	*	H	α-helix	trans	-74.4	-25.3	-165.5	-151.7	166.2	-167.5	0	0	113.9	Q292 Q293	E289-Q292 WeakPolarHBondContact O-CB 3.38Å; E289-Q292 PolarHBondContact O-N 2.87Å; E289-Q293 PolarHBondContact O-N 3.29Å; E289-Q293 VanDerWaalsContact O-N 3.12Å
290	I	51.5	Low	50.7	Low	144 Å²	144	136 Å²	136	74%	0.738	68%	0.677	S	S	*	*	H	α-helix	trans	-75.8	-34.4	-175.7	-60.5	166.1	0	0	0	112	G288 Q292 Q293	G288-I290 PolarHBondContact O-N 3.36Å; I290-Q292 VanDerWaalsContact C-N 3.26Å; I290-Q292 PolarHBondContact O-N 2.96Å; I290-Q293 PolarHBondContact O-N 3.16Å
291	A	51.1	Low	52.1	Low	70 Å²	70	131.4 Å²	131.4	58%	0.579	67%	0.666	S	S	*	*	H	α-helix	trans	-71.9	-25.2	171.4	0	0	0	0	0	112	R295	A291-R295 PolarHBondContact O-N 2.95Å
292	Q	54.9	Low	53.6	Low	105 Å²	105	130 Å²	130	49%	0.491	66%	0.661	S	S	.	*	H	α-helix	trans	-71.5	-36.2	175.7	-116.1	173	-10.2	0	0	111.8	E289 I290 R295 S296	E289-Q292 WeakPolarHBondContact O-CB 3.38Å; E289-Q292 PolarHBondContact O-N 2.87Å; I290-Q292 VanDerWaalsContact C-N 3.26Å; I290-Q292 PolarHBondContact O-N 2.96Å; Q292-R295 CarbonylContact O-C 3.58Å; Q292-R295 PolarHBondContact O-N 2.71Å; Q292-S296 VanDerWaalsContact O-CB 3.27Å; Q292-S296 WeakPolarHBondContact O-CB 3.29Å; Q292-S296 PolarHBondContact O-N 3.18Å
293	Q	56.6	Low	55.2	Low	138 Å²	138	124.4 Å²	124.4	65%	0.645	65%	0.645	S	S	*	*	H	α-helix	trans	-67.9	-42.9	178.5	-109	174.9	2.3	0	0	113.5	E289 I290 R295 S296 L297	E289-Q293 PolarHBondContact O-N 3.29Å; E289-Q293 VanDerWaalsContact O-N 3.12Å; I290-Q293 PolarHBondContact O-N 3.16Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-S296 WeakPolarHBondContact O-CB 3.43Å; Q293-S296 PolarHBondContact O-N 3.15Å; Q293-S296 VanDerWaalsContact O-N 3.11Å; Q293-L297 PolarHBondContact O-N 3.1Å
294	Q	58.7	Low	57.1	Low	153 Å²	153	120.3 Å²	120.3	72%	0.715	64%	0.638	S	S	*	*	H	α-helix	trans	-65.9	-38	174	-75.1	-172.4	-2.5	0	0	112	S296 K298	Q294-S296 VanDerWaalsContact C-N 3.31Å; Q294-K298 WeakPolarHBondContact O-CB 3.36Å; Q294-K298 PolarHBondContact O-N 2.97Å
295	R	59.5	Low	58.9	Low	186 Å²	186	111.7 Å²	111.7	70%	0.702	61%	0.614	S	S	*	*	H	α-helix	trans	-61.1	-42.6	169.1	-86.9	-176.5	178.5	-167.2	-0.1	110.9	A291 Q292 Q293 K298 I299	A291-R295 PolarHBondContact O-N 2.95Å; Q292-R295 CarbonylContact O-C 3.58Å; Q292-R295 PolarHBondContact O-N 2.71Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; R295-K298 PolarHBondContact O-N 3.48Å; R295-I299 HydrophobicContact CB-CD1 4.07Å; R295-I299 WeakPolarHBondContact O-CB 3.41Å; R295-I299 VanDerWaalsContact O-CD1 3.26Å; R295-I299 WeakPolarHBondContact O-CD1 3.33Å; R295-I299 WeakPolarHBondContact O-CG1 3.05Å; R295-I299 PolarHBondContact O-N 3.37Å
296	S	64.3	Low	60.8	Low	66 Å²	66	109.9 Å²	109.9	46%	0.462	59%	0.585	S	S	.	*	H	α-helix	trans	-62.8	-44.1	-177.8	-170.2	0	0	0	0	112.1	Q292 Q293 Q294 I299 Q300	Q292-S296 VanDerWaalsContact O-CB 3.27Å; Q292-S296 WeakPolarHBondContact O-CB 3.29Å; Q292-S296 PolarHBondContact O-N 3.18Å; Q293-S296 WeakPolarHBondContact O-CB 3.43Å; Q293-S296 PolarHBondContact O-N 3.15Å; Q293-S296 VanDerWaalsContact O-N 3.11Å; Q294-S296 VanDerWaalsContact C-N 3.31Å; S296-I299 PolarHBondContact O-N 3.47Å; S296-Q300 VanDerWaalsContact O-CB 3.29Å; S296-Q300 WeakPolarHBondContact O-CB 3.37Å; S296-Q300 PolarHBondContact O-N 2.87Å
297	L	63.3	Low	62.2	Low	112 Å²	112	108.9 Å²	108.9	59%	0.586	57%	0.565	S	S	*	*	H	α-helix	trans	-64.8	-44.4	176.7	-75	172.7	0	0	0	111.5	Q293 I299 Q300 E301	Q293-L297 PolarHBondContact O-N 3.1Å; L297-I299 VanDerWaalsContact C-N 3.32Å; L297-I299 PolarHBondContact O-N 2.78Å; L297-Q300 PolarHBondContact O-N 3.21Å; L297-Q300 VanDerWaalsContact O-N 3.17Å; L297-E301 PolarHBondContact O-N 3.37Å
298	K	67.1	Low	63.5	Low	120 Å²	120	112.3 Å²	112.3	52%	0.522	57%	0.565	S	S	.	*	H	α-helix	trans	-66.6	-36.6	177.8	-139.4	164.6	-168.4	174.6	0	112	Q294 R295 Q300 Y302	Q294-K298 WeakPolarHBondContact O-CB 3.36Å; Q294-K298 PolarHBondContact O-N 2.97Å; R295-K298 PolarHBondContact O-N 3.48Å; K298-Q300 VanDerWaalsContact C-N 3.35Å; K298-Y302 HydrophobicContact CG-CE2 3.91Å; K298-Y302 WeakPolarHBondContact O-CD2 3.25Å; K298-Y302 VanDerWaalsContact O-CG 3.29Å; K298-Y302 PolarHBondContact O-N 2.87Å
299	I	67.8	Low	64.6	Low	93 Å²	93	112.5 Å²	112.5	48%	0.477	55%	0.552	S	S	.	*	H	α-helix	trans	-63.7	-42.6	172.4	-73.2	161.4	0	0	0	109.7	R295 S296 L297 Y302 E303	R295-I299 HydrophobicContact CB-CD1 4.07Å; R295-I299 WeakPolarHBondContact O-CB 3.41Å; R295-I299 VanDerWaalsContact O-CD1 3.26Å; R295-I299 WeakPolarHBondContact O-CD1 3.33Å; R295-I299 WeakPolarHBondContact O-CG1 3.05Å; R295-I299 PolarHBondContact O-N 3.37Å; S296-I299 PolarHBondContact O-N 3.47Å; L297-I299 VanDerWaalsContact C-N 3.32Å; L297-I299 PolarHBondContact O-N 2.78Å; I299-Y302 CarbonylContact O-C 3.54Å; I299-Y302 PolarHBondContact O-N 3.44Å; I299-E303 WeakPolarHBondContact O-CB 3.46Å; I299-E303 PolarHBondContact O-N 3.36Å
300	Q	72.5	Confident	65.4	Low	117 Å²	117	107.9 Å²	107.9	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-67.5	-38.7	179.5	-169	-178.9	5.4	0	0	112.3	S296 L297 K298 E303 S304	S296-Q300 VanDerWaalsContact O-CB 3.29Å; S296-Q300 WeakPolarHBondContact O-CB 3.37Å; S296-Q300 PolarHBondContact O-N 2.87Å; L297-Q300 PolarHBondContact O-N 3.21Å; L297-Q300 VanDerWaalsContact O-N 3.17Å; K298-Q300 VanDerWaalsContact C-N 3.35Å; Q300-E303 PolarHBondContact O-N 2.91Å; Q300-S304 VanDerWaalsContact O-CB 3.29Å; Q300-S304 WeakPolarHBondContact O-CB 3.27Å; Q300-S304 PolarHBondContact O-N 2.91Å
301	E	71.7	Confident	66.2	Low	136 Å²	136	108.5 Å²	108.5	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-45.6	172.2	-74.2	-178.4	161.7	0	0	111.4	L297 S304 A305	L297-E301 PolarHBondContact O-N 3.37Å; E301-S304 PolarHBondContact O-N 3.22Å; E301-A305 WeakPolarHBondContact O-CB 3.44Å; E301-A305 PolarHBondContact O-N 3.34Å
302	Y	72.1	Confident	67	Low	151 Å²	151	111.1 Å²	111.1	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-65.2	-38.7	174.6	-66.8	-42.2	0	0	0	112.1	K298 I299 A305 M306	K298-Y302 HydrophobicContact CG-CE2 3.91Å; K298-Y302 WeakPolarHBondContact O-CD2 3.25Å; K298-Y302 VanDerWaalsContact O-CG 3.29Å; K298-Y302 PolarHBondContact O-N 2.87Å; I299-Y302 CarbonylContact O-C 3.54Å; I299-Y302 PolarHBondContact O-N 3.44Å; Y302-A305 PolarHBondContact O-N 3.28Å; Y302-M306 WeakPolarHBondContact O-CB 3.48Å; Y302-M306 PolarHBondContact O-N 3.47Å
303	E	71.7	Confident	67.5	Low	112 Å²	112	107.2 Å²	107.2	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-63.7	-42.7	174.7	-112	-175.9	155.3	0	0	111.3	I299 Q300 M306 N307	I299-E303 WeakPolarHBondContact O-CB 3.46Å; I299-E303 PolarHBondContact O-N 3.36Å; Q300-E303 PolarHBondContact O-N 2.91Å; E303-M306 PolarHBondContact O-N 3.06Å; E303-N307 VanDerWaalsContact O-CB 3.22Å; E303-N307 WeakPolarHBondContact O-CB 3.48Å; E303-N307 PolarHBondContact O-N 3.43Å; E303-N307 PolarHBondContact O-ND2 2.88Å
304	S	72	Confident	67.8	Low	82 Å²	82	104 Å²	104	57%	0.573	53%	0.525	S	S	*	.	H	α-helix	trans	-64.4	-46.1	177.2	-175.2	0	0	0	0	111.2	Q300 E301 M306 R308	Q300-S304 VanDerWaalsContact O-CB 3.29Å; Q300-S304 WeakPolarHBondContact O-CB 3.27Å; Q300-S304 PolarHBondContact O-N 2.91Å; E301-S304 PolarHBondContact O-N 3.22Å; S304-M306 VanDerWaalsContact C-N 3.33Å; S304-M306 PolarHBondContact O-N 2.94Å; S304-R308 WeakPolarHBondContact O-CB 3.47Å; S304-R308 PolarHBondContact O-N 2.87Å
305	A	70.7	Confident	67.7	Low	49 Å²	49	100.7 Å²	100.7	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-41.5	173.3	0	0	0	0	0	111.5	E301 Y302 R308 L309	E301-A305 WeakPolarHBondContact O-CB 3.44Å; E301-A305 PolarHBondContact O-N 3.34Å; Y302-A305 PolarHBondContact O-N 3.28Å; A305-R308 PolarHBondContact O-N 3.05Å; A305-L309 VanDerWaalsContact O-CG 3.25Å; A305-L309 WeakPolarHBondContact O-CG 3.3Å; A305-L309 PolarHBondContact O-N 3.01Å
306	M	69.2	Low	68	Low	42 Å²	42	97.2 Å²	97.2	21%	0.207	51%	0.512	C	S	.	.	H	α-helix	trans	-69.1	-42.3	-179.3	-158.5	68	-173.8	0	0	112.2	Y302 E303 S304 R308 L309 Q310 V318 M321	Y302-M306 WeakPolarHBondContact O-CB 3.48Å; Y302-M306 PolarHBondContact O-N 3.47Å; E303-M306 PolarHBondContact O-N 3.06Å; S304-M306 VanDerWaalsContact C-N 3.33Å; S304-M306 PolarHBondContact O-N 2.94Å; M306-R308 VanDerWaalsContact C-N 3.3Å; M306-R308 PolarHBondContact O-N 2.91Å; M306-L309 CarbonylContact O-C 3.55Å; M306-L309 PolarHBondContact O-N 3.33Å; M306-L309 HydrophobicContact SD-CD1 4.31Å; M306-Q310 WeakPolarHBondContact O-CB 3.45Å; M306-Q310 WeakPolarHBondContact O-CG 3.49Å; M306-Q310 PolarHBondContact O-N 3.48Å; M306-V318 HydrophobicContact CE-CB 3.67Å; M306-V318 HydrophobicContact CE-CG1 3.49Å; M306-V318 VanDerWaalsContact CE-CG1 3.49Å; M306-V318 HydrophobicContact CE-CG2 3.65Å; M306-M321 HydrophobicContact CE-CB 4.29Å; M306-M321 HydrophobicContact CE-CE 3.81Å; M306-M321 HydrophobicContact CE-SD 3.8Å; M306-M321 HydrophobicContact SD-CE 4.38Å
307	N	70.9	Confident	68.1	Low	80 Å²	80	97.6 Å²	97.6	43%	0.428	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-39.7	174.2	-76.1	-24.8	0	0	0	110.7	E303 Q310 L311	E303-N307 VanDerWaalsContact O-CB 3.22Å; E303-N307 WeakPolarHBondContact O-CB 3.48Å; E303-N307 PolarHBondContact O-N 3.43Å; E303-N307 PolarHBondContact O-ND2 2.88Å; N307-Q310 PolarHBondContact O-N 3.18Å; N307-L311 PolarHBondContact O-N 3.12Å
308	R	72	Confident	68.3	Low	191 Å²	191	95.9 Å²	95.9	72%	0.721	50%	0.503	S	S	*	.	H	α-helix	trans	-63.8	-41.7	173.3	-168.2	173.7	-176.5	135.4	0.1	111.9	S304 A305 M306 L311 I312	S304-R308 WeakPolarHBondContact O-CB 3.47Å; S304-R308 PolarHBondContact O-N 2.87Å; A305-R308 PolarHBondContact O-N 3.05Å; M306-R308 VanDerWaalsContact C-N 3.3Å; M306-R308 PolarHBondContact O-N 2.91Å; R308-L311 PolarHBondContact O-N 2.95Å; R308-I312 WeakPolarHBondContact O-CG1 3.48Å; R308-I312 PolarHBondContact O-N 3.41Å
309	L	66.6	Low	68.7	Low	60 Å²	60	94.8 Å²	94.8	31%	0.314	50%	0.5	S	S	.	.	H	α-helix	trans	-67.1	-37.5	174.7	-68.1	167.9	0	0	0	111.6	A305 M306 I312 T313 M321 Y325	A305-L309 VanDerWaalsContact O-CG 3.25Å; A305-L309 WeakPolarHBondContact O-CG 3.3Å; A305-L309 PolarHBondContact O-N 3.01Å; M306-L309 CarbonylContact O-C 3.55Å; M306-L309 PolarHBondContact O-N 3.33Å; M306-L309 HydrophobicContact SD-CD1 4.31Å; L309-I312 PolarHBondContact O-N 2.88Å; L309-T313 VanDerWaalsContact O-CB 3.28Å; L309-T313 WeakPolarHBondContact O-CB 3.42Å; L309-T313 PolarHBondContact O-N 3.36Å; L309-T313 PolarHBondContact O-OG1 3.3Å; L309-M321 HydrophobicContact CB-CE 3.24Å; L309-M321 WeakPolarHBondContact O-CE 3.43Å; L309-Y325 HydrophobicContact CB-CE2 4.38Å; L309-Y325 HydrophobicContact CD2-CE1 4.28Å; L309-Y325 HydrophobicContact CD2-CE2 3.82Å; L309-Y325 WeakPolarHBondContact CD2-OH 3.37Å
310	Q	68.5	Low	69	Low	58 Å²	58	95.5 Å²	95.5	27%	0.271	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-40.6	176.5	-80.2	180	9.4	0	0	110.8	M306 N307 I312 T313 G314 M321	M306-Q310 WeakPolarHBondContact O-CB 3.45Å; M306-Q310 WeakPolarHBondContact O-CG 3.49Å; M306-Q310 PolarHBondContact O-N 3.48Å; N307-Q310 PolarHBondContact O-N 3.18Å; Q310-I312 VanDerWaalsContact C-N 3.35Å; Q310-I312 PolarHBondContact O-N 2.82Å; Q310-T313 PolarHBondContact O-N 2.92Å; Q310-G314 WeakPolarHBondContact O-CA 3.38Å; Q310-G314 PolarHBondContact O-N 3.07Å; Q310-M321 HydrophobicContact CB-CE 4.4Å; Q310-M321 HydrophobicContact CB-SD 4.32Å; Q310-M321 HydrophobicContact CG-CE 3.88Å; Q310-M321 HydrophobicContact CG-SD 3.42Å; Q310-M321 WeakPolarHBondContact CG-SD 3.48Å; Q310-M321 VanDerWaalsContact N-CE 3.31Å
311	L	68.1	Low	68.9	Low	157 Å²	157	90 Å²	90	82%	0.822	48%	0.475	S	S	*	.	H	α-helix	trans	-62.2	-39.6	176.5	-125.6	120.6	0	0	0	112.5	N307 R308	N307-L311 PolarHBondContact O-N 3.12Å; R308-L311 PolarHBondContact O-N 2.95Å
312	I	67.7	Low	69	Low	125 Å²	125	87.2 Å²	87.2	64%	0.641	47%	0.468	S	S	*	.	H	α-helix	trans	-74.3	-40.6	177.5	-64.3	168.6	0	0	0	111.2	R308 L309 Q310	R308-I312 WeakPolarHBondContact O-CG1 3.48Å; R308-I312 PolarHBondContact O-N 3.41Å; L309-I312 PolarHBondContact O-N 2.88Å; Q310-I312 VanDerWaalsContact C-N 3.35Å; Q310-I312 PolarHBondContact O-N 2.82Å
313	T	66	Low	69.4	Low	24 Å²	24	87.9 Å²	87.9	15%	0.147	47%	0.469	C	S	.	.	H	α-helix	trans	-86.7	-22.2	-171	-45.5	0	0	0	0	112.6	L309 Q310 K315 M321 Y324 Y325	L309-T313 VanDerWaalsContact O-CB 3.28Å; L309-T313 WeakPolarHBondContact O-CB 3.42Å; L309-T313 PolarHBondContact O-N 3.36Å; L309-T313 PolarHBondContact O-OG1 3.3Å; Q310-T313 PolarHBondContact O-N 2.92Å; T313-K315 HydrophobicContact CG2-CB 4.16Å; T313-K315 HydrophobicContact CG2-CD 3.95Å; T313-K315 HydrophobicContact CG2-CG 4.11Å; T313-K315 PolarHBondContact O-N 3.43Å; T313-M321 HydrophobicContact CG2-CG 4.15Å; T313-Y324 HydrophobicContact CG2-CD1 3.91Å; T313-Y324 HydrophobicContact CG2-CE1 4.25Å; T313-Y325 WeakPolarHBondContact OG1-CE2 3.3Å; T313-Y325 PolarHBondContact OG1-OH 3.24Å
314	G	62.7	Low	69.8	Low	71 Å²	71	87.2 Å²	87.2	73%	0.732	46%	0.463	S	S	*	.			trans	64.4	13.7	-176.5	0	0	0	0	0	114.4	Q310	Q310-G314 WeakPolarHBondContact O-CA 3.38Å; Q310-G314 PolarHBondContact O-N 3.07Å
315	K	58.2	Low	70.2	Confident	83 Å²	83	87.1 Å²	87.1	36%	0.361	45%	0.45	S	S	.	.			trans	-113.5	129.8	-176.5	-67.1	178	-170.5	164.7	0	109.8	T313 M321	T313-K315 HydrophobicContact CG2-CB 4.16Å; T313-K315 HydrophobicContact CG2-CD 3.95Å; T313-K315 HydrophobicContact CG2-CG 4.11Å; T313-K315 PolarHBondContact O-N 3.43Å; K315-M321 HydrophobicContact CB-CG 4.2Å; K315-M321 VanDerWaalsContact O-SD 3.36Å
316	S	63.9	Low	70.8	Confident	113 Å²	113	91 Å²	91	79%	0.79	46%	0.458	S	S	*	.			trans	-83	-9.4	-172.6	-162.8	0	0	0	0	114.7
317	D	68.3	Low	71.6	Confident	73 Å²	73	96.6 Å²	96.6	39%	0.39	48%	0.477	S	S	.	.			trans	-109.9	121.7	-173.1	-178.2	16.4	0	0	0	111.7	E319 Q320 M321	D317-E319 VanDerWaalsContact C-N 3.28Å; D317-E319 PolarHBondContact O-N 2.94Å; D317-E319 PolarHBondContact OD1-N 2.72Å; D317-Q320 HydrophobicContact CB-CB 4.28Å; D317-Q320 HydrophobicContact CB-CG 4.29Å; D317-Q320 PolarHBondContact O-N 3.46Å; D317-Q320 WeakPolarHBondContact OD2-CG 3.5Å; D317-Q320 PolarHBondContact OD2-NE2 2.95Å; D317-M321 WeakPolarHBondContact O-CG 3.48Å; D317-M321 PolarHBondContact O-N 3.39Å
318	V	67.3	Low	72.3	Confident	77 Å²	77	95.1 Å²	95.1	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-57	-39.8	-176.2	171	0	0	0	0	112.2	M306 M321 T322	M306-V318 HydrophobicContact CE-CB 3.67Å; M306-V318 HydrophobicContact CE-CG1 3.49Å; M306-V318 VanDerWaalsContact CE-CG1 3.49Å; M306-V318 HydrophobicContact CE-CG2 3.65Å; V318-M321 PolarHBondContact O-N 3.5Å; V318-T322 PolarHBondContact O-N 3.45Å; V318-T322 PolarHBondContact O-OG1 3.24Å
319	E	73.8	Confident	73	Confident	97 Å²	97	92.1 Å²	92.1	45%	0.453	46%	0.463	S	S	.	.	H	α-helix	trans	-68.6	-43.7	-178.3	178.8	65.1	-159.9	0	0	110.8	D317 M321 T322 R323	D317-E319 VanDerWaalsContact C-N 3.28Å; D317-E319 PolarHBondContact O-N 2.94Å; D317-E319 PolarHBondContact OD1-N 2.72Å; E319-M321 VanDerWaalsContact C-N 3.34Å; E319-M321 PolarHBondContact O-N 3.38Å; E319-T322 PolarHBondContact O-N 2.81Å; E319-R323 PolarHBondContact O-N 2.85Å; E319-R323 IonicContact OE1-CZ 2.87Å; E319-R323 IonicContact OE1-NE 3.48Å; E319-R323 PolarHBondContact OE1-NE 3.03Å; E319-R323 VanDerWaalsContact OE1-NE 3.15Å; E319-R323 IonicContact OE1-NH2 2.72Å; E319-R323 PolarHBondContact OE1-NH2 3.08Å
320	Q	75.6	Confident	73.9	Confident	107 Å²	107	93 Å²	93	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-36.2	177.5	-72.1	-179.8	65.7	0	0	112.2	D317 Y324	D317-Q320 HydrophobicContact CB-CB 4.28Å; D317-Q320 HydrophobicContact CB-CG 4.29Å; D317-Q320 PolarHBondContact O-N 3.46Å; D317-Q320 WeakPolarHBondContact OD2-CG 3.5Å; D317-Q320 PolarHBondContact OD2-NE2 2.95Å; Q320-Y324 WeakPolarHBondContact O-CB 3.12Å; Q320-Y324 PolarHBondContact O-N 2.88Å
321	M	69.3	Low	74.9	Confident	2 Å²	2	93.4 Å²	93.4	1%	0.01	47%	0.472	C	S	.	.	H	α-helix	trans	-63.9	-45.6	172.2	-71.1	172.6	62.6	0	0	111.6	M306 L309 Q310 T313 K315 D317 V318 E319 R323 Y324 Y325	M306-M321 HydrophobicContact CE-CB 4.29Å; M306-M321 HydrophobicContact CE-CE 3.81Å; M306-M321 HydrophobicContact CE-SD 3.8Å; M306-M321 HydrophobicContact SD-CE 4.38Å; L309-M321 HydrophobicContact CB-CE 3.24Å; L309-M321 WeakPolarHBondContact O-CE 3.43Å; Q310-M321 HydrophobicContact CB-CE 4.4Å; Q310-M321 HydrophobicContact CB-SD 4.32Å; Q310-M321 HydrophobicContact CG-CE 3.88Å; Q310-M321 HydrophobicContact CG-SD 3.42Å; Q310-M321 WeakPolarHBondContact CG-SD 3.48Å; Q310-M321 VanDerWaalsContact N-CE 3.31Å; T313-M321 HydrophobicContact CG2-CG 4.15Å; K315-M321 HydrophobicContact CB-CG 4.2Å; K315-M321 VanDerWaalsContact O-SD 3.36Å; D317-M321 WeakPolarHBondContact O-CG 3.48Å; D317-M321 PolarHBondContact O-N 3.39Å; V318-M321 PolarHBondContact O-N 3.5Å; E319-M321 VanDerWaalsContact C-N 3.34Å; E319-M321 PolarHBondContact O-N 3.38Å; M321-R323 VanDerWaalsContact C-N 3.34Å; M321-R323 PolarHBondContact O-N 2.92Å; M321-Y324 PolarHBondContact O-N 3.49Å; M321-Y325 HydrophobicContact CE-CE2 4.48Å; M321-Y325 VanDerWaalsContact O-CD2 3.26Å; M321-Y325 WeakPolarHBondContact O-CD2 3.29Å; M321-Y325 PolarHBondContact O-N 3.25Å
322	T	73.4	Confident	75.7	Confident	77 Å²	77	91.3 Å²	91.3	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-43.3	-180	-54.7	0	0	0	0	111.4	V318 E319 Y325 K326	V318-T322 PolarHBondContact O-N 3.45Å; V318-T322 PolarHBondContact O-OG1 3.24Å; E319-T322 PolarHBondContact O-N 2.81Å; T322-Y325 PolarHBondContact O-N 2.9Å; T322-K326 VanDerWaalsContact O-CB 3.28Å; T322-K326 WeakPolarHBondContact O-CB 3.38Å; T322-K326 PolarHBondContact O-N 3.28Å
323	R	80.9	Confident	76.8	Confident	165 Å²	165	90.9 Å²	90.9	62%	0.623	46%	0.455	S	S	*	.	H	α-helix	trans	-65.1	-40.4	175.4	-67.3	-171.4	-149.5	166.8	8.5	112.6	E319 M321 R327	E319-R323 PolarHBondContact O-N 2.85Å; E319-R323 IonicContact OE1-CZ 2.87Å; E319-R323 IonicContact OE1-NE 3.48Å; E319-R323 PolarHBondContact OE1-NE 3.03Å; E319-R323 VanDerWaalsContact OE1-NE 3.15Å; E319-R323 IonicContact OE1-NH2 2.72Å; E319-R323 PolarHBondContact OE1-NH2 3.08Å; M321-R323 VanDerWaalsContact C-N 3.34Å; M321-R323 PolarHBondContact O-N 2.92Å; R323-R327 VanDerWaalsContact O-CB 3.3Å; R323-R327 WeakPolarHBondContact O-CB 3.18Å; R323-R327 PolarHBondContact O-N 3.48Å
324	Y	80.7	Confident	78	Confident	99 Å²	99	93.8 Å²	93.8	39%	0.388	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-45.6	177	178	-103.3	0	0	0	111.8	T313 Q320 M321 R327 N328	T313-Y324 HydrophobicContact CG2-CD1 3.91Å; T313-Y324 HydrophobicContact CG2-CE1 4.25Å; Q320-Y324 WeakPolarHBondContact O-CB 3.12Å; Q320-Y324 PolarHBondContact O-N 2.88Å; M321-Y324 PolarHBondContact O-N 3.49Å; Y324-R327 PolarHBondContact O-N 2.94Å; Y324-N328 WeakPolarHBondContact CE1-ND2 3.44Å; Y324-N328 WeakPolarHBondContact O-CB 3.44Å; Y324-N328 PolarHBondContact O-N 3.4Å; Y324-N328 PolarHBondContact O-OD1 3.23Å; Y324-N328 PolarHBondContact OH-ND2 3.36Å
325	Y	80.2	Confident	79.2	Confident	79 Å²	79	96.1 Å²	96.1	31%	0.31	47%	0.467	S	S	.	.	H	α-helix	trans	-67.6	-39.2	177.1	-82.6	-70.5	0	0	0	112.9	L309 T313 M321 T322 N328 E329	L309-Y325 HydrophobicContact CB-CE2 4.38Å; L309-Y325 HydrophobicContact CD2-CE1 4.28Å; L309-Y325 HydrophobicContact CD2-CE2 3.82Å; L309-Y325 WeakPolarHBondContact CD2-OH 3.37Å; T313-Y325 WeakPolarHBondContact OG1-CE2 3.3Å; T313-Y325 PolarHBondContact OG1-OH 3.24Å; M321-Y325 HydrophobicContact CE-CE2 4.48Å; M321-Y325 VanDerWaalsContact O-CD2 3.26Å; M321-Y325 WeakPolarHBondContact O-CD2 3.29Å; M321-Y325 PolarHBondContact O-N 3.25Å; T322-Y325 PolarHBondContact O-N 2.9Å; Y325-N328 CarbonylContact O-C 3.58Å; Y325-N328 PolarHBondContact O-N 2.86Å; Y325-E329 VanDerWaalsContact O-CB 3.31Å; Y325-E329 WeakPolarHBondContact O-CB 3.49Å; Y325-E329 PolarHBondContact O-N 2.84Å
326	K	83.3	Confident	80.7	Confident	131 Å²	131	98.7 Å²	98.7	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-63.4	-42.9	175.3	-171.9	170	-176.3	173.7	0	111.8	T322 E329 D330	T322-K326 VanDerWaalsContact O-CB 3.28Å; T322-K326 WeakPolarHBondContact O-CB 3.38Å; T322-K326 PolarHBondContact O-N 3.28Å; K326-E329 WeakPolarHBondContact O-CB 3.21Å; K326-E329 PolarHBondContact O-N 3.42Å; K326-D330 PolarHBondContact O-N 2.93Å
327	R	85.9	Confident	82	Confident	159 Å²	159	98.9 Å²	98.9	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-58.8	-49.5	172.6	-174.3	91	-175.7	126.7	8	110.9	R323 Y324 E329 D330 D331	R323-R327 VanDerWaalsContact O-CB 3.3Å; R323-R327 WeakPolarHBondContact O-CB 3.18Å; R323-R327 PolarHBondContact O-N 3.48Å; Y324-R327 PolarHBondContact O-N 2.94Å; R327-E329 VanDerWaalsContact C-N 3.3Å; R327-E329 PolarHBondContact O-N 3.28Å; R327-D330 PolarHBondContact O-N 3.42Å; R327-D331 WeakPolarHBondContact O-CB 3.42Å; R327-D331 VanDerWaalsContact O-CG 3.28Å; R327-D331 PolarHBondContact O-N 2.9Å
328	N	86.4	Confident	83.2	Confident	49 Å²	49	102.1 Å²	102.1	26%	0.262	47%	0.472	S	S	.	.	H	α-helix	trans	-65.4	-32.6	178.6	-74.4	21.3	0	0	0	112.4	Y324 Y325 N332	Y324-N328 WeakPolarHBondContact CE1-ND2 3.44Å; Y324-N328 WeakPolarHBondContact O-CB 3.44Å; Y324-N328 PolarHBondContact O-N 3.4Å; Y324-N328 PolarHBondContact O-OD1 3.23Å; Y324-N328 PolarHBondContact OH-ND2 3.36Å; Y325-N328 CarbonylContact O-C 3.58Å; Y325-N328 PolarHBondContact O-N 2.86Å; N328-N332 WeakPolarHBondContact O-CB 3.38Å; N328-N332 PolarHBondContact O-N 2.93Å; N328-N332 PolarHBondContact O-ND2 3.34Å
329	E	85.4	Confident	84.5	Confident	129 Å²	129	101.9 Å²	101.9	60%	0.603	47%	0.471	S	S	*	.	H	α-helix	trans	-65.5	-48.1	173.5	-172.1	-162.7	178.5	0	0	110.6	Y325 K326 R327 D331 N332 F333	Y325-E329 VanDerWaalsContact O-CB 3.31Å; Y325-E329 WeakPolarHBondContact O-CB 3.49Å; Y325-E329 PolarHBondContact O-N 2.84Å; K326-E329 WeakPolarHBondContact O-CB 3.21Å; K326-E329 PolarHBondContact O-N 3.42Å; R327-E329 VanDerWaalsContact C-N 3.3Å; R327-E329 PolarHBondContact O-N 3.28Å; E329-D331 VanDerWaalsContact C-N 3.34Å; E329-D331 PolarHBondContact O-N 2.98Å; E329-N332 PolarHBondContact O-N 2.99Å; E329-F333 VanDerWaalsContact O-CB 3.24Å; E329-F333 WeakPolarHBondContact O-CB 3.47Å; E329-F333 PolarHBondContact O-N 3.49Å
330	D	87.2	Confident	85.4	Confident	78 Å²	78	100.5 Å²	100.5	42%	0.417	47%	0.469	S	S	.	.	H	α-helix	trans	-61.2	-42.7	176.9	-72.7	-27.1	0	0	0	111.4	K326 R327 F333 T334	K326-D330 PolarHBondContact O-N 2.93Å; R327-D330 PolarHBondContact O-N 3.42Å; D330-F333 PolarHBondContact O-N 2.97Å; D330-T334 WeakPolarHBondContact O-CB 3.03Å; D330-T334 PolarHBondContact O-N 2.89Å; D330-T334 PolarHBondContact O-OG1 2.98Å
331	D	88.5	Confident	86.2	Confident	67 Å²	67	100 Å²	100	36%	0.358	47%	0.467	S	S	.	.	H	α-helix	trans	-66.6	-45	177	-69.6	-19.4	0	0	0	110.6	R327 E329 F333 T334 M335	R327-D331 WeakPolarHBondContact O-CB 3.42Å; R327-D331 VanDerWaalsContact O-CG 3.28Å; R327-D331 PolarHBondContact O-N 2.9Å; E329-D331 VanDerWaalsContact C-N 3.34Å; E329-D331 PolarHBondContact O-N 2.98Å; D331-F333 VanDerWaalsContact C-N 3.35Å; D331-F333 PolarHBondContact O-N 3.31Å; D331-T334 PolarHBondContact O-N 3.48Å; D331-M335 VanDerWaalsContact O-CG 3.29Å; D331-M335 WeakPolarHBondContact O-CG 3.32Å; D331-M335 PolarHBondContact O-N 3.32Å
332	N	86.3	Confident	87.4	Confident	113 Å²	113	102.6 Å²	102.6	60%	0.604	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-39.4	175.4	-76.4	-19.2	0	0	0	112.2	N328 E329 M335 F336	N328-N332 WeakPolarHBondContact O-CB 3.38Å; N328-N332 PolarHBondContact O-N 2.93Å; N328-N332 PolarHBondContact O-ND2 3.34Å; E329-N332 PolarHBondContact O-N 2.99Å; N332-M335 PolarHBondContact O-N 3Å; N332-F336 VanDerWaalsContact O-CB 3.29Å; N332-F336 WeakPolarHBondContact O-CB 3.48Å; N332-F336 PolarHBondContact O-N 3.49Å
333	F	89.1	Confident	88.4	Confident	115 Å²	115	103 Å²	103	50%	0.504	48%	0.48	S	S	.	.	H	α-helix	trans	-67.9	-38.5	177.3	-175.7	-121.6	0	0	0	111.3	E329 D330 D331 F336 K337	E329-F333 VanDerWaalsContact O-CB 3.24Å; E329-F333 WeakPolarHBondContact O-CB 3.47Å; E329-F333 PolarHBondContact O-N 3.49Å; D330-F333 PolarHBondContact O-N 2.97Å; D331-F333 VanDerWaalsContact C-N 3.35Å; D331-F333 PolarHBondContact O-N 3.31Å; F333-F336 PolarHBondContact O-N 2.95Å; F333-K337 HydrophobicContact CD1-CD 4.46Å; F333-K337 HydrophobicContact CE1-CD 4.22Å; F333-K337 HydrophobicContact CZ-CD 4.42Å; F333-K337 WeakPolarHBondContact O-CG 3.37Å; F333-K337 PolarHBondContact O-N 3.31Å
334	T	91.2	Very high	89	Confident	86 Å²	86	98.9 Å²	98.9	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-64.2	-45.6	173.6	-57.3	0	0	0	0	111	D330 D331 K337 Y338	D330-T334 WeakPolarHBondContact O-CB 3.03Å; D330-T334 PolarHBondContact O-N 2.89Å; D330-T334 PolarHBondContact O-OG1 2.98Å; D331-T334 PolarHBondContact O-N 3.48Å; T334-K337 PolarHBondContact O-N 3.38Å; T334-Y338 WeakPolarHBondContact O-CB 3.49Å; T334-Y338 PolarHBondContact O-N 3.46Å
335	M	87.9	Confident	89.6	Confident	120 Å²	120	98.4 Å²	98.4	59%	0.591	47%	0.472	S	S	*	.	H	α-helix	trans	-63.9	-41.6	175.4	-69	-58.8	-169.4	0	0	112	D331 N332 K337 Y338 V339	D331-M335 VanDerWaalsContact O-CG 3.29Å; D331-M335 WeakPolarHBondContact O-CG 3.32Å; D331-M335 PolarHBondContact O-N 3.32Å; N332-M335 PolarHBondContact O-N 3Å; M335-K337 VanDerWaalsContact C-N 3.35Å; M335-K337 PolarHBondContact O-N 3.49Å; M335-Y338 PolarHBondContact O-N 3.31Å; M335-V339 WeakPolarHBondContact O-CB 3.39Å; M335-V339 VanDerWaalsContact O-CG2 3.29Å; M335-V339 WeakPolarHBondContact O-CG2 3.35Å; M335-V339 PolarHBondContact O-N 2.88Å
336	F	91.1	Very high	90.2	Very high	137 Å²	137	99.6 Å²	99.6	60%	0.601	48%	0.482	S	S	*	.	H	α-helix	trans	-61.5	-43.5	176.6	-177.9	-96.4	0	0	0	111.6	N332 F333 V339 T340	N332-F336 VanDerWaalsContact O-CB 3.29Å; N332-F336 WeakPolarHBondContact O-CB 3.48Å; N332-F336 PolarHBondContact O-N 3.49Å; F333-F336 PolarHBondContact O-N 2.95Å; F336-V339 PolarHBondContact O-N 3.18Å; F336-T340 WeakPolarHBondContact O-CB 3.34Å; F336-T340 PolarHBondContact O-N 3.34Å; F336-T340 PolarHBondContact O-OG1 3.45Å
337	K	91.3	Very high	90.7	Very high	117 Å²	117	99.2 Å²	99.2	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-45.2	173.1	-76.9	-179.3	177.8	177.5	0	111.8	F333 T334 M335 T340 E341	F333-K337 HydrophobicContact CD1-CD 4.46Å; F333-K337 HydrophobicContact CE1-CD 4.22Å; F333-K337 HydrophobicContact CZ-CD 4.42Å; F333-K337 WeakPolarHBondContact O-CG 3.37Å; F333-K337 PolarHBondContact O-N 3.31Å; T334-K337 PolarHBondContact O-N 3.38Å; M335-K337 VanDerWaalsContact C-N 3.35Å; M335-K337 PolarHBondContact O-N 3.49Å; K337-T340 PolarHBondContact O-N 3.38Å; K337-E341 WeakPolarHBondContact O-CB 3.27Å; K337-E341 PolarHBondContact O-N 2.93Å
338	Y	93.4	Very high	91.1	Very high	140 Å²	140	94.6 Å²	94.6	55%	0.549	47%	0.474	S	S	.	.	H	α-helix	trans	-63.8	-43.4	179.2	-179	-112.4	0	0	0	112.2	T334 M335 T340 E341 L342	T334-Y338 WeakPolarHBondContact O-CB 3.49Å; T334-Y338 PolarHBondContact O-N 3.46Å; M335-Y338 PolarHBondContact O-N 3.31Å; Y338-T340 VanDerWaalsContact C-N 3.34Å; Y338-T340 PolarHBondContact O-N 2.92Å; Y338-E341 PolarHBondContact O-N 2.87Å; Y338-L342 HydrophobicContact CD1-CD1 3.84Å; Y338-L342 HydrophobicContact CD1-CG 4.41Å; Y338-L342 HydrophobicContact CD2-CG 4.48Å; Y338-L342 HydrophobicContact CE1-CD1 3.29Å; Y338-L342 HydrophobicContact CE1-CG 4.03Å; Y338-L342 HydrophobicContact CE2-CD1 4.24Å; Y338-L342 HydrophobicContact CE2-CD2 4.32Å; Y338-L342 HydrophobicContact CE2-CG 4.08Å; Y338-L342 WeakPolarHBondContact O-CB 3.46Å; Y338-L342 WeakPolarHBondContact O-CG 3.42Å; Y338-L342 PolarHBondContact O-N 3.33Å
339	V	94.6	Very high	91.5	Very high	73 Å²	73	97.3 Å²	97.3	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-63.2	-40.8	174.5	170.7	0	0	0	0	111.1	M335 F336 L342 N343	M335-V339 WeakPolarHBondContact O-CB 3.39Å; M335-V339 VanDerWaalsContact O-CG2 3.29Å; M335-V339 WeakPolarHBondContact O-CG2 3.35Å; M335-V339 PolarHBondContact O-N 2.88Å; F336-V339 PolarHBondContact O-N 3.18Å; V339-L342 PolarHBondContact O-N 3.03Å; V339-N343 WeakPolarHBondContact O-CB 3.44Å; V339-N343 VanDerWaalsContact O-CG 3.27Å; V339-N343 PolarHBondContact O-N 3.25Å
340	T	91.7	Very high	92	Very high	68 Å²	68	95.3 Å²	95.3	42%	0.417	48%	0.481	S	S	.	.	H	α-helix	trans	-64.9	-43.1	177.1	-55.5	0	0	0	0	111.3	F336 K337 Y338 N343 N344	F336-T340 WeakPolarHBondContact O-CB 3.34Å; F336-T340 PolarHBondContact O-N 3.34Å; F336-T340 PolarHBondContact O-OG1 3.45Å; K337-T340 PolarHBondContact O-N 3.38Å; Y338-T340 VanDerWaalsContact C-N 3.34Å; Y338-T340 PolarHBondContact O-N 2.92Å; T340-N343 PolarHBondContact O-N 3.06Å; T340-N344 WeakPolarHBondContact O-CB 3.5Å; T340-N344 PolarHBondContact O-N 3.37Å
341	E	93.7	Very high	92.4	Very high	95 Å²	95	96.2 Å²	96.2	44%	0.444	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-43.8	176.2	179.8	57.9	-148	0	0	111.7	K337 Y338 N343 N344 Q345	K337-E341 WeakPolarHBondContact O-CB 3.27Å; K337-E341 PolarHBondContact O-N 2.93Å; Y338-E341 PolarHBondContact O-N 2.87Å; E341-N343 PolarHBondContact O-N 3.47Å; E341-N344 PolarHBondContact O-N 2.88Å; E341-Q345 WeakPolarHBondContact O-CG 3.12Å; E341-Q345 PolarHBondContact O-N 2.69Å; E341-Q345 PolarHBondContact OE1-NE2 3.45Å
342	L	93.8	Very high	92.7	Very high	57 Å²	57	97.2 Å²	97.2	30%	0.298	49%	0.491	S	S	.	.	H	α-helix	trans	-61.6	-42.6	174.4	-77.8	-179.9	0	0	0	112	Y338 V339 N344 Q345 I346	Y338-L342 HydrophobicContact CD1-CD1 3.84Å; Y338-L342 HydrophobicContact CD1-CG 4.41Å; Y338-L342 HydrophobicContact CD2-CG 4.48Å; Y338-L342 HydrophobicContact CE1-CD1 3.29Å; Y338-L342 HydrophobicContact CE1-CG 4.03Å; Y338-L342 HydrophobicContact CE2-CD1 4.24Å; Y338-L342 HydrophobicContact CE2-CD2 4.32Å; Y338-L342 HydrophobicContact CE2-CG 4.08Å; Y338-L342 WeakPolarHBondContact O-CB 3.46Å; Y338-L342 WeakPolarHBondContact O-CG 3.42Å; Y338-L342 PolarHBondContact O-N 3.33Å; V339-L342 PolarHBondContact O-N 3.03Å; L342-N344 VanDerWaalsContact C-N 3.33Å; L342-N344 PolarHBondContact O-N 3.46Å; L342-Q345 PolarHBondContact O-N 2.81Å; L342-I346 VanDerWaalsContact O-CG1 3.25Å; L342-I346 WeakPolarHBondContact O-CG1 3.31Å; L342-I346 PolarHBondContact O-N 3Å
343	N	93.3	Very high	93.1	Very high	85 Å²	85	95.8 Å²	95.8	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-43.7	175.8	-76.8	-15.2	0	0	0	111.2	V339 T340 E341 Q345 I346 E347	V339-N343 WeakPolarHBondContact O-CB 3.44Å; V339-N343 VanDerWaalsContact O-CG 3.27Å; V339-N343 PolarHBondContact O-N 3.25Å; T340-N343 PolarHBondContact O-N 3.06Å; E341-N343 PolarHBondContact O-N 3.47Å; N343-Q345 VanDerWaalsContact C-N 3.32Å; N343-Q345 PolarHBondContact O-N 2.94Å; N343-I346 PolarHBondContact O-N 3.33Å; N343-E347 WeakPolarHBondContact O-CG 3.36Å; N343-E347 PolarHBondContact O-N 3.02Å
344	N	93.4	Very high	93.4	Very high	80 Å²	80	94.4 Å²	94.4	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-38.7	175.4	-174.7	62.2	0	0	0	112.2	T340 E341 L342 E347 C348	T340-N344 WeakPolarHBondContact O-CB 3.5Å; T340-N344 PolarHBondContact O-N 3.37Å; E341-N344 PolarHBondContact O-N 2.88Å; L342-N344 VanDerWaalsContact C-N 3.33Å; L342-N344 PolarHBondContact O-N 3.46Å; N344-E347 PolarHBondContact O-N 3.35Å; N344-C348 WeakPolarHBondContact O-CB 3.43Å; N344-C348 PolarHBondContact O-N 3.07Å; N344-C348 PolarHBondContact O-SG 3.34Å; N344-C348 VanDerWaalsContact O-SG 3.33Å
345	Q	94.6	Very high	93.6	Very high	89 Å²	89	94.7 Å²	94.7	42%	0.416	48%	0.478	S	S	.	.	H	α-helix	trans	-66.6	-39.1	174.2	-72.9	176.5	26.9	0	0	112.4	E341 L342 N343 C348 L349	E341-Q345 WeakPolarHBondContact O-CG 3.12Å; E341-Q345 PolarHBondContact O-N 2.69Å; E341-Q345 PolarHBondContact OE1-NE2 3.45Å; L342-Q345 PolarHBondContact O-N 2.81Å; N343-Q345 VanDerWaalsContact C-N 3.32Å; N343-Q345 PolarHBondContact O-N 2.94Å; Q345-C348 PolarHBondContact O-N 3.38Å; Q345-L349 WeakPolarHBondContact O-CB 3.5Å; Q345-L349 WeakPolarHBondContact O-CD1 3.32Å; Q345-L349 WeakPolarHBondContact O-CG 3.25Å; Q345-L349 PolarHBondContact O-N 3.25Å
346	I	93.3	Very high	94	Very high	104 Å²	104	93.6 Å²	93.6	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-44.4	175	-70.4	164.5	0	0	0	110.3	L342 N343 L349 N350	L342-I346 VanDerWaalsContact O-CG1 3.25Å; L342-I346 WeakPolarHBondContact O-CG1 3.31Å; L342-I346 PolarHBondContact O-N 3Å; N343-I346 PolarHBondContact O-N 3.33Å; I346-L349 PolarHBondContact O-N 3.5Å; I346-N350 WeakPolarHBondContact O-CB 3.3Å; I346-N350 PolarHBondContact O-N 3.45Å
347	E	92.9	Very high	94.2	Very high	123 Å²	123	92.3 Å²	92.3	58%	0.575	47%	0.469	S	S	*	.	H	α-helix	trans	-60.9	-48.9	175.6	-73.7	178.8	-175.9	0	0	111.4	N343 N344 L349 N350 D351	N343-E347 WeakPolarHBondContact O-CG 3.36Å; N343-E347 PolarHBondContact O-N 3.02Å; N344-E347 PolarHBondContact O-N 3.35Å; E347-L349 VanDerWaalsContact C-N 3.32Å; E347-L349 PolarHBondContact O-N 3.41Å; E347-N350 WeakPolarHBondContact O-CB 3.23Å; E347-N350 PolarHBondContact O-N 2.95Å; E347-N350 VanDerWaalsContact O-N 3.13Å; E347-D351 PolarHBondContact O-N 3.02Å
348	C	95	Very high	94.4	Very high	61 Å²	61	92.7 Å²	92.7	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-60.1	-40.1	176.4	-74.5	0	0	0	0	112.8	N344 Q345 N352	N344-C348 WeakPolarHBondContact O-CB 3.43Å; N344-C348 PolarHBondContact O-N 3.07Å; N344-C348 PolarHBondContact O-SG 3.34Å; N344-C348 VanDerWaalsContact O-SG 3.33Å; Q345-C348 PolarHBondContact O-N 3.38Å; C348-N352 WeakPolarHBondContact O-CB 3.28Å; C348-N352 PolarHBondContact O-N 2.91Å; C348-N352 PolarHBondContact O-ND2 2.83Å; C348-N352 VanDerWaalsContact O-ND2 3.11Å
349	L	94.8	Very high	94.4	Very high	106 Å²	106	88.8 Å²	88.8	56%	0.555	46%	0.462	S	S	*	.	H	α-helix	trans	-65.4	-40.7	175.1	-82.4	159.6	0	0	0	111.3	Q345 I346 E347 N352 I353	Q345-L349 WeakPolarHBondContact O-CB 3.5Å; Q345-L349 WeakPolarHBondContact O-CD1 3.32Å; Q345-L349 WeakPolarHBondContact O-CG 3.25Å; Q345-L349 PolarHBondContact O-N 3.25Å; I346-L349 PolarHBondContact O-N 3.5Å; E347-L349 VanDerWaalsContact C-N 3.32Å; E347-L349 PolarHBondContact O-N 3.41Å; L349-N352 WeakPolarHBondContact O-CB 3.45Å; L349-N352 PolarHBondContact O-N 2.96Å; L349-I353 VanDerWaalsContact O-CG1 3.27Å; L349-I353 WeakPolarHBondContact O-CG1 3.46Å; L349-I353 PolarHBondContact O-N 3.18Å
350	N	95.2	Very high	94.4	Very high	88 Å²	88	90 Å²	90	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-66	-42.4	178.4	-162.5	43.6	0	0	0	111.8	I346 E347 N352 I353 I354	I346-N350 WeakPolarHBondContact O-CB 3.3Å; I346-N350 PolarHBondContact O-N 3.45Å; E347-N350 WeakPolarHBondContact O-CB 3.23Å; E347-N350 PolarHBondContact O-N 2.95Å; E347-N350 VanDerWaalsContact O-N 3.13Å; N350-N352 VanDerWaalsContact C-N 3.3Å; N350-N352 PolarHBondContact O-N 3.39Å; N350-I353 WeakPolarHBondContact O-CB 3.49Å; N350-I353 PolarHBondContact O-N 2.97Å; N350-I354 WeakPolarHBondContact O-CG1 3.49Å; N350-I354 PolarHBondContact O-N 3.46Å
351	D	95.5	Very high	94.6	Very high	96 Å²	96	91.6 Å²	91.6	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-39.2	173.7	-75.9	-11.3	0	0	0	111.9	E347 I354 N355	E347-D351 PolarHBondContact O-N 3.02Å; D351-I354 PolarHBondContact O-N 3.48Å; D351-N355 WeakPolarHBondContact O-CB 3.39Å; D351-N355 VanDerWaalsContact O-CG 3.27Å; D351-N355 PolarHBondContact O-N 3.24Å; D351-N355 PolarHBondContact O-ND2 3.5Å; D351-N355 VanDerWaalsContact O-ND2 3.16Å
352	N	95.7	Very high	94.6	Very high	89 Å²	89	92.1 Å²	92.1	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-65.1	-40.4	174.3	-72.4	-28.2	0	0	0	111.9	C348 L349 N350 N355 I356	C348-N352 WeakPolarHBondContact O-CB 3.28Å; C348-N352 PolarHBondContact O-N 2.91Å; C348-N352 PolarHBondContact O-ND2 2.83Å; C348-N352 VanDerWaalsContact O-ND2 3.11Å; L349-N352 WeakPolarHBondContact O-CB 3.45Å; L349-N352 PolarHBondContact O-N 2.96Å; N350-N352 VanDerWaalsContact C-N 3.3Å; N350-N352 PolarHBondContact O-N 3.39Å; N352-N355 PolarHBondContact O-N 3.37Å; N352-I356 WeakPolarHBondContact O-CB 3.37Å; N352-I356 WeakPolarHBondContact O-CD1 3.29Å; N352-I356 WeakPolarHBondContact O-CG1 3.37Å; N352-I356 PolarHBondContact O-N 3.04Å
353	I	94.4	Very high	94.6	Very high	83 Å²	83	97 Å²	97	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-48.8	175.2	-70.4	164.2	0	0	0	110	L349 N350 N355 I356 E357	L349-I353 VanDerWaalsContact O-CG1 3.27Å; L349-I353 WeakPolarHBondContact O-CG1 3.46Å; L349-I353 PolarHBondContact O-N 3.18Å; N350-I353 WeakPolarHBondContact O-CB 3.49Å; N350-I353 PolarHBondContact O-N 2.97Å; I353-N355 VanDerWaalsContact C-N 3.31Å; I353-N355 PolarHBondContact O-N 3.38Å; I353-I356 PolarHBondContact O-N 2.86Å; I353-I356 VanDerWaalsContact O-N 3.15Å; I353-E357 HydrophobicContact CG2-CG 4.35Å; I353-E357 WeakPolarHBondContact O-CG 3.46Å; I353-E357 PolarHBondContact O-N 2.96Å
354	I	95.8	Very high	94.6	Very high	85 Å²	85	96.3 Å²	96.3	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-59	-42.9	177.9	-67.9	166.7	0	0	0	111.1	N350 D351 E357 K358	N350-I354 WeakPolarHBondContact O-CG1 3.49Å; N350-I354 PolarHBondContact O-N 3.46Å; D351-I354 PolarHBondContact O-N 3.48Å; I354-E357 PolarHBondContact O-N 2.98Å; I354-K358 WeakPolarHBondContact O-CB 3.42Å; I354-K358 PolarHBondContact O-N 3.34Å
355	N	95.4	Very high	94.7	Very high	92 Å²	92	97.6 Å²	97.6	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-65.4	-41.2	177.3	-74.8	-32.5	0	0	0	112	D351 N352 I353 K358 T359	D351-N355 WeakPolarHBondContact O-CB 3.39Å; D351-N355 VanDerWaalsContact O-CG 3.27Å; D351-N355 PolarHBondContact O-N 3.24Å; D351-N355 PolarHBondContact O-ND2 3.5Å; D351-N355 VanDerWaalsContact O-ND2 3.16Å; N352-N355 PolarHBondContact O-N 3.37Å; I353-N355 VanDerWaalsContact C-N 3.31Å; I353-N355 PolarHBondContact O-N 3.38Å; N355-K358 PolarHBondContact O-N 2.9Å; N355-T359 WeakPolarHBondContact O-CG2 3.45Å; N355-T359 PolarHBondContact O-N 3.15Å; N355-T359 PolarHBondContact O-OG1 3.46Å
356	I	94.6	Very high	94.6	Very high	97 Å²	97	98 Å²	98	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-46.9	175.5	-70.7	165.9	0	0	0	110	N352 I353 K358 T359 I360	N352-I356 WeakPolarHBondContact O-CB 3.37Å; N352-I356 WeakPolarHBondContact O-CD1 3.29Å; N352-I356 WeakPolarHBondContact O-CG1 3.37Å; N352-I356 PolarHBondContact O-N 3.04Å; I353-I356 PolarHBondContact O-N 2.86Å; I353-I356 VanDerWaalsContact O-N 3.15Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 3.42Å; I356-T359 PolarHBondContact O-N 3.3Å; I356-T359 VanDerWaalsContact O-N 3.15Å; I356-T359 PolarHBondContact O-OG1 3.36Å; I356-I360 HydrophobicContact CG2-CD1 3.72Å; I356-I360 HydrophobicContact CG2-CG1 4.31Å; I356-I360 VanDerWaalsContact O-CG1 3.3Å; I356-I360 WeakPolarHBondContact O-CG1 3.35Å; I356-I360 PolarHBondContact O-N 3.09Å
357	E	95.7	Very high	94.5	Very high	110 Å²	110	99.5 Å²	99.5	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-58.3	-41.7	176	-72.9	178	166	0	0	112	I353 I354 I360 N361	I353-E357 HydrophobicContact CG2-CG 4.35Å; I353-E357 WeakPolarHBondContact O-CG 3.46Å; I353-E357 PolarHBondContact O-N 2.96Å; I354-E357 PolarHBondContact O-N 2.98Å; E357-I360 PolarHBondContact O-N 3.47Å; E357-N361 PolarHBondContact O-N 2.89Å; E357-N361 PolarHBondContact O-ND2 3.49Å
358	K	95	Very high	94.6	Very high	125 Å²	125	98.3 Å²	98.3	54%	0.543	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-48.2	174.1	-175.1	-178.5	174.3	-171.9	0	111.8	I354 N355 I356 I360 N361 E362	I354-K358 WeakPolarHBondContact O-CB 3.42Å; I354-K358 PolarHBondContact O-N 3.34Å; N355-K358 PolarHBondContact O-N 2.9Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 3.42Å; K358-I360 VanDerWaalsContact C-N 3.33Å; K358-I360 PolarHBondContact O-N 3.37Å; K358-N361 PolarHBondContact O-N 3.25Å; K358-E362 WeakPolarHBondContact CE-OE1 3.43Å; K358-E362 WeakPolarHBondContact O-CG 3.29Å; K358-E362 PolarHBondContact O-N 3.01Å
359	T	94.6	Very high	94.6	Very high	59 Å²	59	99.1 Å²	99.1	36%	0.362	49%	0.491	S	S	.	.	H	α-helix	trans	-65.4	-35.6	178.4	59.4	0	0	0	0	112.5	N355 I356 N361 E362 Y363	N355-T359 WeakPolarHBondContact O-CG2 3.45Å; N355-T359 PolarHBondContact O-N 3.15Å; N355-T359 PolarHBondContact O-OG1 3.46Å; I356-T359 PolarHBondContact O-N 3.3Å; I356-T359 VanDerWaalsContact O-N 3.15Å; I356-T359 PolarHBondContact O-OG1 3.36Å; T359-N361 VanDerWaalsContact C-N 3.34Å; T359-N361 PolarHBondContact O-N 3.44Å; T359-E362 PolarHBondContact O-N 3.41Å; T359-Y363 WeakPolarHBondContact O-CD2 3.41Å; T359-Y363 PolarHBondContact O-N 2.85Å
360	I	94.6	Very high	94.4	Very high	98 Å²	98	99.6 Å²	99.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-60.6	-45.4	173.7	-71.1	167.8	0	0	0	110.3	I356 E357 K358 Y363 D364	I356-I360 HydrophobicContact CG2-CD1 3.72Å; I356-I360 HydrophobicContact CG2-CG1 4.31Å; I356-I360 VanDerWaalsContact O-CG1 3.3Å; I356-I360 WeakPolarHBondContact O-CG1 3.35Å; I356-I360 PolarHBondContact O-N 3.09Å; E357-I360 PolarHBondContact O-N 3.47Å; K358-I360 VanDerWaalsContact C-N 3.33Å; K358-I360 PolarHBondContact O-N 3.37Å; I360-Y363 PolarHBondContact O-N 3.1Å; I360-D364 WeakPolarHBondContact O-CB 3.29Å; I360-D364 PolarHBondContact O-N 3.32Å
361	N	95.1	Very high	94.3	Very high	101 Å²	101	99.1 Å²	99.1	54%	0.54	48%	0.484	S	S	.	.	H	α-helix	trans	-65	-40	177.6	-71.4	-31.5	0	0	0	112.4	E357 K358 T359 D364 E365	E357-N361 PolarHBondContact O-N 2.89Å; E357-N361 PolarHBondContact O-ND2 3.49Å; K358-N361 PolarHBondContact O-N 3.25Å; T359-N361 VanDerWaalsContact C-N 3.34Å; T359-N361 PolarHBondContact O-N 3.44Å; N361-D364 PolarHBondContact O-N 2.93Å; N361-E365 WeakPolarHBondContact O-CG 3.45Å; N361-E365 PolarHBondContact O-N 3.15Å
362	E	94.6	Very high	94.3	Very high	107 Å²	107	101.5 Å²	101.5	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-45.2	175.1	-72.7	171.8	178.2	0	0	111.5	K358 T359 E365 E366	K358-E362 WeakPolarHBondContact CE-OE1 3.43Å; K358-E362 WeakPolarHBondContact O-CG 3.29Å; K358-E362 PolarHBondContact O-N 3.01Å; T359-E362 PolarHBondContact O-N 3.41Å; E362-E365 PolarHBondContact O-N 2.95Å; E362-E366 WeakPolarHBondContact O-CB 3.34Å; E362-E366 PolarHBondContact O-N 3.36Å
363	Y	93.2	Very high	94.2	Very high	159 Å²	159	102.6 Å²	102.6	62%	0.624	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-37.2	175.9	-80.2	-59.8	0	0	0	113	T359 I360 E366 Q367	T359-Y363 WeakPolarHBondContact O-CD2 3.41Å; T359-Y363 PolarHBondContact O-N 2.85Å; I360-Y363 PolarHBondContact O-N 3.1Å; Y363-E366 PolarHBondContact O-N 3.04Å; Y363-Q367 VanDerWaalsContact O-CB 3.25Å; Y363-Q367 WeakPolarHBondContact O-CB 3.49Å; Y363-Q367 PolarHBondContact O-N 2.89Å
364	D	94.2	Very high	94.1	Very high	70 Å²	70	105.8 Å²	105.8	37%	0.374	50%	0.499	S	S	.	.	H	α-helix	trans	-65.5	-43	177.3	-173	50.5	0	0	0	111.5	I360 N361 Q367 K368	I360-D364 WeakPolarHBondContact O-CB 3.29Å; I360-D364 PolarHBondContact O-N 3.32Å; N361-D364 PolarHBondContact O-N 2.93Å; D364-Q367 PolarHBondContact O-N 3.05Å; D364-K368 WeakPolarHBondContact O-CG 3.5Å; D364-K368 PolarHBondContact O-N 3.24Å; D364-K368 WeakPolarHBondContact OD2-CE 3.37Å; D364-K368 IonicContact OD2-NZ 2.63Å; D364-K368 PolarHBondContact OD2-NZ 2.83Å
365	E	94.2	Very high	94	Very high	107 Å²	107	104.8 Å²	104.8	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-66	-42	174.9	-70.3	-56.6	129.6	0	0	112.2	N361 E362 Q367 K368 V369	N361-E365 WeakPolarHBondContact O-CG 3.45Å; N361-E365 PolarHBondContact O-N 3.15Å; E362-E365 PolarHBondContact O-N 2.95Å; E365-Q367 VanDerWaalsContact C-N 3.33Å; E365-Q367 PolarHBondContact O-N 2.9Å; E365-K368 PolarHBondContact O-N 3.38Å; E365-K368 IonicContact OE1-NZ 2.89Å; E365-K368 PolarHBondContact OE1-NZ 2.82Å; E365-V369 WeakPolarHBondContact O-CG2 3.37Å; E365-V369 PolarHBondContact O-N 3.38Å
366	E	93	Very high	94	Very high	98 Å²	98	104.2 Å²	104.2	46%	0.458	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-43.5	174.3	-171.1	-179.3	-173.9	0	0	111.3	E362 Y363 V369 F370	E362-E366 WeakPolarHBondContact O-CB 3.34Å; E362-E366 PolarHBondContact O-N 3.36Å; Y363-E366 PolarHBondContact O-N 3.04Å; E366-V369 PolarHBondContact O-N 2.89Å; E366-F370 HydrophobicContact CG-CD2 3.85Å; E366-F370 HydrophobicContact CG-CE2 3.44Å; E366-F370 VanDerWaalsContact CG-CE2 3.44Å; E366-F370 HydrophobicContact CG-CZ 4.31Å; E366-F370 VanDerWaalsContact O-CD2 3.27Å; E366-F370 WeakPolarHBondContact O-CD2 3.4Å; E366-F370 PolarHBondContact O-N 3.5Å; E366-F370 VanDerWaalsContact OE1-CE2 3.3Å; E366-F370 WeakPolarHBondContact OE1-CE2 3.35Å
367	Q	91.8	Very high	94	Very high	135 Å²	135	106.3 Å²	106.3	63%	0.631	50%	0.495	S	S	*	.	H	α-helix	trans	-65.3	-40	178.2	-174.8	161.9	-19.7	0	0	112.3	Y363 D364 E365 V369 F370 E371	Y363-Q367 VanDerWaalsContact O-CB 3.25Å; Y363-Q367 WeakPolarHBondContact O-CB 3.49Å; Y363-Q367 PolarHBondContact O-N 2.89Å; D364-Q367 PolarHBondContact O-N 3.05Å; E365-Q367 VanDerWaalsContact C-N 3.33Å; E365-Q367 PolarHBondContact O-N 2.9Å; Q367-V369 VanDerWaalsContact C-N 3.33Å; Q367-V369 PolarHBondContact O-N 3.16Å; Q367-F370 PolarHBondContact O-N 3.48Å; Q367-E371 WeakPolarHBondContact O-CB 3.44Å; Q367-E371 PolarHBondContact O-N 3.46Å
368	K	94.1	Very high	93.8	Very high	99 Å²	99	106.5 Å²	106.5	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-61.6	-40.1	173.2	-73.6	170.8	-165.9	156.3	0	112.1	D364 E365 E371 K372	D364-K368 WeakPolarHBondContact O-CG 3.5Å; D364-K368 PolarHBondContact O-N 3.24Å; D364-K368 WeakPolarHBondContact OD2-CE 3.37Å; D364-K368 IonicContact OD2-NZ 2.63Å; D364-K368 PolarHBondContact OD2-NZ 2.83Å; E365-K368 PolarHBondContact O-N 3.38Å; E365-K368 IonicContact OE1-NZ 2.89Å; E365-K368 PolarHBondContact OE1-NZ 2.82Å; K368-E371 PolarHBondContact O-N 3.42Å; K368-K372 WeakPolarHBondContact O-CB 3.29Å; K368-K372 PolarHBondContact O-N 3.37Å
369	V	94.8	Very high	93.8	Very high	77 Å²	77	104.6 Å²	104.6	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-47.1	176.8	172.3	0	0	0	0	110.8	E365 E366 Q367 E371 K372 Q373	E365-V369 WeakPolarHBondContact O-CG2 3.37Å; E365-V369 PolarHBondContact O-N 3.38Å; E366-V369 PolarHBondContact O-N 2.89Å; Q367-V369 VanDerWaalsContact C-N 3.33Å; Q367-V369 PolarHBondContact O-N 3.16Å; V369-E371 PolarHBondContact O-N 3.29Å; V369-K372 PolarHBondContact O-N 2.92Å; V369-Q373 WeakPolarHBondContact O-CG 3.29Å; V369-Q373 PolarHBondContact O-N 2.91Å
370	F	91.8	Very high	93.8	Very high	117 Å²	117	106.9 Å²	106.9	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-41	176.5	-76.1	-51.6	0	0	0	112.6	E366 Q367 K372 Q373 R374	E366-F370 HydrophobicContact CG-CD2 3.85Å; E366-F370 HydrophobicContact CG-CE2 3.44Å; E366-F370 VanDerWaalsContact CG-CE2 3.44Å; E366-F370 HydrophobicContact CG-CZ 4.31Å; E366-F370 VanDerWaalsContact O-CD2 3.27Å; E366-F370 WeakPolarHBondContact O-CD2 3.4Å; E366-F370 PolarHBondContact O-N 3.5Å; E366-F370 VanDerWaalsContact OE1-CE2 3.3Å; E366-F370 WeakPolarHBondContact OE1-CE2 3.35Å; Q367-F370 PolarHBondContact O-N 3.48Å; F370-K372 PolarHBondContact O-N 3.34Å; F370-Q373 PolarHBondContact O-N 3.29Å; F370-R374 WeakPolarHBondContact O-CB 3.46Å; F370-R374 PolarHBondContact O-N 2.93Å
371	E	93	Very high	93.8	Very high	77 Å²	77	106.2 Å²	106.2	36%	0.36	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-44.6	177.4	-170.6	59.8	-149.9	0	0	110.9	Q367 K368 V369 Q373 R374 V375	Q367-E371 WeakPolarHBondContact O-CB 3.44Å; Q367-E371 PolarHBondContact O-N 3.46Å; K368-E371 PolarHBondContact O-N 3.42Å; V369-E371 PolarHBondContact O-N 3.29Å; E371-Q373 PolarHBondContact O-N 3.29Å; E371-R374 PolarHBondContact O-N 2.84Å; E371-R374 IonicContact OE1-CZ 3.37Å; E371-R374 IonicContact OE1-NE 2.76Å; E371-R374 PolarHBondContact OE1-NE 2.88Å; E371-R374 IonicContact OE1-NH2 2.72Å; E371-R374 PolarHBondContact OE1-NH2 3.49Å; E371-R374 IonicContact OE2-CZ 3.82Å; E371-R374 IonicContact OE2-NE 2.76Å; E371-R374 PolarHBondContact OE2-NE 3.43Å; E371-R374 IonicContact OE2-NH2 3.08Å; E371-R374 PolarHBondContact OE2-NH2 3.36Å; E371-V375 WeakPolarHBondContact O-CB 3.38Å; E371-V375 VanDerWaalsContact O-CG2 3.31Å; E371-V375 WeakPolarHBondContact O-CG2 3.38Å; E371-V375 PolarHBondContact O-N 3.48Å
372	K	94.6	Very high	93.8	Very high	146 Å²	146	107.4 Å²	107.4	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-61.4	-43	175.9	-170.1	176.8	-177.6	178.8	0	112.1	K368 V369 F370 V375 N376	K368-K372 WeakPolarHBondContact O-CB 3.29Å; K368-K372 PolarHBondContact O-N 3.37Å; V369-K372 PolarHBondContact O-N 2.92Å; F370-K372 PolarHBondContact O-N 3.34Å; K372-V375 PolarHBondContact O-N 3.15Å; K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 2.91Å
373	Q	93.7	Very high	93.8	Very high	112 Å²	112	105.2 Å²	105.2	52%	0.523	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-42.8	175.3	-72.7	176.5	1.8	0	0	111.9	V369 F370 E371 N376 R377	V369-Q373 WeakPolarHBondContact O-CG 3.29Å; V369-Q373 PolarHBondContact O-N 2.91Å; F370-Q373 PolarHBondContact O-N 3.29Å; E371-Q373 PolarHBondContact O-N 3.29Å; Q373-N376 PolarHBondContact O-N 3.3Å; Q373-R377 WeakPolarHBondContact O-CB 3.15Å; Q373-R377 PolarHBondContact O-N 3.06Å
374	R	91.9	Very high	93.9	Very high	151 Å²	151	102.5 Å²	102.5	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-62.7	-45.4	177.9	-172.7	177.1	73.4	162.4	5	111.6	F370 E371 R377 M378	F370-R374 WeakPolarHBondContact O-CB 3.46Å; F370-R374 PolarHBondContact O-N 2.93Å; E371-R374 PolarHBondContact O-N 2.84Å; E371-R374 IonicContact OE1-CZ 3.37Å; E371-R374 IonicContact OE1-NE 2.76Å; E371-R374 PolarHBondContact OE1-NE 2.88Å; E371-R374 IonicContact OE1-NH2 2.72Å; E371-R374 PolarHBondContact OE1-NH2 3.49Å; E371-R374 IonicContact OE2-CZ 3.82Å; E371-R374 IonicContact OE2-NE 2.76Å; E371-R374 PolarHBondContact OE2-NE 3.43Å; E371-R374 IonicContact OE2-NH2 3.08Å; E371-R374 PolarHBondContact OE2-NH2 3.36Å; R374-R377 PolarHBondContact O-N 3.16Å; R374-M378 WeakPolarHBondContact O-CB 3.37Å; R374-M378 PolarHBondContact O-N 2.94Å
375	V	95.3	Very high	93.9	Very high	63 Å²	63	104.7 Å²	104.7	38%	0.382	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-43.3	176.8	171.6	0	0	0	0	111	E371 K372 R377 M378 N379	E371-V375 WeakPolarHBondContact O-CB 3.38Å; E371-V375 VanDerWaalsContact O-CG2 3.31Å; E371-V375 WeakPolarHBondContact O-CG2 3.38Å; E371-V375 PolarHBondContact O-N 3.48Å; K372-V375 PolarHBondContact O-N 3.15Å; V375-R377 PolarHBondContact O-N 3.18Å; V375-M378 WeakPolarHBondContact O-CB 3.28Å; V375-M378 PolarHBondContact O-N 3.43Å; V375-N379 WeakPolarHBondContact O-CB 3.5Å; V375-N379 VanDerWaalsContact O-CG 3.24Å; V375-N379 PolarHBondContact O-N 3.11Å; V375-N379 PolarHBondContact O-ND2 2.73Å
376	N	95	Very high	94	Very high	81 Å²	81	106 Å²	106	43%	0.433	51%	0.507	S	S	.	.	H	α-helix	trans	-59.7	-46.9	175.1	-73.8	-9.7	0	0	0	111.5	K372 Q373 M378 N379 E380	K372-N376 WeakPolarHBondContact O-CB 3.49Å; K372-N376 PolarHBondContact O-N 2.91Å; Q373-N376 PolarHBondContact O-N 3.3Å; N376-M378 VanDerWaalsContact C-N 3.32Å; N376-M378 PolarHBondContact O-N 3.38Å; N376-N379 PolarHBondContact O-N 2.84Å; N376-E380 WeakPolarHBondContact O-CG 3.35Å; N376-E380 PolarHBondContact O-N 3.15Å
377	R	93.6	Very high	94.1	Very high	140 Å²	140	104.4 Å²	104.4	53%	0.528	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-37.3	178.3	-173.4	56.6	177.2	168.9	2.1	112.5	Q373 R374 V375 E380 L381	Q373-R377 WeakPolarHBondContact O-CB 3.15Å; Q373-R377 PolarHBondContact O-N 3.06Å; R374-R377 PolarHBondContact O-N 3.16Å; V375-R377 PolarHBondContact O-N 3.18Å; R377-E380 WeakPolarHBondContact CD-OE2 3.23Å; R377-E380 IonicContact CZ-OE2 2.57Å; R377-E380 IonicContact NH1-OE2 3.09Å; R377-E380 PolarHBondContact NH1-OE2 3.29Å; R377-L381 HydrophobicContact CG-CD1 4.32Å; R377-L381 WeakPolarHBondContact O-CG 3.42Å; R377-L381 PolarHBondContact O-N 3.5Å
378	M	92.4	Very high	94.2	Very high	114 Å²	114	102 Å²	102	56%	0.562	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-47.1	173.9	-170.9	74.2	74.6	0	0	110.8	R374 V375 N376 L381 Q382	R374-M378 WeakPolarHBondContact O-CB 3.37Å; R374-M378 PolarHBondContact O-N 2.94Å; V375-M378 WeakPolarHBondContact O-CB 3.28Å; V375-M378 PolarHBondContact O-N 3.43Å; N376-M378 VanDerWaalsContact C-N 3.32Å; N376-M378 PolarHBondContact O-N 3.38Å; M378-L381 PolarHBondContact O-N 2.91Å; M378-Q382 VanDerWaalsContact O-CB 3.31Å; M378-Q382 WeakPolarHBondContact O-CB 3.24Å; M378-Q382 PolarHBondContact O-N 2.99Å
379	N	95.5	Very high	94.3	Very high	85 Å²	85	103.9 Å²	103.9	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-41.2	179.5	-70.1	-21.6	0	0	0	112.1	V375 N376 Q382 A383	V375-N379 WeakPolarHBondContact O-CB 3.5Å; V375-N379 VanDerWaalsContact O-CG 3.24Å; V375-N379 PolarHBondContact O-N 3.11Å; V375-N379 PolarHBondContact O-ND2 2.73Å; N376-N379 PolarHBondContact O-N 2.84Å; N379-Q382 PolarHBondContact O-N 3.32Å; N379-A383 WeakPolarHBondContact O-CB 3.31Å; N379-A383 PolarHBondContact O-N 2.85Å
380	E	94.7	Very high	94.3	Very high	108 Å²	108	105.4 Å²	105.4	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-58.6	-50	173.6	-74.7	171.6	-170.6	0	0	111.8	N376 R377 Q382 A383 Q384	N376-E380 WeakPolarHBondContact O-CG 3.35Å; N376-E380 PolarHBondContact O-N 3.15Å; R377-E380 WeakPolarHBondContact CD-OE2 3.23Å; R377-E380 IonicContact CZ-OE2 2.57Å; R377-E380 IonicContact NH1-OE2 3.09Å; R377-E380 PolarHBondContact NH1-OE2 3.29Å; E380-Q382 VanDerWaalsContact C-N 3.33Å; E380-Q382 PolarHBondContact O-N 2.87Å; E380-A383 PolarHBondContact O-N 3.21Å; E380-Q384 PolarHBondContact O-N 3Å
381	L	94.4	Very high	94.4	Very high	83 Å²	83	102.4 Å²	102.4	44%	0.435	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-38.4	179.5	-72.5	173.3	0	0	0	111.6	R377 M378 Q384 I385	R377-L381 HydrophobicContact CG-CD1 4.32Å; R377-L381 WeakPolarHBondContact O-CG 3.42Å; R377-L381 PolarHBondContact O-N 3.5Å; M378-L381 PolarHBondContact O-N 2.91Å; L381-Q384 PolarHBondContact O-N 3.49Å; L381-I385 WeakPolarHBondContact O-CB 3.5Å; L381-I385 VanDerWaalsContact O-CG1 3.25Å; L381-I385 WeakPolarHBondContact O-CG1 3.38Å; L381-I385 PolarHBondContact O-N 2.88Å
382	Q	94.2	Very high	94.4	Very high	127 Å²	127	101.5 Å²	101.5	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-66.1	-39.1	176.8	-172.1	172.6	-1.5	0	0	112	M378 N379 E380 K386	M378-Q382 VanDerWaalsContact O-CB 3.31Å; M378-Q382 WeakPolarHBondContact O-CB 3.24Å; M378-Q382 PolarHBondContact O-N 2.99Å; N379-Q382 PolarHBondContact O-N 3.32Å; E380-Q382 VanDerWaalsContact C-N 3.33Å; E380-Q382 PolarHBondContact O-N 2.87Å; Q382-K386 WeakPolarHBondContact O-CB 3.3Å; Q382-K386 PolarHBondContact O-N 3.13Å
383	A	95.4	Very high	94.4	Very high	61 Å²	61	98.1 Å²	98.1	50%	0.504	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-43.2	173.9	0	0	0	0	0	111.6	N379 E380 K386 S387	N379-A383 WeakPolarHBondContact O-CB 3.31Å; N379-A383 PolarHBondContact O-N 2.85Å; E380-A383 PolarHBondContact O-N 3.21Å; A383-K386 PolarHBondContact O-N 3.34Å; A383-S387 PolarHBondContact O-N 3.37Å
384	Q	95.3	Very high	94.5	Very high	102 Å²	102	96 Å²	96	48%	0.477	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-47.5	176.8	-173.1	61.8	34	0	0	111.7	E380 L381 K386 S387 D388	E380-Q384 PolarHBondContact O-N 3Å; L381-Q384 PolarHBondContact O-N 3.49Å; Q384-K386 VanDerWaalsContact C-N 3.27Å; Q384-K386 PolarHBondContact O-N 2.85Å; Q384-S387 PolarHBondContact O-N 3.43Å; Q384-D388 VanDerWaalsContact NE2-CG 3.34Å; Q384-D388 PolarHBondContact NE2-OD1 2.91Å; Q384-D388 PolarHBondContact NE2-OD2 3.11Å; Q384-D388 PolarHBondContact O-N 2.97Å
385	I	93.9	Very high	94.5	Very high	116 Å²	116	91.2 Å²	91.2	60%	0.595	49%	0.486	S	S	*	.	H	α-helix	trans	-58.7	-40.9	176.9	-71.6	166	0	0	0	111	L381 K389	L381-I385 WeakPolarHBondContact O-CB 3.5Å; L381-I385 VanDerWaalsContact O-CG1 3.25Å; L381-I385 WeakPolarHBondContact O-CG1 3.38Å; L381-I385 PolarHBondContact O-N 2.88Å; I385-K389 WeakPolarHBondContact O-CB 3.3Å; I385-K389 PolarHBondContact O-N 2.9Å
386	K	95.4	Very high	94.4	Very high	135 Å²	135	94 Å²	94	59%	0.587	50%	0.495	S	S	*	.	H	α-helix	trans	-64.7	-46.8	177.6	-171.1	-177.7	175.2	-169.5	0	111.4	Q382 A383 Q384 K389 E390	Q382-K386 WeakPolarHBondContact O-CB 3.3Å; Q382-K386 PolarHBondContact O-N 3.13Å; A383-K386 PolarHBondContact O-N 3.34Å; Q384-K386 VanDerWaalsContact C-N 3.27Å; Q384-K386 PolarHBondContact O-N 2.85Å; K386-K389 PolarHBondContact O-N 2.94Å; K386-E390 WeakPolarHBondContact CE-OE1 3.21Å; K386-E390 WeakPolarHBondContact O-CG 3.45Å; K386-E390 PolarHBondContact O-N 3.31Å
387	S	96	Very high	94.4	Very high	64 Å²	64	95.2 Å²	95.2	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-48.3	177	179.3	0	0	0	0	112.1	A383 Q384 K389 E390 A391	A383-S387 PolarHBondContact O-N 3.37Å; Q384-S387 PolarHBondContact O-N 3.43Å; S387-K389 VanDerWaalsContact C-N 3.31Å; S387-K389 PolarHBondContact O-N 3.35Å; S387-E390 PolarHBondContact O-N 2.92Å; S387-A391 PolarHBondContact O-N 2.88Å
388	D	94	Very high	94.5	Very high	85 Å²	85	96.7 Å²	96.7	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-66.4	-35.4	-179.1	-67.9	-17.8	0	0	0	111.6	Q384 A391 A392	Q384-D388 VanDerWaalsContact NE2-CG 3.34Å; Q384-D388 PolarHBondContact NE2-OD1 2.91Å; Q384-D388 PolarHBondContact NE2-OD2 3.11Å; Q384-D388 PolarHBondContact O-N 2.97Å; D388-A391 PolarHBondContact O-N 2.85Å; D388-A392 WeakPolarHBondContact O-CB 3.37Å; D388-A392 PolarHBondContact O-N 3.48Å
389	K	94.8	Very high	94.4	Very high	138 Å²	138	94.7 Å²	94.7	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-40.4	174.3	-173.8	173	-176.7	174.9	0	112.4	I385 K386 S387 A392 N393	I385-K389 WeakPolarHBondContact O-CB 3.3Å; I385-K389 PolarHBondContact O-N 2.9Å; K386-K389 PolarHBondContact O-N 2.94Å; S387-K389 VanDerWaalsContact C-N 3.31Å; S387-K389 PolarHBondContact O-N 3.35Å; K389-A392 PolarHBondContact O-N 2.97Å; K389-N393 WeakPolarHBondContact O-CB 3.42Å; K389-N393 VanDerWaalsContact O-CG 3.31Å; K389-N393 PolarHBondContact O-N 2.89Å
390	E	95	Very high	94.3	Very high	108 Å²	108	93.5 Å²	93.5	51%	0.505	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-45.1	174	-74.1	172.3	-170.4	0	0	110.8	K386 S387 A392 N393 T394	K386-E390 WeakPolarHBondContact CE-OE1 3.21Å; K386-E390 WeakPolarHBondContact O-CG 3.45Å; K386-E390 PolarHBondContact O-N 3.31Å; S387-E390 PolarHBondContact O-N 2.92Å; E390-A392 PolarHBondContact O-N 3.43Å; E390-N393 PolarHBondContact O-N 2.93Å; E390-T394 WeakPolarHBondContact O-CG2 3.43Å; E390-T394 PolarHBondContact O-N 3.13Å
391	A	94.4	Very high	94.3	Very high	55 Å²	55	94.4 Å²	94.4	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-59.7	-47.2	175	0	0	0	0	0	112.1	S387 D388 N393 T394 A395	S387-A391 PolarHBondContact O-N 2.88Å; D388-A391 PolarHBondContact O-N 2.85Å; A391-N393 PolarHBondContact O-N 3.49Å; A391-T394 PolarHBondContact O-N 3.22Å; A391-T394 PolarHBondContact O-OG1 2.93Å; A391-A395 PolarHBondContact O-N 3.33Å
392	A	93.4	Very high	94.2	Very high	57 Å²	57	95.3 Å²	95.3	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-46.4	177	0	0	0	0	0	112.2	D388 K389 E390 T394 A395 E396	D388-A392 WeakPolarHBondContact O-CB 3.37Å; D388-A392 PolarHBondContact O-N 3.48Å; K389-A392 PolarHBondContact O-N 2.97Å; E390-A392 PolarHBondContact O-N 3.43Å; A392-T394 VanDerWaalsContact C-N 3.33Å; A392-T394 PolarHBondContact O-N 3.28Å; A392-A395 PolarHBondContact O-N 3.38Å; A392-E396 WeakPolarHBondContact O-CB 3.49Å; A392-E396 PolarHBondContact O-N 3.36Å
393	N	94.9	Very high	94	Very high	75 Å²	75	94 Å²	94	40%	0.401	50%	0.5	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176.6	-79.3	-6	0	0	0	112	K389 E390 A391 E396 N397	K389-N393 WeakPolarHBondContact O-CB 3.42Å; K389-N393 VanDerWaalsContact O-CG 3.31Å; K389-N393 PolarHBondContact O-N 2.89Å; E390-N393 PolarHBondContact O-N 2.93Å; A391-N393 PolarHBondContact O-N 3.49Å; N393-E396 PolarHBondContact O-N 2.85Å; N393-N397 WeakPolarHBondContact O-CB 3.47Å; N393-N397 VanDerWaalsContact O-CG 3.22Å; N393-N397 PolarHBondContact O-N 2.93Å; N393-N397 PolarHBondContact O-ND2 3.5Å
394	T	94.8	Very high	93.8	Very high	69 Å²	69	98 Å²	98	42%	0.423	51%	0.506	S	S	.	.	H	α-helix	trans	-66.5	-38.3	176.8	63.4	0	0	0	0	112.3	E390 A391 A392 R398	E390-T394 WeakPolarHBondContact O-CG2 3.43Å; E390-T394 PolarHBondContact O-N 3.13Å; A391-T394 PolarHBondContact O-N 3.22Å; A391-T394 PolarHBondContact O-OG1 2.93Å; A392-T394 VanDerWaalsContact C-N 3.33Å; A392-T394 PolarHBondContact O-N 3.28Å; T394-R398 VanDerWaalsContact O-CG 3.27Å; T394-R398 WeakPolarHBondContact O-CG 3.48Å; T394-R398 PolarHBondContact O-N 3.43Å
395	A	91.6	Very high	93.6	Very high	49 Å²	49	97.1 Å²	97.1	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-42.1	175.9	0	0	0	0	0	111.5	A391 A392 R398 T399	A391-A395 PolarHBondContact O-N 3.33Å; A392-A395 PolarHBondContact O-N 3.38Å; A395-R398 PolarHBondContact O-N 2.89Å; A395-T399 PolarHBondContact O-N 3.33Å; A395-T399 PolarHBondContact O-OG1 3.43Å; A395-T399 VanDerWaalsContact O-OG1 3.06Å
396	E	93.9	Very high	93.3	Very high	121 Å²	121	93 Å²	93	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-63.2	-44.7	176.1	-172.5	175.7	-174.2	0	0	111.8	A392 N393 R398 T399 T400	A392-E396 WeakPolarHBondContact O-CB 3.49Å; A392-E396 PolarHBondContact O-N 3.36Å; N393-E396 PolarHBondContact O-N 2.85Å; E396-R398 VanDerWaalsContact C-N 3.3Å; E396-R398 PolarHBondContact O-N 3.48Å; E396-T399 PolarHBondContact O-N 2.83Å; E396-T400 WeakPolarHBondContact O-CG2 3.32Å; E396-T400 PolarHBondContact O-N 3.28Å; E396-T400 PolarHBondContact O-OG1 3.45Å; E396-T400 VanDerWaalsContact O-OG1 3.1Å
397	N	94.9	Very high	92.9	Very high	107 Å²	107	90.3 Å²	90.3	57%	0.572	48%	0.475	S	S	*	.	H	α-helix	trans	-61.3	-38.2	174.6	-73.8	-25	0	0	0	112.3	N393 T400 H401	N393-N397 WeakPolarHBondContact O-CB 3.47Å; N393-N397 VanDerWaalsContact O-CG 3.22Å; N393-N397 PolarHBondContact O-N 2.93Å; N393-N397 PolarHBondContact O-ND2 3.5Å; N397-T400 WeakPolarHBondContact CA-OG1 3.28Å; N397-T400 PolarHBondContact O-OG1 2.89Å; N397-H401 WeakPolarHBondContact O-CB 3.26Å; N397-H401 PolarHBondContact O-N 2.88Å
398	R	94.8	Very high	92.6	Very high	171 Å²	171	92.5 Å²	92.5	65%	0.645	48%	0.478	S	S	*	.	H	α-helix	trans	-65.4	-46.2	173.8	-74.9	171.2	-179.1	165.8	2	111.5	T394 A395 E396 T400 H401 I402	T394-R398 VanDerWaalsContact O-CG 3.27Å; T394-R398 WeakPolarHBondContact O-CG 3.48Å; T394-R398 PolarHBondContact O-N 3.43Å; A395-R398 PolarHBondContact O-N 2.89Å; E396-R398 VanDerWaalsContact C-N 3.3Å; E396-R398 PolarHBondContact O-N 3.48Å; R398-T400 PolarHBondContact O-N 2.87Å; R398-H401 PolarHBondContact O-N 3.37Å; R398-I402 VanDerWaalsContact O-CG1 3.3Å; R398-I402 WeakPolarHBondContact O-CG1 3.37Å; R398-I402 PolarHBondContact O-N 2.71Å
399	T	91.6	Very high	92.3	Very high	73 Å²	73	91.6 Å²	91.6	45%	0.448	47%	0.472	S	S	.	.	H	α-helix	trans	-62	-43.2	179.1	-61.6	0	0	0	0	111.7	A395 E396 I402 H403	A395-T399 PolarHBondContact O-N 3.33Å; A395-T399 PolarHBondContact O-OG1 3.43Å; A395-T399 VanDerWaalsContact O-OG1 3.06Å; E396-T399 PolarHBondContact O-N 2.83Å; T399-I402 PolarHBondContact O-N 2.87Å; T399-H403 PolarHBondContact O-N 3.27Å; T399-H403 PolarHBondContact O-ND1 3.47Å
400	T	93.6	Very high	91.8	Very high	60 Å²	60	86.9 Å²	86.9	37%	0.368	45%	0.452	S	S	.	.	H	α-helix	trans	-66.5	-37.5	176.7	55.4	0	0	0	0	112	E396 N397 R398 K404	E396-T400 WeakPolarHBondContact O-CG2 3.32Å; E396-T400 PolarHBondContact O-N 3.28Å; E396-T400 PolarHBondContact O-OG1 3.45Å; E396-T400 VanDerWaalsContact O-OG1 3.1Å; N397-T400 WeakPolarHBondContact CA-OG1 3.28Å; N397-T400 PolarHBondContact O-OG1 2.89Å; R398-T400 PolarHBondContact O-N 2.87Å; T400-K404 WeakPolarHBondContact O-CG 3.28Å; T400-K404 PolarHBondContact O-N 2.87Å
401	H	94.1	Very high	91.3	Very high	127 Å²	127	85.6 Å²	85.6	59%	0.588	45%	0.451	S	S	*	.	H	α-helix	trans	-64.5	-44.9	172.9	-171.9	-51.4	0	0	0	111.7	N397 R398 H403 K404 L405	N397-H401 WeakPolarHBondContact O-CB 3.26Å; N397-H401 PolarHBondContact O-N 2.88Å; R398-H401 PolarHBondContact O-N 3.37Å; H401-H403 VanDerWaalsContact C-N 3.34Å; H401-H403 PolarHBondContact O-N 3.45Å; H401-K404 PolarHBondContact O-N 2.81Å; H401-L405 WeakPolarHBondContact O-CB 3.49Å; H401-L405 PolarHBondContact O-N 3.19Å
402	I	91.9	Very high	90.9	Very high	102 Å²	102	88.6 Å²	88.6	52%	0.523	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-43.3	178	-69.7	166.6	0	0	0	110.2	R398 T399 K404 L405 L406	R398-I402 VanDerWaalsContact O-CG1 3.3Å; R398-I402 WeakPolarHBondContact O-CG1 3.37Å; R398-I402 PolarHBondContact O-N 2.71Å; T399-I402 PolarHBondContact O-N 2.87Å; I402-K404 PolarHBondContact O-N 3.28Å; I402-L405 PolarHBondContact O-N 2.95Å; I402-L406 VanDerWaalsContact O-CB 3.27Å; I402-L406 WeakPolarHBondContact O-CB 3.12Å; I402-L406 PolarHBondContact O-N 3.46Å
403	H	89.8	Confident	90.4	Very high	99 Å²	99	86.6 Å²	86.6	46%	0.458	44%	0.437	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.1	-83	78.7	0	0	0	112.3	T399 H401 L405 L406 D407	T399-H403 PolarHBondContact O-N 3.27Å; T399-H403 PolarHBondContact O-ND1 3.47Å; H401-H403 VanDerWaalsContact C-N 3.34Å; H401-H403 PolarHBondContact O-N 3.45Å; H403-L405 VanDerWaalsContact C-N 3.34Å; H403-L405 PolarHBondContact O-N 2.86Å; H403-L406 PolarHBondContact O-N 3.37Å; H403-D407 WeakPolarHBondContact O-CB 3.32Å; H403-D407 PolarHBondContact O-N 2.92Å
404	K	91.9	Very high	89.7	Confident	146 Å²	146	86.6 Å²	86.6	64%	0.635	43%	0.434	S	S	*	.	H	α-helix	trans	-60	-43.4	175.2	-75	175.6	-178.4	178.3	0	112.2	T400 H401 I402 L406 D407 Q408	T400-K404 WeakPolarHBondContact O-CG 3.28Å; T400-K404 PolarHBondContact O-N 2.87Å; H401-K404 PolarHBondContact O-N 2.81Å; I402-K404 PolarHBondContact O-N 3.28Å; K404-L406 VanDerWaalsContact C-N 3.34Å; K404-D407 PolarHBondContact O-N 3.49Å; K404-Q408 WeakPolarHBondContact O-CG 3.4Å; K404-Q408 PolarHBondContact O-N 3.44Å
405	L	90.2	Very high	89.2	Confident	82 Å²	82	88.6 Å²	88.6	43%	0.429	44%	0.438	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.3	-177.8	67.8	0	0	0	111	H401 I402 H403 D407 Q408 I409	H401-L405 WeakPolarHBondContact O-CB 3.49Å; H401-L405 PolarHBondContact O-N 3.19Å; I402-L405 PolarHBondContact O-N 2.95Å; H403-L405 VanDerWaalsContact C-N 3.34Å; H403-L405 PolarHBondContact O-N 2.86Å; L405-D407 VanDerWaalsContact C-N 3.34Å; L405-D407 PolarHBondContact O-N 3.46Å; L405-Q408 WeakPolarHBondContact O-CB 3.45Å; L405-Q408 PolarHBondContact O-N 2.92Å; L405-I409 HydrophobicContact CD1-CD1 4.47Å; L405-I409 HydrophobicContact CG-CD1 3.99Å; L405-I409 VanDerWaalsContact O-CG1 3.27Å; L405-I409 WeakPolarHBondContact O-CG1 3.25Å; L405-I409 PolarHBondContact O-N 2.86Å
406	L	88.1	Confident	88.8	Confident	29 Å²	29	90.4 Å²	90.4	15%	0.152	44%	0.441	C	S	.	.	H	α-helix	trans	-66.3	-38.3	179.9	-159.8	154.1	0	0	0	111.1	I402 H403 K404 I409 K410 E440 L443	I402-L406 VanDerWaalsContact O-CB 3.27Å; I402-L406 WeakPolarHBondContact O-CB 3.12Å; I402-L406 PolarHBondContact O-N 3.46Å; H403-L406 PolarHBondContact O-N 3.37Å; K404-L406 VanDerWaalsContact C-N 3.34Å; L406-I409 PolarHBondContact O-N 2.92Å; L406-K410 HydrophobicContact CD2-CD 3.92Å; L406-K410 HydrophobicContact CD2-CG 4.15Å; L406-K410 VanDerWaalsContact O-CG 3.31Å; L406-K410 WeakPolarHBondContact O-CG 3.35Å; L406-K410 PolarHBondContact O-N 3.23Å; L406-E440 HydrophobicContact CD1-CG 4.09Å; L406-E440 HydrophobicContact CD2-CB 4.31Å; L406-E440 HydrophobicContact CD2-CG 4.21Å; L406-L443 HydrophobicContact CD2-CD2 4.44Å
407	D	86.9	Confident	88	Confident	79 Å²	79	84.8 Å²	84.8	42%	0.422	42%	0.415	S	S	.	.	H	α-helix	trans	-68.4	-38.4	173.8	-70.8	-20.1	0	0	0	112.4	H403 K404 L405 K410 T411	H403-D407 WeakPolarHBondContact O-CB 3.32Å; H403-D407 PolarHBondContact O-N 2.92Å; K404-D407 PolarHBondContact O-N 3.49Å; L405-D407 VanDerWaalsContact C-N 3.34Å; L405-D407 PolarHBondContact O-N 3.46Å; D407-K410 PolarHBondContact O-N 3.39Å; D407-K410 IonicContact OD1-NZ 3.97Å; D407-K410 PolarHBondContact OD1-NZ 3.46Å; D407-T411 WeakPolarHBondContact O-CG2 3.42Å; D407-T411 PolarHBondContact O-N 3.41Å; D407-T411 PolarHBondContact O-OG1 2.91Å
408	Q	89.6	Confident	87.3	Confident	111 Å²	111	85.2 Å²	85.2	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-59.2	-49.7	169.9	-74.7	171.6	-11	0	0	111.2	K404 L405 K410 T411 E412	K404-Q408 WeakPolarHBondContact O-CG 3.4Å; K404-Q408 PolarHBondContact O-N 3.44Å; L405-Q408 WeakPolarHBondContact O-CB 3.45Å; L405-Q408 PolarHBondContact O-N 2.92Å; Q408-K410 VanDerWaalsContact C-N 3.34Å; Q408-K410 PolarHBondContact O-N 3.36Å; Q408-T411 PolarHBondContact O-N 2.9Å; Q408-T411 PolarHBondContact O-OG1 3.46Å; Q408-E412 PolarHBondContact O-N 2.77Å
409	I	87.8	Confident	86.6	Confident	65 Å²	65	85 Å²	85	33%	0.333	42%	0.42	S	S	.	.	H	α-helix	trans	-58.7	-44.1	177.7	-69.9	166.6	0	0	0	111.1	L405 L406 T411 E412 I413 L443	L405-I409 HydrophobicContact CD1-CD1 4.47Å; L405-I409 HydrophobicContact CG-CD1 3.99Å; L405-I409 VanDerWaalsContact O-CG1 3.27Å; L405-I409 WeakPolarHBondContact O-CG1 3.25Å; L405-I409 PolarHBondContact O-N 2.86Å; L406-I409 PolarHBondContact O-N 2.92Å; I409-T411 VanDerWaalsContact C-N 3.31Å; I409-T411 PolarHBondContact O-N 2.87Å; I409-E412 PolarHBondContact O-N 3.45Å; I409-I413 HydrophobicContact CG2-CD1 3.62Å; I409-I413 HydrophobicContact CG2-CG1 4.3Å; I409-I413 VanDerWaalsContact O-CB 3.28Å; I409-I413 WeakPolarHBondContact O-CB 3.42Å; I409-I413 WeakPolarHBondContact O-CG1 3.5Å; I409-I413 PolarHBondContact O-N 2.84Å; I409-L443 HydrophobicContact CG2-CD1 4.44Å; I409-L443 HydrophobicContact CG2-CD2 4.3Å
410	K	84.1	Confident	86	Confident	40 Å²	40	83.8 Å²	83.8	17%	0.174	41%	0.41	C	S	.	.	H	α-helix	trans	-56.5	-44.9	174.1	-76.3	168.1	179.6	153.6	0	111.4	L406 D407 Q408 K414 I438 L443	L406-K410 HydrophobicContact CD2-CD 3.92Å; L406-K410 HydrophobicContact CD2-CG 4.15Å; L406-K410 VanDerWaalsContact O-CG 3.31Å; L406-K410 WeakPolarHBondContact O-CG 3.35Å; L406-K410 PolarHBondContact O-N 3.23Å; D407-K410 PolarHBondContact O-N 3.39Å; D407-K410 IonicContact OD1-NZ 3.97Å; D407-K410 PolarHBondContact OD1-NZ 3.46Å; Q408-K410 VanDerWaalsContact C-N 3.34Å; Q408-K410 PolarHBondContact O-N 3.36Å; K410-K414 WeakPolarHBondContact O-CB 3.17Å; K410-K414 PolarHBondContact O-N 2.96Å; K410-I438 HydrophobicContact CB-CB 4.47Å; K410-I438 HydrophobicContact CB-CG2 4.35Å; K410-I438 VanDerWaalsContact CD-O 3.26Å; K410-I438 WeakPolarHBondContact CD-O 3.32Å; K410-I438 WeakPolarHBondContact CE-O 3.01Å; K410-I438 HydrophobicContact CG-CB 4.49Å; K410-I438 HydrophobicContact CG-CG2 4.05Å; K410-L443 HydrophobicContact CG-CD1 3.91Å
411	T	85	Confident	85	Confident	80 Å²	80	83.4 Å²	83.4	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-68.1	-42	180	58.8	0	0	0	0	112.8	D407 Q408 I409 K414 Q415	D407-T411 WeakPolarHBondContact O-CG2 3.42Å; D407-T411 PolarHBondContact O-N 3.41Å; D407-T411 PolarHBondContact O-OG1 2.91Å; Q408-T411 PolarHBondContact O-N 2.9Å; Q408-T411 PolarHBondContact O-OG1 3.46Å; I409-T411 VanDerWaalsContact C-N 3.31Å; I409-T411 PolarHBondContact O-N 2.87Å; T411-K414 PolarHBondContact O-N 3.28Å; T411-Q415 WeakPolarHBondContact O-CG 3.31Å; T411-Q415 PolarHBondContact O-N 3.44Å
412	E	85.7	Confident	83.6	Confident	119 Å²	119	77.8 Å²	77.8	56%	0.556	39%	0.393	S	S	*	.	H	α-helix	trans	-66.2	-43.5	178	-71.2	-177	178.3	0	0	111.5	Q408 I409 K414 Q415 L416	Q408-E412 PolarHBondContact O-N 2.77Å; I409-E412 PolarHBondContact O-N 3.45Å; E412-K414 PolarHBondContact O-N 2.79Å; E412-Q415 PolarHBondContact O-N 3.32Å; E412-L416 WeakPolarHBondContact O-CG 3.34Å; E412-L416 PolarHBondContact O-N 2.83Å
413	I	83.9	Confident	82.3	Confident	15 Å²	15	79.3 Å²	79.3	8%	0.077	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.8	-76	175.9	0	0	0	110.3	I409 Q415 L416 T417 I438 L443 L447 L450	I409-I413 HydrophobicContact CG2-CD1 3.62Å; I409-I413 HydrophobicContact CG2-CG1 4.3Å; I409-I413 VanDerWaalsContact O-CB 3.28Å; I409-I413 WeakPolarHBondContact O-CB 3.42Å; I409-I413 WeakPolarHBondContact O-CG1 3.5Å; I409-I413 PolarHBondContact O-N 2.84Å; I413-Q415 VanDerWaalsContact C-N 3.28Å; I413-Q415 PolarHBondContact O-N 2.75Å; I413-L416 PolarHBondContact O-N 3.14Å; I413-T417 WeakPolarHBondContact O-CB 3.48Å; I413-T417 PolarHBondContact O-N 3.4Å; I413-T417 PolarHBondContact O-OG1 3.25Å; I413-I438 HydrophobicContact CG2-CD1 4.1Å; I413-L443 HydrophobicContact CB-CD1 4.49Å; I413-L443 HydrophobicContact CD1-CD1 3.65Å; I413-L443 HydrophobicContact CD1-CG 4.3Å; I413-L443 HydrophobicContact CG2-CD1 4.43Å; I413-L447 HydrophobicContact CD1-CD1 4.16Å; I413-L450 HydrophobicContact CB-CD1 4.37Å; I413-L450 HydrophobicContact CG1-CD1 4.37Å; I413-L450 HydrophobicContact CG2-CD1 3.76Å
414	K	80.5	Confident	81	Confident	74 Å²	74	77.3 Å²	77.3	32%	0.322	39%	0.394	S	S	.	.	H	α-helix	trans	-55.4	-45.8	175.5	-166.9	169.1	178.8	166.3	0	111.2	K410 T411 E412 I418 D436 I438	K410-K414 WeakPolarHBondContact O-CB 3.17Å; K410-K414 PolarHBondContact O-N 2.96Å; T411-K414 PolarHBondContact O-N 3.28Å; E412-K414 PolarHBondContact O-N 2.79Å; K414-I418 HydrophobicContact CG-CD1 4.14Å; K414-I418 WeakPolarHBondContact O-CD1 3.22Å; K414-I418 VanDerWaalsContact O-CG1 3.26Å; K414-I418 WeakPolarHBondContact O-CG1 3.49Å; K414-I418 PolarHBondContact O-N 2.86Å; K414-I418 VanDerWaalsContact O-N 3.17Å; K414-D436 PolarHBondContact NZ-O 2.83Å; K414-D436 IonicContact NZ-OD1 3.33Å; K414-D436 PolarHBondContact NZ-OD1 3.38Å; K414-D436 IonicContact NZ-OD2 2.99Å; K414-I438 HydrophobicContact CB-CD1 3.49Å; K414-I438 VanDerWaalsContact CB-CD1 3.49Å; K414-I438 HydrophobicContact CB-CG1 4.35Å; K414-I438 HydrophobicContact CG-CD1 4Å
415	Q	82.8	Confident	79.7	Confident	111 Å²	111	74.4 Å²	74.4	52%	0.519	39%	0.392	S	S	.	.	H	α-helix	trans	-65.9	-40.8	178.9	-70.2	179.1	18.6	0	0	112.9	T411 E412 I413 I418 K419	T411-Q415 WeakPolarHBondContact O-CG 3.31Å; T411-Q415 PolarHBondContact O-N 3.44Å; E412-Q415 PolarHBondContact O-N 3.32Å; I413-Q415 VanDerWaalsContact C-N 3.28Å; I413-Q415 PolarHBondContact O-N 2.75Å; Q415-I418 PolarHBondContact O-N 3.41Å; Q415-K419 WeakPolarHBondContact O-CB 3.29Å; Q415-K419 WeakPolarHBondContact O-CG 3.42Å; Q415-K419 PolarHBondContact O-N 3.43Å
416	L	83.3	Confident	78.4	Confident	87 Å²	87	79.3 Å²	79.3	46%	0.455	41%	0.405	S	S	.	.	H	α-helix	trans	-65.9	-42.5	177.2	-74	173.2	0	0	0	111.7	E412 I413 I418 K419 L420 L450	E412-L416 WeakPolarHBondContact O-CG 3.34Å; E412-L416 PolarHBondContact O-N 2.83Å; I413-L416 PolarHBondContact O-N 3.14Å; L416-I418 VanDerWaalsContact C-N 3.28Å; L416-I418 PolarHBondContact O-N 3.47Å; L416-K419 PolarHBondContact O-N 2.93Å; L416-L420 WeakPolarHBondContact O-CB 3.28Å; L416-L420 PolarHBondContact O-N 2.99Å; L416-L450 HydrophobicContact CB-CD1 4.3Å; L416-L450 HydrophobicContact CB-CD2 4.02Å
417	T	77	Confident	77	Confident	3 Å²	3	78.3 Å²	78.3	2%	0.018	40%	0.4	C	S	.	.	H	α-helix	trans	-61.2	-40.2	178.5	-52.2	0	0	0	0	110.9	I413 G421 C422 L424 Y446 L450	I413-T417 WeakPolarHBondContact O-CB 3.48Å; I413-T417 PolarHBondContact O-N 3.4Å; I413-T417 PolarHBondContact O-OG1 3.25Å; T417-G421 PolarHBondContact O-N 2.65Å; T417-C422 HydrophobicContact CG2-CB 3.72Å; T417-C422 PolarHBondContact O-N 3.21Å; T417-L424 HydrophobicContact CG2-CD1 3.56Å; T417-L424 HydrophobicContact CG2-CG 4.05Å; T417-Y446 HydrophobicContact CG2-CD1 4.27Å; T417-L450 WeakPolarHBondContact OG1-CD1 3.27Å
418	I	80.2	Confident	75.8	Confident	117 Å²	117	77 Å²	77	60%	0.6	40%	0.395	S	S	*	.	H	α-helix	trans	-67.3	-46.9	174.5	-65.7	165.6	0	0	0	111.2	K414 Q415 L416 L420 G421	K414-I418 HydrophobicContact CG-CD1 4.14Å; K414-I418 WeakPolarHBondContact O-CD1 3.22Å; K414-I418 VanDerWaalsContact O-CG1 3.26Å; K414-I418 WeakPolarHBondContact O-CG1 3.49Å; K414-I418 PolarHBondContact O-N 2.86Å; K414-I418 VanDerWaalsContact O-N 3.17Å; Q415-I418 PolarHBondContact O-N 3.41Å; L416-I418 VanDerWaalsContact C-N 3.28Å; L416-I418 PolarHBondContact O-N 3.47Å; I418-L420 PolarHBondContact O-N 3.5Å; I418-G421 PolarHBondContact O-N 3.25Å
419	K	81.4	Confident	74.5	Confident	166 Å²	166	79.7 Å²	79.7	72%	0.722	41%	0.407	S	S	*	.	H	α-helix	trans	-65.7	-38.2	-177.6	-78.4	179.3	-178.4	176.4	0	113.6	Q415 L416 G421	Q415-K419 WeakPolarHBondContact O-CB 3.29Å; Q415-K419 WeakPolarHBondContact O-CG 3.42Å; Q415-K419 PolarHBondContact O-N 3.43Å; L416-K419 PolarHBondContact O-N 2.93Å; K419-G421 VanDerWaalsContact C-N 3.25Å
420	L	78.3	Confident	73.2	Confident	48 Å²	48	82.7 Å²	82.7	25%	0.251	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.7	-179.9	-72.7	160.6	0	0	0	113	L416 I418 C422 L450 R453 V454 L457	L416-L420 WeakPolarHBondContact O-CB 3.28Å; L416-L420 PolarHBondContact O-N 2.99Å; I418-L420 PolarHBondContact O-N 3.5Å; L420-C422 VanDerWaalsContact C-N 3.34Å; L420-C422 PolarHBondContact O-N 3.2Å; L420-L450 HydrophobicContact CD1-CD2 3.48Å; L420-L450 VanDerWaalsContact CD1-CD2 3.48Å; L420-R453 HydrophobicContact CB-CG 4.22Å; L420-R453 PolarHBondContact O-NE 3.46Å; L420-V454 HydrophobicContact CD1-CG2 4.23Å; L420-L457 HydrophobicContact CD2-CD1 3.48Å; L420-L457 VanDerWaalsContact CD2-CD1 3.48Å
421	G	72.9	Confident	71.9	Confident	51 Å²	51	83.5 Å²	83.5	53%	0.526	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	46.3	-177.3	0	0	0	0	0	111.6	T417 I418 K419	T417-G421 PolarHBondContact O-N 2.65Å; I418-G421 PolarHBondContact O-N 3.25Å; K419-G421 VanDerWaalsContact C-N 3.25Å
422	C	65.1	Low	70.4	Confident	9 Å²	9	81.9 Å²	81.9	6%	0.061	43%	0.427	C	S	.	.			trans	-66.2	140.1	176.3	-63.4	0	0	0	0	109.7	T417 L420 L424 V449 R453	T417-C422 HydrophobicContact CG2-CB 3.72Å; T417-C422 PolarHBondContact O-N 3.21Å; L420-C422 VanDerWaalsContact C-N 3.34Å; L420-C422 PolarHBondContact O-N 3.2Å; C422-L424 VanDerWaalsContact C-N 3.33Å; C422-L424 WeakPolarHBondContact O-CD1 3.12Å; C422-L424 PolarHBondContact O-N 3.42Å; C422-V449 HydrophobicContact CB-CG1 3.91Å; C422-R453 VanDerWaalsContact SG-CB 3.58Å
423	D	64.4	Low	68.9	Low	135 Å²	135	79.7 Å²	79.7	72%	0.722	44%	0.436	S	S	*	.			trans	-71.4	88.9	174.1	-82.1	-30.1	0	0	0	110.2	S425	D423-S425 PolarHBondContact O-N 3.43Å
424	L	61.3	Low	67.3	Low	57 Å²	57	86.1 Å²	86.1	30%	0.298	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.8	175.5	-82.7	95.9	0	0	0	112.7	T417 C422 R426 I427 T428 Y446	T417-L424 HydrophobicContact CG2-CD1 3.56Å; T417-L424 HydrophobicContact CG2-CG 4.05Å; C422-L424 VanDerWaalsContact C-N 3.33Å; C422-L424 WeakPolarHBondContact O-CD1 3.12Å; C422-L424 PolarHBondContact O-N 3.42Å; L424-R426 PolarHBondContact O-N 3.29Å; L424-I427 WeakPolarHBondContact O-CA 3.44Å; L424-I427 WeakPolarHBondContact O-CB 3.41Å; L424-I427 PolarHBondContact O-N 3.3Å; L424-T428 PolarHBondContact O-N 2.9Å; L424-T428 PolarHBondContact O-OG1 2.94Å; L424-Y446 HydrophobicContact CD2-CE1 3.59Å; L424-Y446 HydrophobicContact CG-CE1 4.18Å
425	S	65.2	Low	66	Low	84 Å²	84	82.8 Å²	82.8	59%	0.587	46%	0.457	S	S	*	.	H	α-helix	trans	-46.9	-40.6	-176.4	-69.8	0	0	0	0	113.1	D423 I427 T428 E429	D423-S425 PolarHBondContact O-N 3.43Å; S425-I427 PolarHBondContact O-N 3.3Å; S425-T428 WeakPolarHBondContact CA-OG1 3.38Å; S425-T428 PolarHBondContact O-OG1 3.48Å; S425-E429 WeakPolarHBondContact O-CB 3.43Å; S425-E429 PolarHBondContact O-N 2.74Å
426	R	62.7	Low	64.8	Low	186 Å²	186	83.1 Å²	83.1	70%	0.702	46%	0.463	S	S	*	.	H	α-helix	trans	-67.5	-35.7	179	-166.9	173.2	-175	169.2	1.6	112.8	L424 M430	L424-R426 PolarHBondContact O-N 3.29Å; R426-M430 WeakPolarHBondContact O-CB 3.36Å; R426-M430 PolarHBondContact O-N 2.7Å
427	I	58.9	Low	63.8	Low	8 Å²	8	86 Å²	86	4%	0.041	47%	0.474	C	S	.	.	H	α-helix	trans	-75.5	-46.9	177.7	-63	-179.1	0	0	0	110.1	L424 S425 E429 M430 L431 Y446 V449	L424-I427 WeakPolarHBondContact O-CA 3.44Å; L424-I427 WeakPolarHBondContact O-CB 3.41Å; L424-I427 PolarHBondContact O-N 3.3Å; S425-I427 PolarHBondContact O-N 3.3Å; I427-E429 VanDerWaalsContact C-N 3.29Å; I427-E429 PolarHBondContact O-N 3.27Å; I427-M430 PolarHBondContact O-N 2.84Å; I427-M430 VanDerWaalsContact O-N 3.14Å; I427-L431 HydrophobicContact CG2-CD1 3.45Å; I427-L431 VanDerWaalsContact CG2-CD1 3.45Å; I427-L431 WeakPolarHBondContact O-CB 3.42Å; I427-L431 PolarHBondContact O-N 3.31Å; I427-Y446 HydrophobicContact CD1-CD1 3.75Å; I427-Y446 HydrophobicContact CD1-CE1 3.96Å; I427-Y446 HydrophobicContact CD1-CG 4.14Å; I427-Y446 HydrophobicContact CG2-CE1 4.3Å; I427-Y446 HydrophobicContact CG2-CE2 4.15Å; I427-V449 HydrophobicContact CD1-CB 3.98Å; I427-V449 HydrophobicContact CD1-CG1 4.49Å; I427-V449 HydrophobicContact CD1-CG2 3.62Å; I427-V449 HydrophobicContact CG1-CG2 3.88Å
428	T	62.2	Low	63.2	Low	51 Å²	51	86.9 Å²	86.9	31%	0.313	48%	0.478	S	S	.	.	H	α-helix	trans	-62.4	-36	179	14.2	0	0	0	0	112.3	L424 S425 G432	L424-T428 PolarHBondContact O-N 2.9Å; L424-T428 PolarHBondContact O-OG1 2.94Å; S425-T428 WeakPolarHBondContact CA-OG1 3.38Å; S425-T428 PolarHBondContact O-OG1 3.48Å; T428-G432 PolarHBondContact O-N 2.93Å; T428-G432 VanDerWaalsContact O-N 3.08Å
429	E	62.3	Low	62.7	Low	168 Å²	168	85 Å²	85	79%	0.785	47%	0.472	S	S	*	.	H	α-helix	trans	-66.9	-41.1	173.5	-172	176.9	-171.1	0	0	111.7	S425 I427	S425-E429 WeakPolarHBondContact O-CB 3.43Å; S425-E429 PolarHBondContact O-N 2.74Å; I427-E429 VanDerWaalsContact C-N 3.29Å; I427-E429 PolarHBondContact O-N 3.27Å
430	M	59.3	Low	62	Low	128 Å²	128	82.6 Å²	82.6	63%	0.631	46%	0.464	S	S	*	.	H	α-helix	trans	-76.5	-28.9	-177.3	-142.5	-175.9	72.2	0	0	113.9	R426 I427 L445	R426-M430 WeakPolarHBondContact O-CB 3.36Å; R426-M430 PolarHBondContact O-N 2.7Å; I427-M430 PolarHBondContact O-N 2.84Å; I427-M430 VanDerWaalsContact O-N 3.14Å; M430-L445 HydrophobicContact CE-CD1 3.58Å; M430-L445 HydrophobicContact CE-CD2 3.98Å; M430-L445 HydrophobicContact CE-CG 4.44Å
431	L	57.9	Low	61.7	Low	56 Å²	56	90.7 Å²	90.7	29%	0.293	49%	0.491	S	S	.	.	H	α-helix	trans	-98.3	-9.9	-178.4	-82	147.4	0	0	0	114.1	I427 N442 L445	I427-L431 HydrophobicContact CG2-CD1 3.45Å; I427-L431 VanDerWaalsContact CG2-CD1 3.45Å; I427-L431 WeakPolarHBondContact O-CB 3.42Å; I427-L431 PolarHBondContact O-N 3.31Å; L431-N442 HydrophobicContact CD1-CB 4.06Å; L431-N442 VanDerWaalsContact CD2-CG 3.43Å; L431-N442 WeakPolarHBondContact CD2-ND2 3.21Å; L431-N442 WeakPolarHBondContact CD2-OD1 3.43Å; L431-L445 HydrophobicContact CD1-CD1 3.91Å
432	G	53.7	Low	61.6	Low	47 Å²	47	89 Å²	89	49%	0.485	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	96.5	176	0	0	0	0	0	112.9	T428 D434	T428-G432 PolarHBondContact O-N 2.93Å; T428-G432 VanDerWaalsContact O-N 3.08Å; G432-D434 PolarHBondContact O-N 2.96Å
433	G	54	Low	62.1	Low	73 Å²	73	89.9 Å²	89.9	75%	0.753	47%	0.474	S	S	*	.	S	Bend	trans	68.4	-38.6	156.6	0	0	0	0	0	118.7	G435	G433-G435 PolarHBondContact O-N 2.85Å
434	D	49.9	Very low	62.9	Low	149 Å²	149	89.4 Å²	89.4	80%	0.797	47%	0.469	S	S	*	.			trans	-87.9	17.3	-175.5	-71.2	-18.2	0	0	0	112.7	G432 D436 Q437	G432-D434 PolarHBondContact O-N 2.96Å; D434-D436 PolarHBondContact O-N 3.21Å; D434-Q437 PolarHBondContact O-N 2.9Å
435	G	53.5	Low	63.7	Low	4 Å²	4	89.3 Å²	89.3	4%	0.041	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-2.9	-168.9	0	0	0	0	0	116.6	G433 Q437 Y446	G433-G435 PolarHBondContact O-N 2.85Å; G435-Q437 VanDerWaalsContact C-N 3.26Å; G435-Q437 PolarHBondContact O-N 3.46Å; G435-Y446 PolarHBondContact O-OH 2.96Å
436	D	56.7	Low	64.4	Low	119 Å²	119	85.6 Å²	85.6	64%	0.636	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.5	176.9	-172.5	37.6	0	0	0	112.7	K414 D434	K414-D436 PolarHBondContact NZ-O 2.83Å; K414-D436 IonicContact NZ-OD1 3.33Å; K414-D436 PolarHBondContact NZ-OD1 3.38Å; K414-D436 IonicContact NZ-OD2 2.99Å; D434-D436 PolarHBondContact O-N 3.21Å
437	Q	62.5	Low	65.3	Low	148 Å²	148	80.6 Å²	80.6	69%	0.692	43%	0.428	S	S	*	.	S	Bend	trans	-100.5	124.8	176.4	-59.4	-158.3	13.3	0	0	112.5	D434 G435 T439	D434-Q437 PolarHBondContact O-N 2.9Å; G435-Q437 VanDerWaalsContact C-N 3.26Å; G435-Q437 PolarHBondContact O-N 3.46Å; Q437-T439 PolarHBondContact O-N 3.36Å; Q437-T439 VanDerWaalsContact O-N 3.15Å
438	I	64.3	Low	66.3	Low	20 Å²	20	83.7 Å²	83.7	10%	0.103	44%	0.444	C	S	.	.			trans	-81.3	91.4	171.6	-53.9	-167.4	0	0	0	108.6	K410 I413 K414 L443 Y446	K410-I438 HydrophobicContact CB-CB 4.47Å; K410-I438 HydrophobicContact CB-CG2 4.35Å; K410-I438 VanDerWaalsContact CD-O 3.26Å; K410-I438 WeakPolarHBondContact CD-O 3.32Å; K410-I438 WeakPolarHBondContact CE-O 3.01Å; K410-I438 HydrophobicContact CG-CB 4.49Å; K410-I438 HydrophobicContact CG-CG2 4.05Å; I413-I438 HydrophobicContact CG2-CD1 4.1Å; K414-I438 HydrophobicContact CB-CD1 3.49Å; K414-I438 VanDerWaalsContact CB-CD1 3.49Å; K414-I438 HydrophobicContact CB-CG1 4.35Å; K414-I438 HydrophobicContact CG-CD1 4Å; I438-L443 HydrophobicContact CG2-CB 4.42Å; I438-L443 HydrophobicContact CG2-CD1 3.68Å; I438-Y446 HydrophobicContact CB-CD2 4.41Å; I438-Y446 HydrophobicContact CB-CE2 4.36Å; I438-Y446 HydrophobicContact CD1-CD1 4.35Å; I438-Y446 HydrophobicContact CD1-CD2 4.2Å; I438-Y446 HydrophobicContact CD1-CE1 4.49Å; I438-Y446 HydrophobicContact CD1-CE2 4.36Å; I438-Y446 HydrophobicContact CD1-CG 4.2Å; I438-Y446 HydrophobicContact CG1-CD2 4.05Å; I438-Y446 HydrophobicContact CG1-CE2 3.83Å; I438-Y446 HydrophobicContact CG2-CD2 3.87Å; I438-Y446 HydrophobicContact CG2-CE2 4.29Å
439	T	70.5	Confident	67.2	Low	77 Å²	77	82.6 Å²	82.6	47%	0.472	44%	0.438	S	S	.	.			trans	-75.4	157	170.5	-30.8	0	0	0	0	110.3	Q437 R441 N442 L443	Q437-T439 PolarHBondContact O-N 3.36Å; Q437-T439 VanDerWaalsContact O-N 3.15Å; T439-R441 VanDerWaalsContact C-N 3.25Å; T439-R441 PolarHBondContact O-N 3.29Å; T439-N442 CarbonylContact O-C 3.54Å; T439-N442 WeakPolarHBondContact O-CA 3.35Å; T439-N442 PolarHBondContact O-N 2.82Å; T439-L443 PolarHBondContact O-N 3.27Å
440	E	67.6	Low	68.1	Low	117 Å²	117	75.1 Å²	75.1	55%	0.547	40%	0.403	S	S	.	.	H	α-helix	trans	-55.8	-38.8	178.3	-175	177.1	179.2	0	0	112.8	L406 N442 L443	L406-E440 HydrophobicContact CD1-CG 4.09Å; L406-E440 HydrophobicContact CD2-CB 4.31Å; L406-E440 HydrophobicContact CD2-CG 4.21Å; E440-N442 PolarHBondContact O-N 2.72Å; E440-L443 VanDerWaalsContact O-CB 3.31Å; E440-L443 WeakPolarHBondContact O-CB 3.42Å; E440-L443 PolarHBondContact O-N 3.45Å
441	R	70.6	Confident	69.3	Low	218 Å²	218	74.6 Å²	74.6	82%	0.823	40%	0.399	S	S	*	.	H	α-helix	trans	-63.7	-29.3	174.6	-173.9	173	175	81.4	0.9	113.2	T439	T439-R441 VanDerWaalsContact C-N 3.25Å; T439-R441 PolarHBondContact O-N 3.29Å
442	N	70.9	Confident	70.5	Confident	15 Å²	15	76.9 Å²	76.9	8%	0.08	41%	0.408	C	S	.	.	H	α-helix	trans	-91.7	-21	-177	-57.6	-1.6	0	0	0	111.3	L431 T439 E440 M444 L445 Y446	L431-N442 HydrophobicContact CD1-CB 4.06Å; L431-N442 VanDerWaalsContact CD2-CG 3.43Å; L431-N442 WeakPolarHBondContact CD2-ND2 3.21Å; L431-N442 WeakPolarHBondContact CD2-OD1 3.43Å; T439-N442 CarbonylContact O-C 3.54Å; T439-N442 WeakPolarHBondContact O-CA 3.35Å; T439-N442 PolarHBondContact O-N 2.82Å; E440-N442 PolarHBondContact O-N 2.72Å; N442-M444 PolarHBondContact O-N 3.47Å; N442-L445 WeakPolarHBondContact O-CB 3.27Å; N442-L445 PolarHBondContact O-N 3.19Å; N442-Y446 HydrophobicContact CB-CD2 4.1Å; N442-Y446 HydrophobicContact CB-CE2 4.04Å; N442-Y446 VanDerWaalsContact O-CD2 3.28Å; N442-Y446 WeakPolarHBondContact O-CD2 3.29Å; N442-Y446 PolarHBondContact O-N 2.86Å
443	L	76.3	Confident	71.8	Confident	28 Å²	28	77.9 Å²	77.9	15%	0.147	40%	0.398	C	S	.	.	H	α-helix	trans	-51.4	-42.4	-178	-169.6	65.9	0	0	0	112.3	L406 I409 K410 I413 I438 T439 E440 L445 Y446 L447	L406-L443 HydrophobicContact CD2-CD2 4.44Å; I409-L443 HydrophobicContact CG2-CD1 4.44Å; I409-L443 HydrophobicContact CG2-CD2 4.3Å; K410-L443 HydrophobicContact CG-CD1 3.91Å; I413-L443 HydrophobicContact CB-CD1 4.49Å; I413-L443 HydrophobicContact CD1-CD1 3.65Å; I413-L443 HydrophobicContact CD1-CG 4.3Å; I413-L443 HydrophobicContact CG2-CD1 4.43Å; I438-L443 HydrophobicContact CG2-CB 4.42Å; I438-L443 HydrophobicContact CG2-CD1 3.68Å; T439-L443 PolarHBondContact O-N 3.27Å; E440-L443 VanDerWaalsContact O-CB 3.31Å; E440-L443 WeakPolarHBondContact O-CB 3.42Å; E440-L443 PolarHBondContact O-N 3.45Å; L443-L445 PolarHBondContact O-N 3.07Å; L443-Y446 PolarHBondContact O-N 3.17Å; L443-L447 PolarHBondContact O-N 3.03Å
444	M	81.1	Confident	73.3	Confident	125 Å²	125	77.8 Å²	77.8	62%	0.616	38%	0.382	S	S	*	.	H	α-helix	trans	-64.3	-38.9	178.1	-163.9	72.4	171.1	0	0	112.4	N442 L447 N448	N442-M444 PolarHBondContact O-N 3.47Å; M444-L447 PolarHBondContact O-N 3.15Å; M444-N448 PolarHBondContact O-N 2.81Å; M444-N448 PolarHBondContact O-ND2 3.05Å; M444-N448 PolarHBondContact O-OD1 3.47Å
445	L	78.1	Confident	74.9	Confident	55 Å²	55	74.1 Å²	74.1	29%	0.288	36%	0.362	S	S	.	.	H	α-helix	trans	-69	-40.7	178.3	-63.8	171	0	0	0	111.1	M430 L431 N442 L443 L447 N448 V449	M430-L445 HydrophobicContact CE-CD1 3.58Å; M430-L445 HydrophobicContact CE-CD2 3.98Å; M430-L445 HydrophobicContact CE-CG 4.44Å; L431-L445 HydrophobicContact CD1-CD1 3.91Å; N442-L445 WeakPolarHBondContact O-CB 3.27Å; N442-L445 PolarHBondContact O-N 3.19Å; L443-L445 PolarHBondContact O-N 3.07Å; L445-L447 VanDerWaalsContact C-N 3.33Å; L445-N448 PolarHBondContact O-N 3.23Å; L445-V449 PolarHBondContact O-N 3.5Å; L445-V449 VanDerWaalsContact O-N 3.14Å
446	Y	78.8	Confident	76.4	Confident	5 Å²	5	78 Å²	78	2%	0.02	38%	0.38	C	S	.	.	H	α-helix	trans	-60.7	-42.2	172.9	-82.4	-72.2	0	0	0	112.2	T417 L424 I427 G435 I438 N442 L443 V449 L450	T417-Y446 HydrophobicContact CG2-CD1 4.27Å; L424-Y446 HydrophobicContact CD2-CE1 3.59Å; L424-Y446 HydrophobicContact CG-CE1 4.18Å; I427-Y446 HydrophobicContact CD1-CD1 3.75Å; I427-Y446 HydrophobicContact CD1-CE1 3.96Å; I427-Y446 HydrophobicContact CD1-CG 4.14Å; I427-Y446 HydrophobicContact CG2-CE1 4.3Å; I427-Y446 HydrophobicContact CG2-CE2 4.15Å; G435-Y446 PolarHBondContact O-OH 2.96Å; I438-Y446 HydrophobicContact CB-CD2 4.41Å; I438-Y446 HydrophobicContact CB-CE2 4.36Å; I438-Y446 HydrophobicContact CD1-CD1 4.35Å; I438-Y446 HydrophobicContact CD1-CD2 4.2Å; I438-Y446 HydrophobicContact CD1-CE1 4.49Å; I438-Y446 HydrophobicContact CD1-CE2 4.36Å; I438-Y446 HydrophobicContact CD1-CG 4.2Å; I438-Y446 HydrophobicContact CG1-CD2 4.05Å; I438-Y446 HydrophobicContact CG1-CE2 3.83Å; I438-Y446 HydrophobicContact CG2-CD2 3.87Å; I438-Y446 HydrophobicContact CG2-CE2 4.29Å; N442-Y446 HydrophobicContact CB-CD2 4.1Å; N442-Y446 HydrophobicContact CB-CE2 4.04Å; N442-Y446 VanDerWaalsContact O-CD2 3.28Å; N442-Y446 WeakPolarHBondContact O-CD2 3.29Å; N442-Y446 PolarHBondContact O-N 2.86Å; L443-Y446 PolarHBondContact O-N 3.17Å; Y446-V449 PolarHBondContact O-N 2.91Å; Y446-L450 WeakPolarHBondContact O-CB 3.26Å; Y446-L450 PolarHBondContact O-N 3.41Å
447	L	81.7	Confident	77.7	Confident	82 Å²	82	75.6 Å²	75.6	43%	0.429	37%	0.366	S	S	.	.	H	α-helix	trans	-65	-42.2	178	-168.2	64.6	0	0	0	111.9	I413 L443 M444 L445 V449 L450 E451	I413-L447 HydrophobicContact CD1-CD1 4.16Å; L443-L447 PolarHBondContact O-N 3.03Å; M444-L447 PolarHBondContact O-N 3.15Å; L445-L447 VanDerWaalsContact C-N 3.33Å; L447-V449 VanDerWaalsContact C-N 3.33Å; L447-V449 PolarHBondContact O-N 2.67Å; L447-L450 WeakPolarHBondContact O-CB 3.03Å; L447-L450 PolarHBondContact O-N 3.05Å; L447-E451 WeakPolarHBondContact O-CB 3.18Å; L447-E451 PolarHBondContact O-N 3.32Å
448	N	81.4	Confident	78.7	Confident	72 Å²	72	73.2 Å²	73.2	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-38.8	177.1	-68.6	-12.1	0	0	0	112.5	M444 L445 Q452	M444-N448 PolarHBondContact O-N 2.81Å; M444-N448 PolarHBondContact O-ND2 3.05Å; M444-N448 PolarHBondContact O-OD1 3.47Å; L445-N448 PolarHBondContact O-N 3.23Å; N448-Q452 PolarHBondContact O-N 3.11Å
449	V	81.1	Confident	79.7	Confident	29 Å²	29	76.8 Å²	76.8	18%	0.176	38%	0.381	C	S	.	.	H	α-helix	trans	-72.1	-38.1	177.3	171.9	0	0	0	0	111.4	C422 I427 L445 Y446 L447 Q452 R453	C422-V449 HydrophobicContact CB-CG1 3.91Å; I427-V449 HydrophobicContact CD1-CB 3.98Å; I427-V449 HydrophobicContact CD1-CG1 4.49Å; I427-V449 HydrophobicContact CD1-CG2 3.62Å; I427-V449 HydrophobicContact CG1-CG2 3.88Å; L445-V449 PolarHBondContact O-N 3.5Å; L445-V449 VanDerWaalsContact O-N 3.14Å; Y446-V449 PolarHBondContact O-N 2.91Å; L447-V449 VanDerWaalsContact C-N 3.33Å; L447-V449 PolarHBondContact O-N 2.67Å; V449-Q452 PolarHBondContact O-N 3.08Å; V449-R453 WeakPolarHBondContact O-CB 3.17Å; V449-R453 PolarHBondContact O-N 3.45Å
450	L	81.1	Confident	80.2	Confident	11 Å²	11	77.4 Å²	77.4	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-60	-45.6	171.7	-87.9	170.4	0	0	0	111.9	I413 L416 T417 L420 Y446 L447 R453 V454	I413-L450 HydrophobicContact CB-CD1 4.37Å; I413-L450 HydrophobicContact CG1-CD1 4.37Å; I413-L450 HydrophobicContact CG2-CD1 3.76Å; L416-L450 HydrophobicContact CB-CD1 4.3Å; L416-L450 HydrophobicContact CB-CD2 4.02Å; T417-L450 WeakPolarHBondContact OG1-CD1 3.27Å; L420-L450 HydrophobicContact CD1-CD2 3.48Å; L420-L450 VanDerWaalsContact CD1-CD2 3.48Å; Y446-L450 WeakPolarHBondContact O-CB 3.26Å; Y446-L450 PolarHBondContact O-N 3.41Å; L447-L450 WeakPolarHBondContact O-CB 3.03Å; L447-L450 PolarHBondContact O-N 3.05Å; L450-R453 PolarHBondContact O-N 3.36Å; L450-V454 VanDerWaalsContact O-CG2 3.31Å; L450-V454 WeakPolarHBondContact O-CG2 3.37Å; L450-V454 PolarHBondContact O-N 2.91Å
451	E	83.1	Confident	80.8	Confident	116 Å²	116	77.6 Å²	77.6	54%	0.542	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-49.6	176.8	-175.5	177.8	-168.7	0	0	111.1	L447 R453 V454 D455	L447-E451 WeakPolarHBondContact O-CB 3.18Å; L447-E451 PolarHBondContact O-N 3.32Å; E451-R453 VanDerWaalsContact C-N 3.28Å; E451-R453 PolarHBondContact O-N 2.94Å; E451-V454 PolarHBondContact O-N 2.74Å; E451-V454 VanDerWaalsContact O-N 3.12Å; E451-D455 PolarHBondContact O-N 2.99Å
452	Q	82.9	Confident	81.2	Confident	104 Å²	104	70.6 Å²	70.6	49%	0.486	37%	0.367	S	S	.	.	H	α-helix	trans	-57.8	-41.3	177.1	-173.9	178.2	-4.5	0	0	112.1	N448 V449 D455 E456	N448-Q452 PolarHBondContact O-N 3.11Å; V449-Q452 PolarHBondContact O-N 3.08Å; Q452-D455 PolarHBondContact O-N 3.46Å; Q452-E456 WeakPolarHBondContact O-CG 3.5Å; Q452-E456 PolarHBondContact O-N 2.85Å; Q452-E456 VanDerWaalsContact O-N 3.09Å
453	R	82.3	Confident	81.5	Confident	69 Å²	69	78.1 Å²	78.1	26%	0.26	40%	0.395	S	S	.	.	H	α-helix	trans	-67.6	-38.4	178.1	-174.8	67.5	-173.3	118.3	3.8	112.3	L420 C422 V449 L450 E451 E456 L457	L420-R453 HydrophobicContact CB-CG 4.22Å; L420-R453 PolarHBondContact O-NE 3.46Å; C422-R453 VanDerWaalsContact SG-CB 3.58Å; V449-R453 WeakPolarHBondContact O-CB 3.17Å; V449-R453 PolarHBondContact O-N 3.45Å; L450-R453 PolarHBondContact O-N 3.36Å; E451-R453 VanDerWaalsContact C-N 3.28Å; E451-R453 PolarHBondContact O-N 2.94Å; R453-E456 IonicContact NH1-OE2 2.72Å; R453-E456 PolarHBondContact NH1-OE2 3.32Å; R453-E456 VanDerWaalsContact NH1-OE2 3.08Å; R453-E456 PolarHBondContact O-N 3Å; R453-L457 HydrophobicContact CG-CD1 4.49Å; R453-L457 WeakPolarHBondContact O-CG 3.22Å; R453-L457 PolarHBondContact O-N 3.23Å; R453-L457 VanDerWaalsContact O-N 3.09Å
454	V	84.7	Confident	81.6	Confident	70 Å²	70	80.1 Å²	80.1	42%	0.424	41%	0.412	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175.9	169.5	0	0	0	0	110.6	L420 L450 E451 E456 L457 L458	L420-V454 HydrophobicContact CD1-CG2 4.23Å; L450-V454 VanDerWaalsContact O-CG2 3.31Å; L450-V454 WeakPolarHBondContact O-CG2 3.37Å; L450-V454 PolarHBondContact O-N 2.91Å; E451-V454 PolarHBondContact O-N 2.74Å; E451-V454 VanDerWaalsContact O-N 3.12Å; V454-E456 PolarHBondContact O-N 2.9Å; V454-L457 PolarHBondContact O-N 3.18Å; V454-L458 WeakPolarHBondContact O-CB 3.26Å; V454-L458 PolarHBondContact O-N 3.34Å
455	D	84.6	Confident	81.1	Confident	72 Å²	72	79.9 Å²	79.9	39%	0.385	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-40.2	176.6	-79.4	-13.5	0	0	0	112.7	E451 Q452 L458 T459	E451-D455 PolarHBondContact O-N 2.99Å; Q452-D455 PolarHBondContact O-N 3.46Å; D455-L458 PolarHBondContact O-N 3.32Å; D455-T459 WeakPolarHBondContact O-CB 3.33Å; D455-T459 PolarHBondContact O-N 3.19Å; D455-T459 PolarHBondContact O-OG1 3.36Å
456	E	84.3	Confident	80.4	Confident	86 Å²	86	82.3 Å²	82.3	40%	0.402	42%	0.422	S	S	.	.	H	α-helix	trans	-60.9	-47.3	173	-72.5	169.6	-173.8	0	0	111.5	Q452 R453 V454 L458 T459 V460	Q452-E456 WeakPolarHBondContact O-CG 3.5Å; Q452-E456 PolarHBondContact O-N 2.85Å; Q452-E456 VanDerWaalsContact O-N 3.09Å; R453-E456 IonicContact NH1-OE2 2.72Å; R453-E456 PolarHBondContact NH1-OE2 3.32Å; R453-E456 VanDerWaalsContact NH1-OE2 3.08Å; R453-E456 PolarHBondContact O-N 3Å; V454-E456 PolarHBondContact O-N 2.9Å; E456-L458 VanDerWaalsContact C-N 3.31Å; E456-L458 PolarHBondContact O-N 3.26Å; E456-T459 WeakPolarHBondContact O-CB 3.26Å; E456-T459 PolarHBondContact O-N 2.83Å; E456-V460 WeakPolarHBondContact O-CG2 3.39Å; E456-V460 PolarHBondContact O-N 3.45Å
457	L	83.8	Confident	79.4	Confident	69 Å²	69	88.6 Å²	88.6	36%	0.361	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-37.5	177.8	-72.5	171.3	0	0	0	111.9	L420 R453 V454 V460 K461	L420-L457 HydrophobicContact CD2-CD1 3.48Å; L420-L457 VanDerWaalsContact CD2-CD1 3.48Å; R453-L457 HydrophobicContact CG-CD1 4.49Å; R453-L457 WeakPolarHBondContact O-CG 3.22Å; R453-L457 PolarHBondContact O-N 3.23Å; R453-L457 VanDerWaalsContact O-N 3.09Å; V454-L457 PolarHBondContact O-N 3.18Å; L457-V460 PolarHBondContact O-N 3.22Å; L457-K461 PolarHBondContact O-N 3.46Å
458	L	84.4	Confident	78	Confident	98 Å²	98	87.2 Å²	87.2	51%	0.513	46%	0.455	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.5	-163.6	73.2	0	0	0	110.9	V454 D455 E456 V460 K461 C462	V454-L458 WeakPolarHBondContact O-CB 3.26Å; V454-L458 PolarHBondContact O-N 3.34Å; D455-L458 PolarHBondContact O-N 3.32Å; E456-L458 VanDerWaalsContact C-N 3.31Å; E456-L458 PolarHBondContact O-N 3.26Å; L458-V460 VanDerWaalsContact C-N 3.34Å; L458-V460 PolarHBondContact O-N 3.04Å; L458-K461 PolarHBondContact O-N 3.17Å; L458-C462 PolarHBondContact O-N 2.95Å; L458-C462 PolarHBondContact O-SG 3.42Å; L458-C462 VanDerWaalsContact O-SG 3.35Å
459	T	83.5	Confident	76.3	Confident	95 Å²	95	91.7 Å²	91.7	58%	0.583	47%	0.473	S	S	*	.	H	α-helix	trans	-60.1	-44.1	175.7	-55.7	0	0	0	0	111.3	D455 E456 K461 C462 Y463	D455-T459 WeakPolarHBondContact O-CB 3.33Å; D455-T459 PolarHBondContact O-N 3.19Å; D455-T459 PolarHBondContact O-OG1 3.36Å; E456-T459 WeakPolarHBondContact O-CB 3.26Å; E456-T459 PolarHBondContact O-N 2.83Å; T459-K461 PolarHBondContact O-N 3.12Å; T459-C462 PolarHBondContact O-N 2.66Å; T459-Y463 WeakPolarHBondContact O-CB 3.39Å; T459-Y463 PolarHBondContact O-N 3.33Å
460	V	82.7	Confident	74.6	Confident	89 Å²	89	93.8 Å²	93.8	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-40.1	176.1	172.7	0	0	0	0	111.7	E456 L457 L458 Y463 S464	E456-V460 WeakPolarHBondContact O-CG2 3.39Å; E456-V460 PolarHBondContact O-N 3.45Å; L457-V460 PolarHBondContact O-N 3.22Å; L458-V460 VanDerWaalsContact C-N 3.34Å; L458-V460 PolarHBondContact O-N 3.04Å; V460-Y463 PolarHBondContact O-N 2.83Å; V460-S464 WeakPolarHBondContact O-CB 3.38Å; V460-S464 PolarHBondContact O-N 3.24Å; V460-S464 PolarHBondContact O-OG 3.48Å
461	K	78.9	Confident	72.9	Confident	121 Å²	121	100 Å²	100	53%	0.526	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-46.5	176.7	-176.5	-178.9	177	-177.6	0	111.9	L457 L458 T459 Y463 S464 Q465	L457-K461 PolarHBondContact O-N 3.46Å; L458-K461 PolarHBondContact O-N 3.17Å; T459-K461 PolarHBondContact O-N 3.12Å; K461-Y463 VanDerWaalsContact C-N 3.26Å; K461-Y463 PolarHBondContact O-N 3.43Å; K461-S464 PolarHBondContact O-N 3.47Å; K461-S464 VanDerWaalsContact O-N 3.12Å; K461-Q465 PolarHBondContact O-N 2.93Å
462	C	79	Confident	70.8	Confident	72 Å²	72	102.5 Å²	102.5	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-57.5	-42.1	175.7	-71.4	0	0	0	0	111.1	L458 T459 N466	L458-C462 PolarHBondContact O-N 2.95Å; L458-C462 PolarHBondContact O-SG 3.42Å; L458-C462 VanDerWaalsContact O-SG 3.35Å; T459-C462 PolarHBondContact O-N 2.66Å; C462-N466 PolarHBondContact O-N 2.93Å; C462-N466 VanDerWaalsContact O-N 3.15Å
463	Y	77.7	Confident	68.6	Low	172 Å²	172	104.6 Å²	104.6	68%	0.675	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-39.6	176.3	-150.7	-88.7	0	0	0	112.4	T459 V460 K461 K467	T459-Y463 WeakPolarHBondContact O-CB 3.39Å; T459-Y463 PolarHBondContact O-N 3.33Å; V460-Y463 PolarHBondContact O-N 2.83Å; K461-Y463 VanDerWaalsContact C-N 3.26Å; K461-Y463 PolarHBondContact O-N 3.43Å; Y463-K467 PolarHBondContact O-N 3.44Å; Y463-K467 VanDerWaalsContact O-N 3.09Å
464	S	77.5	Confident	66.5	Low	70 Å²	70	108.3 Å²	108.3	49%	0.49	57%	0.571	S	S	.	*	H	α-helix	trans	-72	-37	179.4	-57.4	0	0	0	0	113	V460 K461 K467 G468	V460-S464 WeakPolarHBondContact O-CB 3.38Å; V460-S464 PolarHBondContact O-N 3.24Å; V460-S464 PolarHBondContact O-OG 3.48Å; K461-S464 PolarHBondContact O-N 3.47Å; K461-S464 VanDerWaalsContact O-N 3.12Å; S464-K467 PolarHBondContact O-N 2.75Å; S464-G468 PolarHBondContact O-N 2.96Å
465	Q	70.7	Confident	64.3	Low	121 Å²	121	113.5 Å²	113.5	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-65.9	-40.6	174.3	-79.2	-174.5	-53.7	0	0	111.7	K461 K467 G468 H469	K461-Q465 PolarHBondContact O-N 2.93Å; Q465-K467 VanDerWaalsContact C-N 3.29Å; Q465-K467 PolarHBondContact O-N 3.3Å; Q465-G468 PolarHBondContact O-N 2.76Å; Q465-H469 PolarHBondContact O-N 3.48Å; Q465-H469 VanDerWaalsContact O-N 3.14Å
466	N	64.9	Low	62.1	Low	105 Å²	105	116.7 Å²	116.7	56%	0.561	61%	0.608	S	S	*	*	H	α-helix	trans	-62.3	-38.4	172.6	-98.9	15.3	0	0	0	112	C462 H469 S470	C462-N466 PolarHBondContact O-N 2.93Å; C462-N466 VanDerWaalsContact O-N 3.15Å; N466-H469 PolarHBondContact O-N 3.12Å; N466-S470 PolarHBondContact O-N 3.23Å
467	K	57.4	Low	59.7	Low	138 Å²	138	119.5 Å²	119.5	60%	0.6	63%	0.626	S	S	*	*	H	α-helix	trans	-72.1	-35.1	178.2	-156.2	172.1	-175.9	179.5	0	112.8	Y463 S464 Q465 H469 S470	Y463-K467 PolarHBondContact O-N 3.44Å; Y463-K467 VanDerWaalsContact O-N 3.09Å; S464-K467 PolarHBondContact O-N 2.75Å; Q465-K467 VanDerWaalsContact C-N 3.29Å; Q465-K467 PolarHBondContact O-N 3.3Å; K467-H469 VanDerWaalsContact C-N 3.28Å; K467-H469 PolarHBondContact O-N 3.15Å; K467-S470 WeakPolarHBondContact CA-OG 3.27Å; K467-S470 PolarHBondContact O-N 3.44Å; K467-S470 PolarHBondContact O-OG 2.8Å
468	G	52.5	Low	57.6	Low	53 Å²	53	124.1 Å²	124.1	55%	0.546	65%	0.65	S	S	.	*	H	α-helix	trans	-70.7	-19.6	174.5	0	0	0	0	0	114.2	S464 Q465	S464-G468 PolarHBondContact O-N 2.96Å; Q465-G468 PolarHBondContact O-N 2.76Å
469	H	45.9	Very low	55.3	Low	165 Å²	165	128.5 Å²	128.5	76%	0.764	67%	0.665	S	S	*	*	H	α-helix	trans	-90.2	-14.4	170	-87.4	9	0	0	0	113.9	Q465 N466 K467	Q465-H469 PolarHBondContact O-N 3.48Å; Q465-H469 VanDerWaalsContact O-N 3.14Å; N466-H469 PolarHBondContact O-N 3.12Å; K467-H469 VanDerWaalsContact C-N 3.28Å; K467-H469 PolarHBondContact O-N 3.15Å
470	S	45.5	Very low	53.1	Low	73 Å²	73	130.6 Å²	130.6	51%	0.51	67%	0.671	S	S	.	*	H	α-helix	trans	-80.1	-14.7	175.9	56.3	0	0	0	0	114.3	N466 K467 E472	N466-S470 PolarHBondContact O-N 3.23Å; K467-S470 WeakPolarHBondContact CA-OG 3.27Å; K467-S470 PolarHBondContact O-N 3.44Å; K467-S470 PolarHBondContact O-OG 2.8Å; S470-E472 VanDerWaalsContact C-N 3.28Å; S470-E472 PolarHBondContact O-N 3.43Å
471	D	44.1	Very low	50.9	Low	143 Å²	143	132 Å²	132	77%	0.765	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-12.5	179.7	-79.9	-6.8	0	0	0	113.4
472	E	39	Very low	48.9	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-22.5	178.7	-86.3	-170.1	168.2	0	0	116.8	S470	S470-E472 VanDerWaalsContact C-N 3.28Å; S470-E472 PolarHBondContact O-N 3.43Å
473	M	36.7	Very low	46.7	Very low	149 Å²	149	131.7 Å²	131.7	73%	0.734	69%	0.686	S	S	*	*	S	Bend	trans	-140.9	108	-174.7	-71.3	-70	127.9	0	0	114.5
474	N	39.4	Very low	44.8	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	69%	0.688	S	S	*	*			trans	44.2	112.2	143.1	-75	-27.8	0	0	0	119.1	D476	N474-D476 PolarHBondContact O-N 2.8Å
475	Q	37.3	Very low	42.8	Very low	179 Å²	179	131.4 Å²	131.4	84%	0.836	70%	0.697	S	S	*	*	S	Bend	trans	-38.6	21.1	168.4	-149.8	172.1	7.8	0	0	120
476	D	38.5	Very low	41.1	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	71%	0.709	S	S	*	*			trans	-125.5	76.4	-177.2	-74.3	-30.4	0	0	0	111.3	N474	N474-D476 PolarHBondContact O-N 2.8Å
477	N	35.4	Very low	39.5	Very low	145 Å²	145	136.3 Å²	136.3	78%	0.775	72%	0.716	S	S	*	*			trans	157.8	62.6	147.3	-81.4	-39	0	0	0	112.3	K479	N477-K479 PolarHBondContact O-N 3.22Å; N477-K479 VanDerWaalsContact O-N 3.12Å
478	L	37.9	Very low	38.3	Very low	166 Å²	166	137.9 Å²	137.9	87%	0.869	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	18.6	173.6	-82.8	152.7	0	0	0	114.2
479	K	37.7	Very low	37.4	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	24.6	178.5	-70.8	-171.3	-179.4	179.4	0	113.7	N477 T481	N477-K479 PolarHBondContact O-N 3.22Å; N477-K479 VanDerWaalsContact O-N 3.12Å; K479-T481 PolarHBondContact O-N 2.83Å
480	I	36.2	Very low	36.6	Very low	139 Å²	139	140.3 Å²	140.3	71%	0.713	73%	0.731	S	S	*	*			trans	-80.2	77.7	157.4	-57.9	174.5	0	0	0	105.9	L482	I480-L482 VanDerWaalsContact C-N 3.25Å; I480-L482 PolarHBondContact O-N 3.28Å
481	T	37.2	Very low	36	Very low	119 Å²	119	147.1 Å²	147.1	73%	0.73	75%	0.746	S	S	*	*			trans	-44.5	101.4	152.1	-58.7	0	0	0	0	105.9	K479 A483	K479-T481 PolarHBondContact O-N 2.83Å; T481-A483 PolarHBondContact O-N 2.9Å
482	L	36	Very low	35.7	Very low	130 Å²	130	145.2 Å²	145.2	68%	0.681	74%	0.74	S	S	*	*			trans	-62.2	83.4	165.7	-85.1	145.8	0	0	0	105.8	I480 P484	I480-L482 VanDerWaalsContact C-N 3.25Å; I480-L482 PolarHBondContact O-N 3.28Å; L482-P484 WeakPolarHBondContact O-CD 3.22Å
483	A	33.7	Very low	35.4	Very low	57 Å²	57	143.5 Å²	143.5	47%	0.471	74%	0.736	S	S	.	*			trans	-53.6	120.7	159.7	0	0	0	0	0	105.7	T481 N485	T481-A483 PolarHBondContact O-N 2.9Å; A483-N485 HydrophobicContact CB-CB 4.47Å; A483-N485 PolarHBondContact O-N 3.2Å
484	P	38.2	Very low	35.5	Very low	109 Å²	109	146.3 Å²	146.3	71%	0.708	74%	0.738	S	S	*	*			trans	-74	61.1	170.6	33.1	-32	0	0	0	108.1	L482 F486	L482-P484 WeakPolarHBondContact O-CD 3.22Å; P484-F486 VanDerWaalsContact C-N 3.27Å
485	N	35.4	Very low	35.2	Very low	126 Å²	126	145.6 Å²	145.6	67%	0.674	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	13.9	172	-83.1	33.4	0	0	0	111.6	A483	A483-N485 HydrophobicContact CB-CB 4.47Å; A483-N485 PolarHBondContact O-N 3.2Å
486	F	33.4	Very low	35.2	Very low	189 Å²	189	142.4 Å²	142.4	83%	0.829	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	16.2	167.2	-130.7	-93.6	0	0	0	112.9	P484 E488	P484-F486 VanDerWaalsContact C-N 3.27Å; F486-E488 VanDerWaalsContact C-N 3.34Å
487	M	32.4	Very low	35	Very low	140 Å²	140	140.1 Å²	140.1	69%	0.69	72%	0.722	S	S	*	*			trans	-105.2	38.7	161.2	-113.9	-172.3	178.6	0	0	110.1
488	E	31.6	Very low	35	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	72%	0.72	S	S	*	*			trans	-112.3	48.8	166.4	-156.7	168.8	-153.1	0	0	109.1	F486	F486-E488 VanDerWaalsContact C-N 3.34Å
489	T	33.3	Very low	34.9	Very low	101 Å²	101	137.4 Å²	137.4	62%	0.62	71%	0.712	S	S	*	*	S	Bend	trans	-120.3	98.8	164.1	55.5	0	0	0	0	108	R491	T489-R491 PolarHBondContact O-N 3.33Å
490	M	29.5	Very low	34.9	Very low	167 Å²	167	134.6 Å²	134.6	82%	0.823	71%	0.705	S	S	*	*			trans	57.6	53.3	149.1	-58.3	-71.3	-141	0	0	115.2	T492	M490-T492 PolarHBondContact O-N 2.57Å
491	R	33.1	Very low	35	Very low	217 Å²	217	133.6 Å²	133.6	82%	0.819	71%	0.708	S	S	*	*			trans	-67.5	90.3	140.6	-74	-171.5	-177.7	-174.8	2.2	106.1	T489 N493	T489-R491 PolarHBondContact O-N 3.33Å; R491-N493 PolarHBondContact O-N 3.38Å
492	T	37.4	Very low	35.2	Very low	103 Å²	103	132.3 Å²	132.3	63%	0.632	70%	0.704	S	S	*	*			trans	-62.2	74.8	159.8	55.2	0	0	0	0	107.2	M490 R494	M490-T492 PolarHBondContact O-N 2.57Å; T492-R494 PolarHBondContact O-N 2.92Å
493	N	34.2	Very low	35.2	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	71%	0.713	S	S	*	*			trans	-67	65.6	145.5	-90.1	5.4	0	0	0	106.1	R491 D495	R491-N493 PolarHBondContact O-N 3.38Å; N493-D495 PolarHBondContact O-N 2.83Å; N493-D495 VanDerWaalsContact O-N 3.1Å
494	R	37.2	Very low	35.2	Very low	209 Å²	209	138.1 Å²	138.1	79%	0.789	72%	0.722	S	S	*	*			trans	-73.6	81.3	139.7	-71.4	-175.2	178	177	0.2	102.9	T492 T496	T492-R494 PolarHBondContact O-N 2.92Å; R494-T496 HydrophobicContact CB-CG2 4.46Å; R494-T496 PolarHBondContact O-N 3.4Å
495	D	34.1	Very low	35.2	Very low	131 Å²	131	139.8 Å²	139.8	70%	0.701	73%	0.725	S	S	*	*			trans	-52.8	92.2	145	-76.3	-39.6	0	0	0	104	N493 S497	N493-D495 PolarHBondContact O-N 2.83Å; N493-D495 VanDerWaalsContact O-N 3.1Å; D495-S497 PolarHBondContact O-N 3.03Å
496	T	37.7	Very low	35.4	Very low	111 Å²	111	141.2 Å²	141.2	68%	0.681	73%	0.727	S	S	*	*			trans	-66.7	70.3	157.8	51.5	0	0	0	0	104.7	R494 L498	R494-T496 HydrophobicContact CB-CG2 4.46Å; R494-T496 PolarHBondContact O-N 3.4Å; T496-L498 PolarHBondContact O-N 3.33Å
497	S	34.6	Very low	35.5	Very low	92 Å²	92	139.4 Å²	139.4	64%	0.643	73%	0.726	S	S	*	*			trans	-62.2	89.6	153.7	-173.4	0	0	0	0	103.5	D495 V499	D495-S497 PolarHBondContact O-N 3.03Å; S497-V499 PolarHBondContact O-N 2.72Å
498	L	34.4	Very low	35.7	Very low	140 Å²	140	138.9 Å²	138.9	73%	0.733	73%	0.726	S	S	*	*			trans	-65.5	77.6	166.2	-129.9	101	0	0	0	104.4	T496 L500	T496-L498 PolarHBondContact O-N 3.33Å; L498-L500 HydrophobicContact CD2-CD1 4.21Å; L498-L500 PolarHBondContact O-N 2.73Å
499	V	36.6	Very low	35.8	Very low	113 Å²	113	137 Å²	137	69%	0.685	73%	0.727	S	S	*	*			trans	-65.9	96.3	164.2	179.1	0	0	0	0	103.5	S497 P501	S497-V499 PolarHBondContact O-N 2.72Å; V499-P501 WeakPolarHBondContact O-CD 3.33Å
500	L	36.2	Very low	35.9	Very low	132 Å²	132	138.1 Å²	138.1	69%	0.691	73%	0.729	S	S	*	*			trans	-47.9	124.5	165.4	-109.8	67.4	0	0	0	106.1	L498 S502	L498-L500 HydrophobicContact CD2-CD1 4.21Å; L498-L500 PolarHBondContact O-N 2.73Å; L500-S502 PolarHBondContact O-N 3.44Å
501	P	39.6	Very low	36.2	Very low	118 Å²	118	138.3 Å²	138.3	77%	0.766	73%	0.734	S	S	*	*			trans	-49.6	114.2	172.2	-27.4	35.2	0	0	0	108.4	V499 L503	V499-P501 WeakPolarHBondContact O-CD 3.33Å; P501-L503 PolarHBondContact O-N 3.19Å; P501-L503 VanDerWaalsContact O-N 3.17Å
502	S	41.7	Very low	36.3	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	73%	0.73	S	S	*	*			trans	-61.1	119.4	174.6	-170	0	0	0	0	106.6	L500 Q504	L500-S502 PolarHBondContact O-N 3.44Å; S502-Q504 PolarHBondContact O-N 3.49Å
503	L	34.3	Very low	36.5	Very low	167 Å²	167	138.4 Å²	138.4	87%	0.874	74%	0.74	S	S	*	*			trans	-67.8	79.7	165.1	-85.3	115.4	0	0	0	107.1	P501	P501-L503 PolarHBondContact O-N 3.19Å; P501-L503 VanDerWaalsContact O-N 3.17Å
504	Q	34.6	Very low	36.7	Very low	141 Å²	141	139.6 Å²	139.6	66%	0.659	75%	0.747	S	S	*	*			trans	-114	112.4	167.6	-151	146.5	-24.9	0	0	106	S502 E506	S502-Q504 PolarHBondContact O-N 3.49Å; Q504-E506 PolarHBondContact O-N 2.89Å
505	D	38.2	Very low	36.9	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	74%	0.744	S	S	*	*			trans	-61.3	83.3	175.9	-61.3	-48.3	0	0	0	108.1	D507	D505-D507 PolarHBondContact O-N 2.81Å
506	E	39.9	Very low	37.1	Very low	156 Å²	156	134.7 Å²	134.7	73%	0.729	75%	0.747	S	S	*	*			trans	-75.7	98.7	163.7	-69.8	-69.5	161.9	0	0	105.9	Q504 D508	Q504-E506 PolarHBondContact O-N 2.89Å; E506-D508 PolarHBondContact O-N 2.81Å
507	D	35.1	Very low	37.7	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	75%	0.749	S	S	*	*			trans	-59.2	71.5	169.4	-78.5	-43	0	0	0	110.1	D505 T509	D505-D507 PolarHBondContact O-N 2.81Å; D507-T509 PolarHBondContact O-N 3.17Å
508	D	37.6	Very low	38.2	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	75%	0.754	S	S	*	*			trans	-90.9	83.6	174.7	-125.8	-16.2	0	0	0	109.3	E506 N510	E506-D508 PolarHBondContact O-N 2.81Å; D508-N510 VanDerWaalsContact C-N 3.27Å; D508-N510 PolarHBondContact O-N 2.81Å; D508-N510 PolarHBondContact OD1-ND2 3.2Å
509	T	32.9	Very low	39.1	Very low	133 Å²	133	137.4 Å²	137.4	82%	0.816	76%	0.762	S	S	*	*			trans	-56	88.1	159	32.8	0	0	0	0	109.9	D507	D507-T509 PolarHBondContact O-N 3.17Å
510	N	36.2	Very low	40.6	Very low	125 Å²	125	141.7 Å²	141.7	67%	0.668	77%	0.766	S	S	*	*			trans	-132.9	98.6	163.1	-79.4	-55.3	0	0	0	109.7	D508 D512	D508-N510 VanDerWaalsContact C-N 3.27Å; D508-N510 PolarHBondContact O-N 2.81Å; D508-N510 PolarHBondContact OD1-ND2 3.2Å; N510-D512 PolarHBondContact O-N 3.41Å
511	D	34.4	Very low	42.3	Very low	171 Å²	171	140.9 Å²	140.9	91%	0.914	77%	0.768	S	S	*	*			trans	-61.3	89.3	168.4	-81.7	-42.1	0	0	0	110
512	D	36	Very low	44	Very low	139 Å²	139	138.9 Å²	138.9	74%	0.743	75%	0.751	S	S	*	*			trans	-125.3	101.6	163.8	-102.4	-31.1	0	0	0	110.8	N510 N514	N510-D512 PolarHBondContact O-N 3.41Å; D512-N514 PolarHBondContact O-N 3.32Å
513	E	41	Very low	46	Very low	182 Å²	182	137.5 Å²	137.5	85%	0.85	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	14.6	-170.5	-92.9	-93.3	151.6	0	0	116.3
514	N	39.5	Very low	48	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	17.5	-170.1	-73.5	-53.7	0	0	0	117	D512	D512-N514 PolarHBondContact O-N 3.32Å
515	T	39.9	Very low	50.3	Low	117 Å²	117	133.5 Å²	133.5	72%	0.718	73%	0.73	S	S	*	*	S	Bend	trans	-91.7	121.9	173.5	-40.7	0	0	0	0	110.9	T517	T515-T517 PolarHBondContact O-N 3.46Å
516	P	39	Very low	52.6	Low	119 Å²	119	131.9 Å²	131.9	77%	0.773	72%	0.718	S	S	*	*			trans	-64.2	112.9	-175.5	25.2	-31.9	0	0	0	109.7	S518	P516-S518 PolarHBondContact O-N 2.96Å; P516-S518 VanDerWaalsContact O-N 3.16Å
517	T	49.8	Very low	54.8	Low	116 Å²	116	128.6 Å²	128.6	71%	0.712	70%	0.704	S	S	*	*			trans	-55	120.2	-178.8	-38.4	0	0	0	0	109.4	T515 I519	T515-T517 PolarHBondContact O-N 3.46Å; T517-I519 PolarHBondContact O-N 2.74Å
518	S	45	Very low	57.2	Low	108 Å²	108	125.9 Å²	125.9	76%	0.755	69%	0.689	S	S	*	*			trans	-42.9	128.9	173.1	-178.9	0	0	0	0	110.2	P516 R520	P516-S518 PolarHBondContact O-N 2.96Å; P516-S518 VanDerWaalsContact O-N 3.16Å; S518-R520 PolarHBondContact O-N 3.09Å
519	I	53.4	Low	59.5	Low	176 Å²	176	121 Å²	121	90%	0.903	67%	0.669	S	S	*	*			trans	-69.3	73	-171.6	-55.1	162	0	0	0	108.7	T517	T517-I519 PolarHBondContact O-N 2.74Å
520	R	69.2	Low	62.1	Low	204 Å²	204	121.7 Å²	121.7	77%	0.77	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-99	135.3	164.7	-174	-179.4	175.5	-177.5	-1	107.9	S518 L522	S518-R520 PolarHBondContact O-N 3.09Å; R520-L522 PolarHBondContact O-N 2.76Å; R520-L522 VanDerWaalsContact O-N 3.15Å
521	P	70.2	Confident	64.6	Low	114 Å²	114	119.1 Å²	119.1	74%	0.74	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-55.4	122.6	171	21.1	-31.8	0	0	0	109.8
522	L	75.9	Confident	67.1	Low	77 Å²	77	114.3 Å²	114.3	40%	0.403	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-59.7	139.5	179.1	-87.5	72.1	0	0	0	110.3	R520 E526 I527	R520-L522 PolarHBondContact O-N 2.76Å; R520-L522 VanDerWaalsContact O-N 3.15Å; L522-E526 WeakPolarHBondContact CA-OE2 3.49Å; L522-E526 HydrophobicContact CB-CB 4.41Å; L522-E526 HydrophobicContact CD2-CB 4.29Å; L522-E526 HydrophobicContact CG-CB 4.4Å; L522-I527 HydrophobicContact CB-CD1 4.3Å; L522-I527 HydrophobicContact CB-CG1 3.83Å; L522-I527 HydrophobicContact CD2-CG1 4.29Å
523	S	82.8	Confident	69.4	Low	62 Å²	62	116.2 Å²	116.2	43%	0.434	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-65	148.9	169.5	171.3	0	0	0	0	110.6	A525 E526 I527	S523-A525 PolarHBondContact O-N 2.78Å; S523-A525 VanDerWaalsContact O-N 3.12Å; S523-A525 PolarHBondContact OG-N 3.33Å; S523-E526 PolarHBondContact N-OE2 3.42Å; S523-E526 WeakPolarHBondContact O-CB 3.24Å; S523-E526 PolarHBondContact O-N 3.49Å; S523-I527 PolarHBondContact O-N 3.47Å
524	Q	77.6	Confident	71.5	Confident	154 Å²	154	113.8 Å²	113.8	72%	0.72	61%	0.608	S	S	*	*	H	α-helix	trans	-53.5	-34.5	175.9	-175.9	175.2	-8.7	0	0	112.3	I528	Q524-I528 HydrophobicContact CG-CD1 4.1Å; Q524-I528 VanDerWaalsContact O-CG1 3.26Å; Q524-I528 WeakPolarHBondContact O-CG1 3.32Å; Q524-I528 PolarHBondContact O-N 3.11Å; Q524-I528 VanDerWaalsContact O-N 3.08Å
525	A	82.7	Confident	73.4	Confident	70 Å²	70	110.7 Å²	110.7	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-37.6	176.6	0	0	0	0	0	112.7	S523 I528 G529	S523-A525 PolarHBondContact O-N 2.78Å; S523-A525 VanDerWaalsContact O-N 3.12Å; S523-A525 PolarHBondContact OG-N 3.33Å; A525-I528 PolarHBondContact O-N 2.73Å; A525-G529 PolarHBondContact O-N 2.74Å
526	E	85.9	Confident	75.3	Confident	110 Å²	110	111.3 Å²	111.3	51%	0.514	59%	0.586	S	S	.	*	H	α-helix	trans	-70.6	-37.7	178.3	-64.8	170.1	157.5	0	0	111.4	L522 S523 G529 R530	L522-E526 WeakPolarHBondContact CA-OE2 3.49Å; L522-E526 HydrophobicContact CB-CB 4.41Å; L522-E526 HydrophobicContact CD2-CB 4.29Å; L522-E526 HydrophobicContact CG-CB 4.4Å; S523-E526 PolarHBondContact N-OE2 3.42Å; S523-E526 WeakPolarHBondContact O-CB 3.24Å; S523-E526 PolarHBondContact O-N 3.49Å; E526-G529 PolarHBondContact O-N 3.48Å; E526-R530 WeakPolarHBondContact O-CB 3.4Å; E526-R530 PolarHBondContact O-N 3.3Å
527	I	86.3	Confident	77.1	Confident	87 Å²	87	113 Å²	113	45%	0.446	58%	0.581	S	S	.	*	H	α-helix	trans	-62.4	-50.2	174.1	-63.1	172.7	0	0	0	109.8	L522 S523 G529 R530 V531	L522-I527 HydrophobicContact CB-CD1 4.3Å; L522-I527 HydrophobicContact CB-CG1 3.83Å; L522-I527 HydrophobicContact CD2-CG1 4.29Å; S523-I527 PolarHBondContact O-N 3.47Å; I527-G529 VanDerWaalsContact C-N 3.31Å; I527-G529 PolarHBondContact O-N 2.82Å; I527-R530 PolarHBondContact O-N 2.84Å; I527-V531 HydrophobicContact CG2-CG2 4.37Å; I527-V531 VanDerWaalsContact O-CG2 3.29Å; I527-V531 WeakPolarHBondContact O-CG2 3.24Å; I527-V531 PolarHBondContact O-N 3.28Å
528	I	85.9	Confident	78.4	Confident	95 Å²	95	112.5 Å²	112.5	49%	0.487	57%	0.573	S	S	.	*	H	α-helix	trans	-59.4	-44.9	178.4	-67.6	166.7	0	0	0	110.2	Q524 A525 R530 V531 T532	Q524-I528 HydrophobicContact CG-CD1 4.1Å; Q524-I528 VanDerWaalsContact O-CG1 3.26Å; Q524-I528 WeakPolarHBondContact O-CG1 3.32Å; Q524-I528 PolarHBondContact O-N 3.11Å; Q524-I528 VanDerWaalsContact O-N 3.08Å; A525-I528 PolarHBondContact O-N 2.73Å; I528-R530 PolarHBondContact O-N 2.72Å; I528-V531 PolarHBondContact O-N 2.95Å; I528-T532 HydrophobicContact CG2-CG2 4.37Å; I528-T532 WeakPolarHBondContact O-CG2 3.17Å; I528-T532 PolarHBondContact O-N 3.39Å; I528-T532 PolarHBondContact O-OG1 3.24Å
529	G	86.7	Confident	79.5	Confident	27 Å²	27	113.9 Å²	113.9	28%	0.278	57%	0.568	S	S	.	*	H	α-helix	trans	-62.4	-38.8	177.6	0	0	0	0	0	114.1	A525 E526 I527 T532 R533	A525-G529 PolarHBondContact O-N 2.74Å; E526-G529 PolarHBondContact O-N 3.48Å; I527-G529 VanDerWaalsContact C-N 3.31Å; I527-G529 PolarHBondContact O-N 2.82Å; G529-T532 WeakPolarHBondContact CA-OG1 3.47Å; G529-T532 PolarHBondContact O-OG1 3.2Å; G529-R533 WeakPolarHBondContact O-CG 3.01Å; G529-R533 PolarHBondContact O-N 3.43Å
530	R	87.2	Confident	80.1	Confident	147 Å²	147	110.6 Å²	110.6	56%	0.555	56%	0.556	S	S	*	*	H	α-helix	trans	-68.1	-43.4	174.6	-87.6	-174	171.3	-177.3	-1.3	111.9	E526 I527 I528 R533 Q534	E526-R530 WeakPolarHBondContact O-CB 3.4Å; E526-R530 PolarHBondContact O-N 3.3Å; I527-R530 PolarHBondContact O-N 2.84Å; I528-R530 PolarHBondContact O-N 2.72Å; R530-R533 PolarHBondContact O-N 2.79Å; R530-Q534 WeakPolarHBondContact O-CG 3.19Å; R530-Q534 PolarHBondContact O-N 2.78Å
531	V	87.8	Confident	79.6	Confident	71 Å²	71	109.6 Å²	109.6	43%	0.43	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-43.1	179.8	171.8	0	0	0	0	111	I527 I528 Q534 L535	I527-V531 HydrophobicContact CG2-CG2 4.37Å; I527-V531 VanDerWaalsContact O-CG2 3.29Å; I527-V531 WeakPolarHBondContact O-CG2 3.24Å; I527-V531 PolarHBondContact O-N 3.28Å; I528-V531 PolarHBondContact O-N 2.95Å; V531-Q534 PolarHBondContact O-N 3.12Å; V531-L535 HydrophobicContact CG1-CD1 4Å; V531-L535 WeakPolarHBondContact O-CG 3.35Å; V531-L535 PolarHBondContact O-N 3.43Å
532	T	86.8	Confident	78.6	Confident	69 Å²	69	111.4 Å²	111.4	42%	0.423	56%	0.555	S	S	.	*	H	α-helix	trans	-65.4	-41.2	177.7	49.8	0	0	0	0	112.5	I528 G529 Q534 L535 Q536	I528-T532 HydrophobicContact CG2-CG2 4.37Å; I528-T532 WeakPolarHBondContact O-CG2 3.17Å; I528-T532 PolarHBondContact O-N 3.39Å; I528-T532 PolarHBondContact O-OG1 3.24Å; G529-T532 WeakPolarHBondContact CA-OG1 3.47Å; G529-T532 PolarHBondContact O-OG1 3.2Å; T532-Q534 PolarHBondContact O-N 3.48Å; T532-L535 PolarHBondContact O-N 3.48Å; T532-Q536 PolarHBondContact O-N 3.03Å
533	R	84.7	Confident	77.1	Confident	180 Å²	180	115.8 Å²	115.8	68%	0.679	57%	0.573	S	S	*	*	H	α-helix	trans	-63.1	-39.8	174	-75.2	-179.8	-169.5	176	4.3	112.5	G529 R530 K537	G529-R533 WeakPolarHBondContact O-CG 3.01Å; G529-R533 PolarHBondContact O-N 3.43Å; R530-R533 PolarHBondContact O-N 2.79Å; R533-K537 WeakPolarHBondContact O-CG 3.3Å; R533-K537 PolarHBondContact O-N 3.35Å; R533-K537 VanDerWaalsContact O-N 3.07Å
534	Q	84.7	Confident	75.3	Confident	130 Å²	130	116.8 Å²	116.8	61%	0.607	58%	0.578	S	S	*	*	H	α-helix	trans	-66.1	-40.3	176.3	-78.1	-176.3	-4.6	0	0	111.8	R530 V531 T532 K537 L538	R530-Q534 WeakPolarHBondContact O-CG 3.19Å; R530-Q534 PolarHBondContact O-N 2.78Å; V531-Q534 PolarHBondContact O-N 3.12Å; T532-Q534 PolarHBondContact O-N 3.48Å; Q534-K537 PolarHBondContact O-N 3.2Å; Q534-L538 WeakPolarHBondContact O-CG 3.21Å; Q534-L538 PolarHBondContact O-N 3.49Å
535	L	80	Confident	73.5	Confident	92 Å²	92	115 Å²	115	48%	0.482	58%	0.583	S	S	.	*	H	α-helix	trans	-63.2	-45.3	175	-78.4	166.1	0	0	0	112	V531 T532 K537 L538 E539	V531-L535 HydrophobicContact CG1-CD1 4Å; V531-L535 WeakPolarHBondContact O-CG 3.35Å; V531-L535 PolarHBondContact O-N 3.43Å; T532-L535 PolarHBondContact O-N 3.48Å; L535-K537 VanDerWaalsContact C-N 3.33Å; L535-K537 PolarHBondContact O-N 2.66Å; L535-L538 WeakPolarHBondContact O-CB 3.28Å; L535-L538 PolarHBondContact O-N 3.42Å; L535-L538 VanDerWaalsContact O-N 3.09Å; L535-E539 WeakPolarHBondContact O-CG 3.45Å; L535-E539 PolarHBondContact O-N 2.71Å
536	Q	79	Confident	71.4	Confident	130 Å²	130	119.1 Å²	119.1	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-61.2	-38.8	175.4	-85.7	-178.3	-27.7	0	0	112.9	T532 L538 E539 T540	T532-Q536 PolarHBondContact O-N 3.03Å; Q536-L538 VanDerWaalsContact C-N 3.3Å; Q536-L538 PolarHBondContact O-N 3.29Å; Q536-E539 PolarHBondContact O-N 2.95Å; Q536-T540 WeakPolarHBondContact O-CG2 3.35Å; Q536-T540 PolarHBondContact O-N 3.15Å; Q536-T540 PolarHBondContact O-OG1 3.02Å
537	K	77.5	Confident	69.1	Low	154 Å²	154	120.7 Å²	120.7	67%	0.67	60%	0.604	S	S	*	*	H	α-helix	trans	-65.8	-32.8	174.7	-77.4	-174.8	178.3	-175.9	0	112.5	R533 Q534 L535 T540 K541	R533-K537 WeakPolarHBondContact O-CG 3.3Å; R533-K537 PolarHBondContact O-N 3.35Å; R533-K537 VanDerWaalsContact O-N 3.07Å; Q534-K537 PolarHBondContact O-N 3.2Å; L535-K537 VanDerWaalsContact C-N 3.33Å; L535-K537 PolarHBondContact O-N 2.66Å; K537-T540 WeakPolarHBondContact CA-OG1 3.3Å; K537-T540 PolarHBondContact O-OG1 3.15Å; K537-T540 VanDerWaalsContact O-OG1 3.1Å; K537-K541 PolarHBondContact O-N 2.74Å
538	L	76.2	Confident	67	Low	106 Å²	106	121.9 Å²	121.9	56%	0.555	62%	0.616	S	S	*	*	H	α-helix	trans	-72.2	-43.5	174.5	-77	167	0	0	0	111.6	Q534 L535 Q536 T540 K541 H542	Q534-L538 WeakPolarHBondContact O-CG 3.21Å; Q534-L538 PolarHBondContact O-N 3.49Å; L535-L538 WeakPolarHBondContact O-CB 3.28Å; L535-L538 PolarHBondContact O-N 3.42Å; L535-L538 VanDerWaalsContact O-N 3.09Å; Q536-L538 VanDerWaalsContact C-N 3.3Å; Q536-L538 PolarHBondContact O-N 3.29Å; L538-T540 PolarHBondContact O-N 2.69Å; L538-K541 PolarHBondContact O-N 2.86Å; L538-H542 WeakPolarHBondContact O-CB 3.31Å; L538-H542 PolarHBondContact O-N 2.8Å; L538-H542 VanDerWaalsContact O-N 3.15Å
539	E	69.9	Low	64.7	Low	137 Å²	137	124.3 Å²	124.3	64%	0.64	63%	0.63	S	S	*	*	H	α-helix	trans	-62.8	-41.2	178.8	-74.2	-178.6	169.9	0	0	112.3	L535 Q536 K541 H542	L535-E539 WeakPolarHBondContact O-CG 3.45Å; L535-E539 PolarHBondContact O-N 2.71Å; Q536-E539 PolarHBondContact O-N 2.95Å; E539-K541 PolarHBondContact O-N 3.18Å; E539-H542 PolarHBondContact O-N 2.62Å; E539-H542 VanDerWaalsContact O-N 3.16Å
540	T	65	Low	62.3	Low	106 Å²	106	131 Å²	131	65%	0.65	65%	0.651	S	S	*	*	H	α-helix	trans	-67.3	-33.7	177.4	45.8	0	0	0	0	113.4	Q536 K537 L538 H542	Q536-T540 WeakPolarHBondContact O-CG2 3.35Å; Q536-T540 PolarHBondContact O-N 3.15Å; Q536-T540 PolarHBondContact O-OG1 3.02Å; K537-T540 WeakPolarHBondContact CA-OG1 3.3Å; K537-T540 PolarHBondContact O-OG1 3.15Å; K537-T540 VanDerWaalsContact O-OG1 3.1Å; L538-T540 PolarHBondContact O-N 2.69Å; T540-H542 VanDerWaalsContact C-N 3.28Å; T540-H542 PolarHBondContact O-N 3Å
541	K	59.1	Low	59.9	Low	184 Å²	184	130.9 Å²	130.9	80%	0.8	67%	0.667	S	S	*	*	H	α-helix	trans	-72.7	-22.3	173	-79.5	-174.1	176.4	-176.3	0	113.1	K537 L538 E539	K537-K541 PolarHBondContact O-N 2.74Å; L538-K541 PolarHBondContact O-N 2.86Å; E539-K541 PolarHBondContact O-N 3.18Å
542	H	48.6	Very low	57.7	Low	152 Å²	152	136.6 Å²	136.6	70%	0.704	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	15.1	-173.5	-118.9	-67.8	0	0	0	114.8	L538 E539 T540 P544	L538-H542 WeakPolarHBondContact O-CB 3.31Å; L538-H542 PolarHBondContact O-N 2.8Å; L538-H542 VanDerWaalsContact O-N 3.15Å; E539-H542 PolarHBondContact O-N 2.62Å; E539-H542 VanDerWaalsContact O-N 3.16Å; T540-H542 VanDerWaalsContact C-N 3.28Å; T540-H542 PolarHBondContact O-N 3Å; H542-P544 WeakPolarHBondContact O-CD 3.17Å
543	H	45.3	Very low	55.4	Low	168 Å²	168	138.4 Å²	138.4	78%	0.778	70%	0.698	S	S	*	*			trans	-78.9	102.6	172.7	-133.5	-68	0	0	0	110
544	P	45.4	Very low	53.2	Low	83 Å²	83	141.9 Å²	141.9	54%	0.539	71%	0.711	S	S	.	*			trans	-81	129.8	-179.9	2.1	20	0	0	0	107.1	H542 M546	H542-P544 WeakPolarHBondContact O-CD 3.17Å; P544-M546 PolarHBondContact O-N 3.39Å
545	S	38.8	Very low	51.1	Low	118 Å²	118	142.2 Å²	142.2	83%	0.825	72%	0.721	S	S	*	*			trans	-62.9	105.2	171	64.9	0	0	0	0	108.7	N547	S545-N547 VanDerWaalsContact C-N 3.27Å; S545-N547 PolarHBondContact O-N 2.96Å
546	M	39.5	Very low	49.1	Very low	155 Å²	155	143.2 Å²	143.2	76%	0.764	74%	0.736	S	S	*	*			trans	-69.7	84.8	174.5	-74.2	-74.8	-179.5	0	0	108.7	P544 T548	P544-M546 PolarHBondContact O-N 3.39Å; M546-T548 PolarHBondContact O-N 3.47Å; M546-T548 HydrophobicContact SD-CG2 4.37Å
547	N	35.8	Very low	47.2	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	74%	0.744	S	S	*	*			trans	-95.8	75	166.8	-162.5	4.3	0	0	0	108.9	S545	S545-N547 VanDerWaalsContact C-N 3.27Å; S545-N547 PolarHBondContact O-N 2.96Å
548	T	43.9	Very low	45.6	Very low	113 Å²	113	140.8 Å²	140.8	69%	0.693	75%	0.75	S	S	*	*			trans	-100.2	75.7	178.6	56.7	0	0	0	0	110.6	M546	M546-T548 PolarHBondContact O-N 3.47Å; M546-T548 HydrophobicContact SD-CG2 4.37Å
549	N	36.3	Very low	44.1	Very low	146 Å²	146	143.4 Å²	143.4	78%	0.781	77%	0.765	S	S	*	*			trans	-111.9	80.5	161.6	-92.6	-15.7	0	0	0	108.9
550	K	36.8	Very low	42.7	Very low	167 Å²	167	148.4 Å²	148.4	73%	0.726	78%	0.778	S	S	*	*			trans	-133.6	97.9	162.5	-90.1	-174.8	177.7	175.1	0	109.6	Y552	K550-Y552 HydrophobicContact CB-CD2 4.29Å; K550-Y552 HydrophobicContact CB-CE2 3.87Å; K550-Y552 HydrophobicContact CD-CE2 4.31Å; K550-Y552 PolarHBondContact O-N 2.99Å
551	T	37.4	Very low	41.8	Very low	144 Å²	144	154.5 Å²	154.5	88%	0.883	79%	0.789	S	S	*	*			trans	-63	103.3	167.9	36.3	0	0	0	0	109.7
552	Y	40.5	Very low	41.1	Very low	191 Å²	191	153.3 Å²	153.3	75%	0.749	79%	0.79	S	S	*	*			trans	-96.3	113	166.8	-76.8	-81.3	0	0	0	109.6	K550	K550-Y552 HydrophobicContact CB-CD2 4.29Å; K550-Y552 HydrophobicContact CB-CE2 3.87Å; K550-Y552 HydrophobicContact CD-CE2 4.31Å; K550-Y552 PolarHBondContact O-N 2.99Å
553	S	39	Very low	40.9	Very low	108 Å²	108	155.6 Å²	155.6	76%	0.755	80%	0.798	S	S	*	*			trans	-59.8	124	173	24.9	0	0	0	0	111	V555	S553-V555 PolarHBondContact O-N 2.72Å
554	R	38.5	Very low	41	Very low	252 Å²	252	155.6 Å²	155.6	95%	0.951	80%	0.802	S	S	*	*			trans	-65.6	115.2	173.1	-78.3	178.3	179.2	169.3	-0.1	109.9
555	V	40.5	Very low	41	Very low	137 Å²	137	162.7 Å²	162.7	83%	0.83	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.4	120.8	167.5	-178.9	0	0	0	0	108.5	S553 S557	S553-V555 PolarHBondContact O-N 2.72Å; V555-S557 PolarHBondContact O-N 3.01Å
556	S	38.2	Very low	41	Very low	114 Å²	114	169.3 Å²	169.3	80%	0.797	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-72.7	117	176.5	-170.8	0	0	0	0	110.1
557	S	39.8	Very low	41.1	Very low	111 Å²	111	170 Å²	170	78%	0.776	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-86.7	131.5	172.5	-102	0	0	0	0	110.7	V555 N559	V555-S557 PolarHBondContact O-N 3.01Å; S557-N559 PolarHBondContact O-N 3.34Å
558	P	44.1	Very low	41.4	Very low	121 Å²	121	171.4 Å²	171.4	79%	0.786	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-82	121	-177	18.9	-9	0	0	0	111.9	R560	P558-R560 PolarHBondContact O-N 2.85Å; P558-R560 VanDerWaalsContact O-N 3.11Å
559	N	42.9	Very low	41.2	Very low	162 Å²	162	174.7 Å²	174.7	87%	0.866	86%	0.855	S	S	*	*			trans	-60.8	104.7	170.8	-105.6	-29.5	0	0	0	111.1	S557 R561	S557-N559 PolarHBondContact O-N 3.34Å; N559-R561 PolarHBondContact O-N 3.42Å
560	R	41.4	Very low	41.5	Very low	241 Å²	241	176.4 Å²	176.4	91%	0.909	86%	0.86	S	S	*	*			trans	-70.7	89.4	163.5	-102.8	-177.4	-172.4	-168.8	3.6	109.1	P558	P558-R560 PolarHBondContact O-N 2.85Å; P558-R560 VanDerWaalsContact O-N 3.11Å
561	R	45.3	Very low	41.8	Very low	234 Å²	234	176.9 Å²	176.9	88%	0.883	87%	0.868	S	S	*	*			trans	-90	104.5	165.9	-122.8	178.9	178.9	-173.5	-1	108.4	N559 K563	N559-R561 PolarHBondContact O-N 3.42Å; R561-K563 PolarHBondContact O-N 3.4Å
562	L	44.6	Very low	42.1	Very low	160 Å²	160	179.1 Å²	179.1	84%	0.838	87%	0.867	S	S	*	*			trans	-62.6	112.6	168.3	-84.2	121.8	0	0	0	109	I564	L562-I564 PolarHBondContact O-N 3.34Å
563	K	45.1	Very low	42.2	Very low	200 Å²	200	178.3 Å²	178.3	87%	0.87	88%	0.876	S	S	*	*			trans	-76.5	103.6	166.7	-83.1	177.9	174.1	174.1	0	108	R561	R561-K563 PolarHBondContact O-N 3.4Å
564	I	47.7	Very low	42.5	Very low	167 Å²	167	183.7 Å²	183.7	86%	0.856	89%	0.885	S	S	*	*			trans	-88.9	102.4	156.4	-61.7	170.1	0	0	0	104.6	L562	L562-I564 PolarHBondContact O-N 3.34Å
565	R	43.9	Very low	42.8	Very low	233 Å²	233	178 Å²	178	88%	0.879	88%	0.879	S	S	*	*			trans	-111.9	125.5	169.8	-160.2	176.9	-171.6	177.3	1.4	105.8
566	M	40.5	Very low	43	Very low	256 Å²	256	181.7 Å²	181.7	100%	1.261	88%	0.884	S	S	*	*			trans	-39.5	0	165.8	-74.3	-84	-158.2	0	0	112.3

Retrieved 566 of 566 residues in 1388 ms (Link to these results)

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