A0A096LNU0_HUMAN Loading...

MCC regulator of WNT signaling pathway

AlphaFold DB , UniProt , Accession A0A096LNU0, Species HUMAN (Homo sapiens, Human), Gene MCC, Length 715 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.3	Very low	47.5	Very low	238 Å²	238	146.5 Å²	146.5	100%	1.172	83%	0.831	S	S	*	*				0	141.8	0	-71.7	154.7	73.3	0	0	108
2	N	41.2	Very low	48.2	Very low	159 Å²	159	143.2 Å²	143.2	85%	0.85	81%	0.809	S	S	*	*			trans	24.4	132.3	163.1	-61.4	11.2	0	0	0	122.7
3	S	45.4	Very low	49.2	Very low	136 Å²	136	137 Å²	137	95%	0.951	78%	0.781	S	S	*	*			trans	74	138.3	140.4	-152.9	0	0	0	0	119.4
4	G	39.6	Very low	50	Low	69 Å²	69	132.8 Å²	132.8	71%	0.711	76%	0.764	S	S	*	*			trans	161.5	1.4	-179.6	0	0	0	0	0	116.8	A6	G4-A6 PolarHBondContact O-N 3.03Å
5	V	51.5	Low	51.2	Low	155 Å²	155	127.8 Å²	127.8	94%	0.939	75%	0.745	S	S	*	*			trans	-76.2	95.2	174.4	-178.7	0	0	0	0	109.4
6	A	46	Very low	52.4	Low	89 Å²	89	127.6 Å²	127.6	74%	0.736	74%	0.735	S	S	*	*			trans	-105.1	131.7	171.2	0	0	0	0	0	109.8	G4	G4-A6 PolarHBondContact O-N 3.03Å
7	M	53	Low	53.7	Low	182 Å²	182	125.8 Å²	125.8	90%	0.897	72%	0.721	S	S	*	*			trans	-65.9	136.8	-175.4	-61.2	-176.4	-172.4	0	0	112.1
8	K	51.5	Low	55	Low	188 Å²	188	122.7 Å²	122.7	82%	0.817	71%	0.708	S	S	*	*			trans	-135.7	35.6	166	-149.9	-174	178.4	-171.4	0	113.1
9	Y	49.8	Very low	56.4	Low	218 Å²	218	123.8 Å²	123.8	86%	0.855	71%	0.707	S	S	*	*	S	Bend	trans	-128.4	5.4	-179.2	-76.9	-74.2	0	0	0	113.9	S13	Y9-S13 PolarHBondContact O-OG 3.09Å
10	G	53.2	Low	57.7	Low	53 Å²	53	123.8 Å²	123.8	55%	0.546	70%	0.703	S	S	.	*	S	Bend	trans	-106.8	0.6	-174	0	0	0	0	0	115.9
11	N	52.9	Low	59.1	Low	125 Å²	125	123.4 Å²	123.4	67%	0.668	70%	0.696	S	S	*	*	S	Bend	trans	-105.5	-44.6	-173.3	-153.7	72.1	0	0	0	112.1	S14 A15	N11-S14 WeakPolarHBondContact O-CB 3.49Å; N11-S14 PolarHBondContact O-N 2.85Å; N11-S14 VanDerWaalsContact O-N 3.16Å; N11-A15 PolarHBondContact O-N 3.36Å; N11-A15 VanDerWaalsContact O-N 3.11Å
12	D	55.9	Low	61.5	Low	106 Å²	106	115.3 Å²	115.3	57%	0.567	66%	0.663	S	S	*	*	H	α-helix	trans	-68.7	-41.2	-177.1	-48.6	-37.5	0	0	0	111.1	S14 A15 E16	D12-S14 PolarHBondContact O-N 3.22Å; D12-A15 WeakPolarHBondContact O-CB 3.31Å; D12-A15 PolarHBondContact O-N 3.41Å; D12-E16 WeakPolarHBondContact O-CG 3.33Å; D12-E16 PolarHBondContact O-N 2.9Å
13	S	60.8	Low	63.7	Low	63 Å²	63	110.6 Å²	110.6	44%	0.441	65%	0.646	S	S	.	*	H	α-helix	trans	-63.2	-22.1	172.3	49.2	0	0	0	0	114.3	Y9 L17	Y9-S13 PolarHBondContact O-OG 3.09Å; S13-L17 VanDerWaalsContact O-CB 3.32Å; S13-L17 WeakPolarHBondContact O-CB 3.3Å; S13-L17 PolarHBondContact O-N 2.91Å
14	S	61.3	Low	65.8	Low	78 Å²	78	106.5 Å²	106.5	55%	0.545	62%	0.62	S	S	.	*	H	α-helix	trans	-80.4	-37.4	172.1	-168.9	0	0	0	0	111.3	N11 D12 S18	N11-S14 WeakPolarHBondContact O-CB 3.49Å; N11-S14 PolarHBondContact O-N 2.85Å; N11-S14 VanDerWaalsContact O-N 3.16Å; D12-S14 PolarHBondContact O-N 3.22Å; S14-S18 WeakPolarHBondContact O-CB 3.45Å; S14-S18 PolarHBondContact O-N 3.36Å; S14-S18 VanDerWaalsContact O-N 3.09Å
15	A	67.2	Low	68.3	Low	58 Å²	58	108 Å²	108	48%	0.479	61%	0.611	S	S	.	*	H	α-helix	trans	-67.3	-49.7	175.4	0	0	0	0	0	111.9	N11 D12 L17 S18 E19	N11-A15 PolarHBondContact O-N 3.36Å; N11-A15 VanDerWaalsContact O-N 3.11Å; D12-A15 WeakPolarHBondContact O-CB 3.31Å; D12-A15 PolarHBondContact O-N 3.41Å; A15-L17 VanDerWaalsContact C-N 3.3Å; A15-L17 PolarHBondContact O-N 2.71Å; A15-S18 WeakPolarHBondContact O-CB 3.47Å; A15-S18 PolarHBondContact O-N 3.06Å; A15-S18 VanDerWaalsContact O-N 3.16Å; A15-E19 PolarHBondContact O-N 3.4Å
16	E	70.4	Confident	70.1	Confident	125 Å²	125	103.6 Å²	103.6	58%	0.584	59%	0.591	S	S	*	*	H	α-helix	trans	-57.1	-41.7	177.6	-70.6	175.7	163.2	0	0	112.1	D12 E19 L20	D12-E16 WeakPolarHBondContact O-CG 3.33Å; D12-E16 PolarHBondContact O-N 2.9Å; E16-E19 PolarHBondContact O-N 3.47Å; E16-L20 WeakPolarHBondContact O-CB 3.32Å; E16-L20 WeakPolarHBondContact O-CG 3.41Å; E16-L20 PolarHBondContact O-N 2.75Å
17	L	74.9	Confident	72.3	Confident	96 Å²	96	102.6 Å²	102.6	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-71.4	-34.8	179.6	-165.3	150.2	0	0	0	112	S13 A15 H21	S13-L17 VanDerWaalsContact O-CB 3.32Å; S13-L17 WeakPolarHBondContact O-CB 3.3Å; S13-L17 PolarHBondContact O-N 2.91Å; A15-L17 VanDerWaalsContact C-N 3.3Å; A15-L17 PolarHBondContact O-N 2.71Å; L17-H21 WeakPolarHBondContact CD2-CE1 3.38Å; L17-H21 WeakPolarHBondContact O-CB 3.38Å; L17-H21 PolarHBondContact O-N 2.92Å
18	S	77.2	Confident	74.3	Confident	70 Å²	70	98.6 Å²	98.6	49%	0.49	56%	0.56	S	S	.	*	H	α-helix	trans	-66.4	-38.4	171.2	-170.2	0	0	0	0	112.4	S14 A15 S22	S14-S18 WeakPolarHBondContact O-CB 3.45Å; S14-S18 PolarHBondContact O-N 3.36Å; S14-S18 VanDerWaalsContact O-N 3.09Å; A15-S18 WeakPolarHBondContact O-CB 3.47Å; A15-S18 PolarHBondContact O-N 3.06Å; A15-S18 VanDerWaalsContact O-N 3.16Å; S18-S22 WeakPolarHBondContact O-CB 3.33Å; S18-S22 PolarHBondContact O-N 2.95Å; S18-S22 PolarHBondContact O-OG 2.96Å
19	E	81.9	Confident	76.3	Confident	144 Å²	144	96.4 Å²	96.4	67%	0.673	55%	0.551	S	S	*	*	H	α-helix	trans	-69.5	-43.2	176.6	-171.5	164.6	-160.3	0	0	111.6	A15 E16 S22 A23	A15-E19 PolarHBondContact O-N 3.4Å; E16-E19 PolarHBondContact O-N 3.47Å; E19-S22 WeakPolarHBondContact O-CB 3.25Å; E19-S22 PolarHBondContact O-N 3.43Å; E19-S22 VanDerWaalsContact O-N 3.14Å; E19-A23 WeakPolarHBondContact O-CB 3.33Å; E19-A23 PolarHBondContact O-N 3.22Å
20	L	82.8	Confident	78.4	Confident	123 Å²	123	88 Å²	88	64%	0.644	53%	0.53	S	S	*	.	H	α-helix	trans	-60.4	-44.3	172.4	-78	167.2	0	0	0	112.6	E16 S22 A23 A24	E16-L20 WeakPolarHBondContact O-CB 3.32Å; E16-L20 WeakPolarHBondContact O-CG 3.41Å; E16-L20 PolarHBondContact O-N 2.75Å; L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 3.12Å; L20-A23 PolarHBondContact O-N 3.04Å; L20-A24 WeakPolarHBondContact O-CB 3.4Å; L20-A24 PolarHBondContact O-N 3.33Å
21	H	85.6	Confident	80.4	Confident	116 Å²	116	89.5 Å²	89.5	54%	0.537	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-39	172.8	-76.3	176.2	0	0	0	112.1	L17 A24 L25	L17-H21 WeakPolarHBondContact CD2-CE1 3.38Å; L17-H21 WeakPolarHBondContact O-CB 3.38Å; L17-H21 PolarHBondContact O-N 2.92Å; H21-A24 PolarHBondContact O-N 2.76Å; H21-L25 WeakPolarHBondContact O-CB 3.38Å; H21-L25 VanDerWaalsContact O-CG 3.27Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 3.03Å
22	S	89	Confident	82.4	Confident	69 Å²	69	88.8 Å²	88.8	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-40.3	177.1	-60.7	0	0	0	0	112.1	S18 E19 L20 L25 A26	S18-S22 WeakPolarHBondContact O-CB 3.33Å; S18-S22 PolarHBondContact O-N 2.95Å; S18-S22 PolarHBondContact O-OG 2.96Å; E19-S22 WeakPolarHBondContact O-CB 3.25Å; E19-S22 PolarHBondContact O-N 3.43Å; E19-S22 VanDerWaalsContact O-N 3.14Å; L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 3.12Å; S22-L25 PolarHBondContact O-N 3.03Å; S22-A26 WeakPolarHBondContact O-CB 3.39Å; S22-A26 PolarHBondContact O-N 3.29Å
23	A	88.4	Confident	84.3	Confident	60 Å²	60	88.6 Å²	88.6	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-42.7	174.6	0	0	0	0	0	112.2	E19 L20 A26 S27	E19-A23 WeakPolarHBondContact O-CB 3.33Å; E19-A23 PolarHBondContact O-N 3.22Å; L20-A23 PolarHBondContact O-N 3.04Å; A23-A26 WeakPolarHBondContact O-CB 3.45Å; A23-A26 PolarHBondContact O-N 3.36Å; A23-A26 VanDerWaalsContact O-N 3.16Å; A23-S27 PolarHBondContact O-N 3.39Å
24	A	89.3	Confident	85.9	Confident	49 Å²	49	91 Å²	91	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-62	-43.3	174.7	0	0	0	0	0	112	L20 H21 A26 S27 L28	L20-A24 WeakPolarHBondContact O-CB 3.4Å; L20-A24 PolarHBondContact O-N 3.33Å; H21-A24 PolarHBondContact O-N 2.76Å; A24-A26 VanDerWaalsContact C-N 3.29Å; A24-A26 PolarHBondContact O-N 2.94Å; A24-S27 PolarHBondContact O-N 2.71Å; A24-L28 WeakPolarHBondContact O-CG 3.47Å; A24-L28 PolarHBondContact O-N 3.25Å
25	L	90.9	Very high	87.5	Confident	102 Å²	102	93.1 Å²	93.1	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-66.4	-27.9	174	-72.3	170.5	0	0	0	113.1	H21 S22 K29	H21-L25 WeakPolarHBondContact O-CB 3.38Å; H21-L25 VanDerWaalsContact O-CG 3.27Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 3.03Å; S22-L25 PolarHBondContact O-N 3.03Å; L25-K29 WeakPolarHBondContact O-CB 3.2Å; L25-K29 WeakPolarHBondContact O-CD 3.27Å; L25-K29 WeakPolarHBondContact O-CG 3.47Å; L25-K29 PolarHBondContact O-N 3.15Å
26	A	90.1	Very high	88.7	Confident	61 Å²	61	94.2 Å²	94.2	50%	0.504	53%	0.53	S	S	.	.	H	α-helix	trans	-73.6	-43.1	172.6	0	0	0	0	0	111.7	S22 A23 A24 K29 G30	S22-A26 WeakPolarHBondContact O-CB 3.39Å; S22-A26 PolarHBondContact O-N 3.29Å; A23-A26 WeakPolarHBondContact O-CB 3.45Å; A23-A26 PolarHBondContact O-N 3.36Å; A23-A26 VanDerWaalsContact O-N 3.16Å; A24-A26 VanDerWaalsContact C-N 3.29Å; A24-A26 PolarHBondContact O-N 2.94Å; A26-K29 PolarHBondContact O-N 2.64Å; A26-G30 PolarHBondContact O-N 3.45Å
27	S	93	Very high	89.9	Confident	68 Å²	68	95.5 Å²	95.5	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-57.8	-54.7	173.8	-167.3	0	0	0	0	110.8	A23 A24 K29 G30 D31	A23-S27 PolarHBondContact O-N 3.39Å; A24-S27 PolarHBondContact O-N 2.71Å; S27-K29 PolarHBondContact O-N 3.41Å; S27-K29 VanDerWaalsContact O-N 3.14Å; S27-G30 CarbonylContact O-C 3.59Å; S27-G30 VanDerWaalsContact O-CA 3.3Å; S27-G30 WeakPolarHBondContact O-CA 3.49Å; S27-G30 PolarHBondContact O-N 2.68Å; S27-D31 VanDerWaalsContact C-OD2 3.28Å; S27-D31 PolarHBondContact O-N 3.31Å; S27-D31 VanDerWaalsContact O-OD2 3.06Å; S27-D31 PolarHBondContact OG-OD2 3.19Å
28	L	93.7	Very high	90.9	Very high	98 Å²	98	97.9 Å²	97.9	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-57.9	-33.3	-179.6	-70.9	169.4	0	0	0	112.8	A24 D31 I32	A24-L28 WeakPolarHBondContact O-CG 3.47Å; A24-L28 PolarHBondContact O-N 3.25Å; L28-D31 WeakPolarHBondContact CA-OD2 3.16Å; L28-I32 WeakPolarHBondContact O-CB 3.1Å; L28-I32 WeakPolarHBondContact O-CD1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.49Å; L28-I32 PolarHBondContact O-N 3.29Å
29	K	93.7	Very high	91.6	Very high	143 Å²	143	99.2 Å²	99.2	62%	0.622	54%	0.537	S	S	*	.	H	α-helix	trans	-69.4	-38.3	172.3	-76.8	170.9	-176.1	176.1	0	112.5	L25 A26 S27 V33	L25-K29 WeakPolarHBondContact O-CB 3.2Å; L25-K29 WeakPolarHBondContact O-CD 3.27Å; L25-K29 WeakPolarHBondContact O-CG 3.47Å; L25-K29 PolarHBondContact O-N 3.15Å; A26-K29 PolarHBondContact O-N 2.64Å; S27-K29 PolarHBondContact O-N 3.41Å; S27-K29 VanDerWaalsContact O-N 3.14Å; K29-V33 VanDerWaalsContact O-CG2 3.3Å; K29-V33 WeakPolarHBondContact O-CG2 3.4Å; K29-V33 PolarHBondContact O-N 3.48Å; K29-V33 VanDerWaalsContact O-N 3.11Å
30	G	94.6	Very high	92.2	Very high	41 Å²	41	95.9 Å²	95.9	42%	0.423	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-49.8	171.3	0	0	0	0	0	111.7	A26 S27 I32 V33 E34	A26-G30 PolarHBondContact O-N 3.45Å; S27-G30 CarbonylContact O-C 3.59Å; S27-G30 VanDerWaalsContact O-CA 3.3Å; S27-G30 WeakPolarHBondContact O-CA 3.49Å; S27-G30 PolarHBondContact O-N 2.68Å; G30-I32 PolarHBondContact O-N 3.38Å; G30-V33 PolarHBondContact O-N 3.29Å; G30-E34 PolarHBondContact O-N 3.18Å
31	D	95.1	Very high	92.8	Very high	84 Å²	84	94.8 Å²	94.8	45%	0.449	51%	0.513	S	S	.	.	H	α-helix	trans	-57.4	-46.3	178.4	-57	-40.1	0	0	0	111.1	S27 L28 V33 E34 L35	S27-D31 VanDerWaalsContact C-OD2 3.28Å; S27-D31 PolarHBondContact O-N 3.31Å; S27-D31 VanDerWaalsContact O-OD2 3.06Å; S27-D31 PolarHBondContact OG-OD2 3.19Å; L28-D31 WeakPolarHBondContact CA-OD2 3.16Å; D31-V33 VanDerWaalsContact C-N 3.34Å; D31-V33 PolarHBondContact O-N 2.6Å; D31-E34 PolarHBondContact O-N 2.94Å; D31-L35 WeakPolarHBondContact O-CB 3.33Å; D31-L35 PolarHBondContact O-N 3.09Å
32	I	94.1	Very high	92.9	Very high	111 Å²	111	93.4 Å²	93.4	57%	0.569	51%	0.512	S	S	*	.	H	α-helix	trans	-60.6	-39.8	175.3	-73.4	164.5	0	0	0	111.9	L28 G30 N36	L28-I32 WeakPolarHBondContact O-CB 3.1Å; L28-I32 WeakPolarHBondContact O-CD1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.49Å; L28-I32 PolarHBondContact O-N 3.29Å; G30-I32 PolarHBondContact O-N 3.38Å; I32-N36 VanDerWaalsContact O-CB 3.24Å; I32-N36 WeakPolarHBondContact O-CB 3.2Å; I32-N36 PolarHBondContact O-N 2.82Å
33	V	95.6	Very high	93	Very high	101 Å²	101	93.6 Å²	93.6	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-70.5	-39.8	178.5	168.4	0	0	0	0	111.6	K29 G30 D31 K37	K29-V33 VanDerWaalsContact O-CG2 3.3Å; K29-V33 WeakPolarHBondContact O-CG2 3.4Å; K29-V33 PolarHBondContact O-N 3.48Å; K29-V33 VanDerWaalsContact O-N 3.11Å; G30-V33 PolarHBondContact O-N 3.29Å; D31-V33 VanDerWaalsContact C-N 3.34Å; D31-V33 PolarHBondContact O-N 2.6Å; V33-K37 WeakPolarHBondContact O-CB 3.34Å; V33-K37 PolarHBondContact O-N 3.42Å
34	E	95.3	Very high	93.3	Very high	115 Å²	115	97.8 Å²	97.8	54%	0.537	51%	0.509	S	S	.	.	H	α-helix	trans	-65.4	-45.6	173.4	-167	-170.9	127.3	0	0	111.1	G30 D31 N36 K37 R38	G30-E34 PolarHBondContact O-N 3.18Å; D31-E34 PolarHBondContact O-N 2.94Å; E34-N36 VanDerWaalsContact C-N 3.32Å; E34-N36 PolarHBondContact O-N 3.39Å; E34-K37 WeakPolarHBondContact O-CB 3.41Å; E34-K37 PolarHBondContact O-N 3.37Å; E34-K37 VanDerWaalsContact O-N 3.16Å; E34-R38 HydrophobicContact CG-CG 4.46Å; E34-R38 WeakPolarHBondContact O-CG 3.39Å; E34-R38 PolarHBondContact O-N 2.91Å; E34-R38 IonicContact OE1-NH1 2.66Å
35	L	94.6	Very high	93.5	Very high	122 Å²	122	100 Å²	100	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-61.2	-40.8	179.8	-149.1	79.8	0	0	0	111.6	D31 R38 L39	D31-L35 WeakPolarHBondContact O-CB 3.33Å; D31-L35 PolarHBondContact O-N 3.09Å; L35-R38 PolarHBondContact O-N 3.26Å; L35-L39 WeakPolarHBondContact O-CB 3.31Å; L35-L39 PolarHBondContact O-N 3.35Å
36	N	93.1	Very high	93.4	Very high	81 Å²	81	101.5 Å²	101.5	43%	0.433	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-42.2	174.6	-171.9	-10.6	0	0	0	111.7	I32 E34 R38 L39 Q40	I32-N36 VanDerWaalsContact O-CB 3.24Å; I32-N36 WeakPolarHBondContact O-CB 3.2Å; I32-N36 PolarHBondContact O-N 2.82Å; E34-N36 VanDerWaalsContact C-N 3.32Å; E34-N36 PolarHBondContact O-N 3.39Å; N36-R38 VanDerWaalsContact C-N 3.33Å; N36-R38 PolarHBondContact O-N 2.89Å; N36-L39 PolarHBondContact O-N 3.45Å; N36-Q40 WeakPolarHBondContact O-CG 3.43Å; N36-Q40 PolarHBondContact O-N 2.87Å; N36-Q40 PolarHBondContact OD1-NE2 3.35Å; N36-Q40 VanDerWaalsContact OD1-NE2 3.15Å
37	K	95.9	Very high	93.5	Very high	151 Å²	151	101.2 Å²	101.2	66%	0.657	50%	0.499	S	S	*	.	H	α-helix	trans	-60.5	-41.9	174.1	-175.9	-176.4	175.3	-171.6	0	111.9	V33 E34 Q41	V33-K37 WeakPolarHBondContact O-CB 3.34Å; V33-K37 PolarHBondContact O-N 3.42Å; E34-K37 WeakPolarHBondContact O-CB 3.41Å; E34-K37 PolarHBondContact O-N 3.37Å; E34-K37 VanDerWaalsContact O-N 3.16Å; K37-Q41 PolarHBondContact O-N 3.1Å; K37-Q41 VanDerWaalsContact O-N 3.13Å
38	R	94.6	Very high	93.6	Very high	147 Å²	147	102.5 Å²	102.5	56%	0.555	50%	0.5	S	S	*	.	H	α-helix	trans	-66.1	-45.8	176.1	-72.3	174.8	63.1	169.9	-2.3	111.5	E34 L35 N36 Q40 Q41 T42	E34-R38 HydrophobicContact CG-CG 4.46Å; E34-R38 WeakPolarHBondContact O-CG 3.39Å; E34-R38 PolarHBondContact O-N 2.91Å; E34-R38 IonicContact OE1-NH1 2.66Å; L35-R38 PolarHBondContact O-N 3.26Å; N36-R38 VanDerWaalsContact C-N 3.33Å; N36-R38 PolarHBondContact O-N 2.89Å; R38-Q40 PolarHBondContact O-N 2.98Å; R38-Q41 WeakPolarHBondContact O-CB 3.48Å; R38-Q41 PolarHBondContact O-N 3.39Å; R38-T42 PolarHBondContact O-N 2.8Å; R38-T42 PolarHBondContact O-OG1 3.37Å
39	L	93.3	Very high	93.2	Very high	97 Å²	97	103 Å²	103	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-53.8	-52.9	174.7	178	63.3	0	0	0	111.1	L35 N36 Q41 T42 E43	L35-L39 WeakPolarHBondContact O-CB 3.31Å; L35-L39 PolarHBondContact O-N 3.35Å; N36-L39 PolarHBondContact O-N 3.45Å; L39-Q41 PolarHBondContact O-N 2.93Å; L39-T42 PolarHBondContact O-N 2.97Å; L39-T42 VanDerWaalsContact O-N 3.12Å; L39-E43 HydrophobicContact CD1-CG 4.44Å; L39-E43 WeakPolarHBondContact O-CG 3.43Å; L39-E43 PolarHBondContact O-N 3.5Å
40	Q	94.4	Very high	93	Very high	74 Å²	74	102 Å²	102	35%	0.346	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-26.9	178.2	-66.2	-179.1	22	0	0	113.7	N36 R38 E43 R44	N36-Q40 WeakPolarHBondContact O-CG 3.43Å; N36-Q40 PolarHBondContact O-N 2.87Å; N36-Q40 PolarHBondContact OD1-NE2 3.35Å; N36-Q40 VanDerWaalsContact OD1-NE2 3.15Å; R38-Q40 PolarHBondContact O-N 2.98Å; Q40-E43 WeakPolarHBondContact CA-OE2 3.38Å; Q40-R44 VanDerWaalsContact CB-NH1 3.33Å; Q40-R44 VanDerWaalsContact O-CG 3.29Å; Q40-R44 WeakPolarHBondContact O-CG 3.47Å; Q40-R44 PolarHBondContact O-N 3.06Å; Q40-R44 PolarHBondContact O-NH1 3.03Å
41	Q	93.8	Very high	92.9	Very high	101 Å²	101	107.2 Å²	107.2	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-70.8	-48.8	172.7	177.9	170.1	-17.8	0	0	110.2	K37 R38 L39 E43 R44 E45	K37-Q41 PolarHBondContact O-N 3.1Å; K37-Q41 VanDerWaalsContact O-N 3.13Å; R38-Q41 WeakPolarHBondContact O-CB 3.48Å; R38-Q41 PolarHBondContact O-N 3.39Å; L39-Q41 PolarHBondContact O-N 2.93Å; Q41-E43 VanDerWaalsContact C-N 3.28Å; Q41-E43 PolarHBondContact O-N 3.45Å; Q41-R44 PolarHBondContact O-N 3.18Å; Q41-R44 VanDerWaalsContact O-N 3.13Å; Q41-E45 HydrophobicContact CG-CG 4.48Å; Q41-E45 WeakPolarHBondContact CG-OE1 3.25Å; Q41-E45 PolarHBondContact NE2-OE1 2.72Å; Q41-E45 WeakPolarHBondContact O-CG 3.24Å; Q41-E45 PolarHBondContact O-N 3.43Å
42	T	89.1	Confident	92.7	Very high	86 Å²	86	109.6 Å²	109.6	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-60.1	-35.7	176.2	-54.9	0	0	0	0	112.5	R38 L39 E45 R46	R38-T42 PolarHBondContact O-N 2.8Å; R38-T42 PolarHBondContact O-OG1 3.37Å; L39-T42 PolarHBondContact O-N 2.97Å; L39-T42 VanDerWaalsContact O-N 3.12Å; T42-E45 PolarHBondContact O-N 3.24Å; T42-R46 WeakPolarHBondContact O-CB 3.43Å; T42-R46 PolarHBondContact O-N 2.97Å
43	E	91.3	Very high	92.1	Very high	74 Å²	74	109.2 Å²	109.2	35%	0.346	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-47.3	172.4	-72.1	175.2	143.4	0	0	112	L39 Q40 Q41 E45 R46 D47	L39-E43 HydrophobicContact CD1-CG 4.44Å; L39-E43 WeakPolarHBondContact O-CG 3.43Å; L39-E43 PolarHBondContact O-N 3.5Å; Q40-E43 WeakPolarHBondContact CA-OE2 3.38Å; Q41-E43 VanDerWaalsContact C-N 3.28Å; Q41-E43 PolarHBondContact O-N 3.45Å; E43-E45 VanDerWaalsContact C-N 3.3Å; E43-E45 PolarHBondContact O-N 2.92Å; E43-R46 WeakPolarHBondContact O-CB 3.23Å; E43-R46 PolarHBondContact O-N 3.2Å; E43-D47 PolarHBondContact O-N 3.22Å; E43-D47 VanDerWaalsContact O-OD1 3.08Å
44	R	94.6	Very high	91.9	Very high	148 Å²	148	106.9 Å²	106.9	56%	0.558	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-34.2	177.2	-68.1	173.8	-163.4	104.3	0.9	112.5	Q40 Q41 L48	Q40-R44 VanDerWaalsContact CB-NH1 3.33Å; Q40-R44 VanDerWaalsContact O-CG 3.29Å; Q40-R44 WeakPolarHBondContact O-CG 3.47Å; Q40-R44 PolarHBondContact O-N 3.06Å; Q40-R44 PolarHBondContact O-NH1 3.03Å; Q41-R44 PolarHBondContact O-N 3.18Å; Q41-R44 VanDerWaalsContact O-N 3.13Å; R44-L48 WeakPolarHBondContact O-CB 3.49Å; R44-L48 PolarHBondContact O-N 3.41Å; R44-L48 VanDerWaalsContact O-N 3.17Å
45	E	93.1	Very high	91.7	Very high	94 Å²	94	107.1 Å²	107.1	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-43.5	175.4	-72.8	167.2	-176	0	0	111.1	Q41 T42 E43 L48 L49	Q41-E45 HydrophobicContact CG-CG 4.48Å; Q41-E45 WeakPolarHBondContact CG-OE1 3.25Å; Q41-E45 PolarHBondContact NE2-OE1 2.72Å; Q41-E45 WeakPolarHBondContact O-CG 3.24Å; Q41-E45 PolarHBondContact O-N 3.43Å; T42-E45 PolarHBondContact O-N 3.24Å; E43-E45 VanDerWaalsContact C-N 3.3Å; E43-E45 PolarHBondContact O-N 2.92Å; E45-L48 PolarHBondContact O-N 2.99Å; E45-L49 WeakPolarHBondContact O-CG 3.4Å; E45-L49 PolarHBondContact O-N 2.89Å
46	R	89.1	Confident	91.1	Very high	134 Å²	134	103.8 Å²	103.8	51%	0.506	50%	0.497	S	S	.	.	H	α-helix	trans	-56	-53.7	170.6	177.9	-159.8	66.3	-155.2	-5.5	111.3	T42 E43 L48 L49 E50	T42-R46 WeakPolarHBondContact O-CB 3.43Å; T42-R46 PolarHBondContact O-N 2.97Å; E43-R46 WeakPolarHBondContact O-CB 3.23Å; E43-R46 PolarHBondContact O-N 3.2Å; R46-L48 PolarHBondContact O-N 2.98Å; R46-L49 PolarHBondContact O-N 2.95Å; R46-E50 WeakPolarHBondContact O-CB 3.15Å; R46-E50 PolarHBondContact O-N 2.99Å
47	D	92.5	Very high	90.6	Very high	56 Å²	56	104.7 Å²	104.7	30%	0.299	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-25.7	-176.2	-64.2	1.7	0	0	0	112.5	E43 K51	E43-D47 PolarHBondContact O-N 3.22Å; E43-D47 VanDerWaalsContact O-OD1 3.08Å; D47-K51 WeakPolarHBondContact O-CD 3.4Å; D47-K51 VanDerWaalsContact O-CG 3.28Å; D47-K51 WeakPolarHBondContact O-CG 3.38Å; D47-K51 PolarHBondContact O-N 3.29Å
48	L	94.3	Very high	90.4	Very high	94 Å²	94	101.7 Å²	101.7	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-79.9	-37.3	174.1	-175.3	149	0	0	0	112	R44 E45 R46 K52	R44-L48 WeakPolarHBondContact O-CB 3.49Å; R44-L48 PolarHBondContact O-N 3.41Å; R44-L48 VanDerWaalsContact O-N 3.17Å; E45-L48 PolarHBondContact O-N 2.99Å; R46-L48 PolarHBondContact O-N 2.98Å; L48-K52 HydrophobicContact CD2-CD 4.01Å; L48-K52 WeakPolarHBondContact O-CG 3.34Å; L48-K52 PolarHBondContact O-N 2.91Å; L48-K52 VanDerWaalsContact O-N 3.14Å
49	L	84.8	Confident	90.1	Very high	109 Å²	109	99.2 Å²	99.2	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-68.5	-40.6	173.1	-70.9	170.4	0	0	0	111.7	E45 R46 K51 K52 L53	E45-L49 WeakPolarHBondContact O-CG 3.4Å; E45-L49 PolarHBondContact O-N 2.89Å; R46-L49 PolarHBondContact O-N 2.95Å; L49-K51 PolarHBondContact O-N 2.71Å; L49-K52 WeakPolarHBondContact O-CB 3.37Å; L49-K52 PolarHBondContact O-N 2.66Å; L49-K52 VanDerWaalsContact O-N 3.15Å; L49-L53 WeakPolarHBondContact O-CB 3.5Å; L49-L53 PolarHBondContact O-N 3.4Å
50	E	89.6	Confident	89.6	Confident	122 Å²	122	100.3 Å²	100.3	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-43.8	175.7	-174.5	172.9	-151	0	0	111.5	R46 K52 L53 A54	R46-E50 WeakPolarHBondContact O-CB 3.15Å; R46-E50 PolarHBondContact O-N 2.99Å; E50-K52 PolarHBondContact O-N 2.78Å; E50-L53 PolarHBondContact O-N 2.91Å; E50-A54 WeakPolarHBondContact O-CB 3.45Å; E50-A54 PolarHBondContact O-N 2.93Å
51	K	93.6	Very high	89.1	Confident	151 Å²	151	99.8 Å²	99.8	66%	0.657	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-35.2	173.6	-73.8	167.7	-172.3	164.1	0	113.2	D47 L49 K55	D47-K51 WeakPolarHBondContact O-CD 3.4Å; D47-K51 VanDerWaalsContact O-CG 3.28Å; D47-K51 WeakPolarHBondContact O-CG 3.38Å; D47-K51 PolarHBondContact O-N 3.29Å; L49-K51 PolarHBondContact O-N 2.71Å; K51-K55 WeakPolarHBondContact O-CB 3.49Å; K51-K55 PolarHBondContact O-N 3.35Å; K51-K55 VanDerWaalsContact O-N 3.1Å
52	K	90	Very high	89	Confident	134 Å²	134	100 Å²	100	58%	0.583	50%	0.498	S	S	*	.	H	α-helix	trans	-67.6	-42.7	173.1	-77.6	177	174.3	-180	0	111.6	L48 L49 E50 K55 A56	L48-K52 HydrophobicContact CD2-CD 4.01Å; L48-K52 WeakPolarHBondContact O-CG 3.34Å; L48-K52 PolarHBondContact O-N 2.91Å; L48-K52 VanDerWaalsContact O-N 3.14Å; L49-K52 WeakPolarHBondContact O-CB 3.37Å; L49-K52 PolarHBondContact O-N 2.66Å; L49-K52 VanDerWaalsContact O-N 3.15Å; E50-K52 PolarHBondContact O-N 2.78Å; K52-K55 PolarHBondContact O-N 3.43Å; K52-A56 WeakPolarHBondContact O-CB 3.46Å; K52-A56 PolarHBondContact O-N 3.11Å
53	L	82.1	Confident	88.9	Confident	103 Å²	103	101.4 Å²	101.4	54%	0.539	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-48.9	177.1	-178.4	64.5	0	0	0	111.2	L49 E50 K55 A56 Q57	L49-L53 WeakPolarHBondContact O-CB 3.5Å; L49-L53 PolarHBondContact O-N 3.4Å; E50-L53 PolarHBondContact O-N 2.91Å; L53-K55 VanDerWaalsContact C-N 3.3Å; L53-K55 PolarHBondContact O-N 3.48Å; L53-A56 PolarHBondContact O-N 2.87Å; L53-Q57 HydrophobicContact CD1-CG 4.44Å; L53-Q57 WeakPolarHBondContact O-CB 3.39Å; L53-Q57 WeakPolarHBondContact O-CG 3.45Å; L53-Q57 PolarHBondContact O-N 3.27Å
54	A	90.5	Very high	88.6	Confident	52 Å²	52	102.9 Å²	102.9	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-37.5	176.8	0	0	0	0	0	112.5	E50 C58	E50-A54 WeakPolarHBondContact O-CB 3.45Å; E50-A54 PolarHBondContact O-N 2.93Å; A54-C58 WeakPolarHBondContact O-CB 3.34Å; A54-C58 PolarHBondContact O-N 3.41Å; A54-C58 VanDerWaalsContact O-N 3.09Å
55	K	91.1	Very high	88.4	Confident	119 Å²	119	102.2 Å²	102.2	52%	0.517	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-48	173.4	-176.3	176.7	175.6	-73.2	0	111.6	K51 K52 L53 Q57 C58 E59	K51-K55 WeakPolarHBondContact O-CB 3.49Å; K51-K55 PolarHBondContact O-N 3.35Å; K51-K55 VanDerWaalsContact O-N 3.1Å; K52-K55 PolarHBondContact O-N 3.43Å; L53-K55 VanDerWaalsContact C-N 3.3Å; L53-K55 PolarHBondContact O-N 3.48Å; K55-Q57 VanDerWaalsContact C-N 3.35Å; K55-Q57 PolarHBondContact O-N 3.17Å; K55-C58 WeakPolarHBondContact O-CB 3.37Å; K55-C58 PolarHBondContact O-N 3.07Å; K55-C58 VanDerWaalsContact O-N 3.14Å; K55-E59 WeakPolarHBondContact CE-OE1 3.24Å; K55-E59 IonicContact NZ-OE1 3.57Å; K55-E59 PolarHBondContact NZ-OE1 3.2Å; K55-E59 IonicContact NZ-OE2 3.71Å; K55-E59 PolarHBondContact NZ-OE2 2.84Å; K55-E59 WeakPolarHBondContact O-CG 3.42Å; K55-E59 PolarHBondContact O-N 3.47Å
56	A	82.9	Confident	88.2	Confident	52 Å²	52	102.1 Å²	102.1	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-40.2	178.7	0	0	0	0	0	112.4	K52 L53 C58 E59 Q60	K52-A56 WeakPolarHBondContact O-CB 3.46Å; K52-A56 PolarHBondContact O-N 3.11Å; L53-A56 PolarHBondContact O-N 2.87Å; A56-C58 VanDerWaalsContact C-N 3.34Å; A56-C58 PolarHBondContact O-N 2.8Å; A56-E59 PolarHBondContact O-N 3.13Å; A56-Q60 VanDerWaalsContact O-CB 3.3Å; A56-Q60 WeakPolarHBondContact O-CB 3.45Å; A56-Q60 PolarHBondContact O-N 3.27Å
57	Q	83.1	Confident	88.1	Confident	100 Å²	100	101.3 Å²	101.3	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-38.3	173.4	-73.8	171.9	-22.5	0	0	112.3	L53 K55 S61	L53-Q57 HydrophobicContact CD1-CG 4.44Å; L53-Q57 WeakPolarHBondContact O-CB 3.39Å; L53-Q57 WeakPolarHBondContact O-CG 3.45Å; L53-Q57 PolarHBondContact O-N 3.27Å; K55-Q57 VanDerWaalsContact C-N 3.35Å; K55-Q57 PolarHBondContact O-N 3.17Å; Q57-S61 VanDerWaalsContact O-CB 3.27Å; Q57-S61 WeakPolarHBondContact O-CB 3.49Å; Q57-S61 PolarHBondContact O-N 2.91Å; Q57-S61 PolarHBondContact O-OG 3.4Å
58	C	90.9	Very high	87.9	Confident	88 Å²	88	103.8 Å²	103.8	60%	0.595	52%	0.519	S	S	*	.	H	α-helix	trans	-66.7	-43.9	175	-168.3	0	0	0	0	111.7	A54 K55 A56 S61 H62	A54-C58 WeakPolarHBondContact O-CB 3.34Å; A54-C58 PolarHBondContact O-N 3.41Å; A54-C58 VanDerWaalsContact O-N 3.09Å; K55-C58 WeakPolarHBondContact O-CB 3.37Å; K55-C58 PolarHBondContact O-N 3.07Å; K55-C58 VanDerWaalsContact O-N 3.14Å; A56-C58 VanDerWaalsContact C-N 3.34Å; A56-C58 PolarHBondContact O-N 2.8Å; C58-S61 CarbonylContact O-C 3.58Å; C58-S61 PolarHBondContact O-N 2.73Å; C58-H62 PolarHBondContact O-N 3.32Å
59	E	88.9	Confident	87.7	Confident	96 Å²	96	102 Å²	102	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-40.6	177.6	-70.2	174.5	138.2	0	0	111.9	K55 A56 S61 H62 L63	K55-E59 WeakPolarHBondContact CE-OE1 3.24Å; K55-E59 IonicContact NZ-OE1 3.57Å; K55-E59 PolarHBondContact NZ-OE1 3.2Å; K55-E59 IonicContact NZ-OE2 3.71Å; K55-E59 PolarHBondContact NZ-OE2 2.84Å; K55-E59 WeakPolarHBondContact O-CG 3.42Å; K55-E59 PolarHBondContact O-N 3.47Å; A56-E59 PolarHBondContact O-N 3.13Å; E59-S61 VanDerWaalsContact C-N 3.35Å; E59-S61 PolarHBondContact O-N 3.23Å; E59-H62 WeakPolarHBondContact O-CB 3.46Å; E59-H62 PolarHBondContact O-N 3.03Å; E59-H62 VanDerWaalsContact O-N 3.13Å; E59-L63 WeakPolarHBondContact O-CG 3.23Å; E59-L63 PolarHBondContact O-N 2.83Å
60	Q	82.7	Confident	88.1	Confident	119 Å²	119	100.9 Å²	100.9	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-60.3	-43.2	170.5	-174.1	177.5	39	0	0	111.7	A56 H62 L63 M64	A56-Q60 VanDerWaalsContact O-CB 3.3Å; A56-Q60 WeakPolarHBondContact O-CB 3.45Å; A56-Q60 PolarHBondContact O-N 3.27Å; Q60-H62 PolarHBondContact O-N 2.93Å; Q60-L63 PolarHBondContact O-N 3.5Å; Q60-M64 WeakPolarHBondContact O-CB 3.43Å; Q60-M64 WeakPolarHBondContact O-CG 3.49Å; Q60-M64 PolarHBondContact O-N 3.07Å
61	S	84	Confident	88	Confident	64 Å²	64	100 Å²	100	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-70.5	-11.9	176.2	-57.1	0	0	0	0	113.9	Q57 C58 E59 R65	Q57-S61 VanDerWaalsContact O-CB 3.27Å; Q57-S61 WeakPolarHBondContact O-CB 3.49Å; Q57-S61 PolarHBondContact O-N 2.91Å; Q57-S61 PolarHBondContact O-OG 3.4Å; C58-S61 CarbonylContact O-C 3.58Å; C58-S61 PolarHBondContact O-N 2.73Å; E59-S61 VanDerWaalsContact C-N 3.35Å; E59-S61 PolarHBondContact O-N 3.23Å; S61-R65 PolarHBondContact O-NH1 2.78Å; S61-R65 PolarHBondContact O-NH2 2.78Å
62	H	90.9	Very high	87.9	Confident	104 Å²	104	98.6 Å²	98.6	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-85	-53.7	170.5	-166.1	-79.9	0	0	0	109.8	C58 E59 Q60 M64 R65 E66	C58-H62 PolarHBondContact O-N 3.32Å; E59-H62 WeakPolarHBondContact O-CB 3.46Å; E59-H62 PolarHBondContact O-N 3.03Å; E59-H62 VanDerWaalsContact O-N 3.13Å; Q60-H62 PolarHBondContact O-N 2.93Å; H62-M64 VanDerWaalsContact C-N 3.32Å; H62-M64 PolarHBondContact O-N 3.44Å; H62-R65 PolarHBondContact O-N 3.4Å; H62-E66 IonicContact CE1-OE1 2.92Å; H62-E66 PolarHBondContact CE1-OE1 2.91Å; H62-E66 IonicContact CE1-OE2 3.01Å; H62-E66 PolarHBondContact CE1-OE2 3.19Å; H62-E66 VanDerWaalsContact CE1-OE2 3.32Å; H62-E66 IonicContact CG-OE2 2.67Å; H62-E66 IonicContact ND1-OE1 3.56Å; H62-E66 IonicContact ND1-OE2 2.7Å; H62-E66 PolarHBondContact ND1-OE2 3.13Å; H62-E66 PolarHBondContact O-N 3.14Å
63	L	87.7	Confident	88.1	Confident	116 Å²	116	98.3 Å²	98.3	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-60	-38.1	-179.3	-68.1	169.5	0	0	0	112.9	E59 Q60 R65 E66 H67	E59-L63 WeakPolarHBondContact O-CG 3.23Å; E59-L63 PolarHBondContact O-N 2.83Å; Q60-L63 PolarHBondContact O-N 3.5Å; L63-R65 VanDerWaalsContact C-N 3.34Å; L63-R65 PolarHBondContact O-N 2.92Å; L63-E66 PolarHBondContact O-N 2.97Å; L63-H67 WeakPolarHBondContact O-CB 3.41Å; L63-H67 PolarHBondContact O-N 3.29Å
64	M	83.4	Confident	88.5	Confident	106 Å²	106	96 Å²	96	52%	0.522	48%	0.484	S	S	.	.	H	α-helix	trans	-58.7	-44.9	172.8	-76.9	-60.5	-54.3	0	0	111.9	Q60 H62 H67 E68	Q60-M64 WeakPolarHBondContact O-CB 3.43Å; Q60-M64 WeakPolarHBondContact O-CG 3.49Å; Q60-M64 PolarHBondContact O-N 3.07Å; H62-M64 VanDerWaalsContact C-N 3.32Å; H62-M64 PolarHBondContact O-N 3.44Å; M64-H67 WeakPolarHBondContact O-CB 3.36Å; M64-H67 PolarHBondContact O-N 3.17Å; M64-E68 WeakPolarHBondContact O-CG 3.38Å; M64-E68 PolarHBondContact O-N 3.21Å
65	R	91.8	Very high	88.5	Confident	134 Å²	134	96.5 Å²	96.5	51%	0.506	48%	0.482	S	S	.	.	H	α-helix	trans	-70	-37.8	179.3	-168.2	-177.8	-59.8	85.6	13.3	111.9	S61 H62 L63 H67 E68 D69	S61-R65 PolarHBondContact O-NH1 2.78Å; S61-R65 PolarHBondContact O-NH2 2.78Å; H62-R65 PolarHBondContact O-N 3.4Å; L63-R65 VanDerWaalsContact C-N 3.34Å; L63-R65 PolarHBondContact O-N 2.92Å; R65-H67 VanDerWaalsContact C-N 3.28Å; R65-H67 PolarHBondContact O-N 2.9Å; R65-E68 PolarHBondContact O-N 2.89Å; R65-D69 VanDerWaalsContact O-CB 3.23Å; R65-D69 WeakPolarHBondContact O-CB 3.29Å; R65-D69 PolarHBondContact O-N 3.07Å
66	E	89.2	Confident	88.6	Confident	91 Å²	91	94.6 Å²	94.6	43%	0.425	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-34.4	173.3	-72	177.1	121.2	0	0	112.2	H62 L63 V70	H62-E66 IonicContact CE1-OE1 2.92Å; H62-E66 PolarHBondContact CE1-OE1 2.91Å; H62-E66 IonicContact CE1-OE2 3.01Å; H62-E66 PolarHBondContact CE1-OE2 3.19Å; H62-E66 VanDerWaalsContact CE1-OE2 3.32Å; H62-E66 IonicContact CG-OE2 2.67Å; H62-E66 IonicContact ND1-OE1 3.56Å; H62-E66 IonicContact ND1-OE2 2.7Å; H62-E66 PolarHBondContact ND1-OE2 3.13Å; H62-E66 PolarHBondContact O-N 3.14Å; L63-E66 PolarHBondContact O-N 2.97Å; E66-V70 WeakPolarHBondContact O-CB 3.21Å; E66-V70 VanDerWaalsContact O-CG2 3.25Å; E66-V70 WeakPolarHBondContact O-CG2 3.47Å; E66-V70 PolarHBondContact O-N 3.34Å
67	H	85.3	Confident	89.1	Confident	117 Å²	117	99.9 Å²	99.9	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-68.4	-45.7	172	-176.3	-72.1	0	0	0	111.8	L63 M64 R65 V70 Q71	L63-H67 WeakPolarHBondContact O-CB 3.41Å; L63-H67 PolarHBondContact O-N 3.29Å; M64-H67 WeakPolarHBondContact O-CB 3.36Å; M64-H67 PolarHBondContact O-N 3.17Å; R65-H67 VanDerWaalsContact C-N 3.28Å; R65-H67 PolarHBondContact O-N 2.9Å; H67-V70 PolarHBondContact O-N 3.34Å; H67-Q71 PolarHBondContact CE1-OE1 3.39Å; H67-Q71 WeakPolarHBondContact O-CB 3.03Å; H67-Q71 PolarHBondContact O-N 3.49Å
68	E	89.1	Confident	89.5	Confident	109 Å²	109	103 Å²	103	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-57.3	-49.9	174.5	-71.5	163.4	177.7	0	0	111.2	M64 R65 V70 Q71 E72	M64-E68 WeakPolarHBondContact O-CG 3.38Å; M64-E68 PolarHBondContact O-N 3.21Å; R65-E68 PolarHBondContact O-N 2.89Å; E68-V70 VanDerWaalsContact C-N 3.35Å; E68-V70 PolarHBondContact O-N 2.86Å; E68-Q71 PolarHBondContact O-N 2.98Å; E68-E72 WeakPolarHBondContact O-CB 3.22Å; E68-E72 PolarHBondContact O-N 3.1Å
69	D	91.1	Very high	89.7	Confident	56 Å²	56	104 Å²	104	30%	0.299	49%	0.49	S	S	.	.	H	α-helix	trans	-52.6	-45.1	173.1	-100.6	43.1	0	0	0	112.9	R65 R73	R65-D69 VanDerWaalsContact O-CB 3.23Å; R65-D69 WeakPolarHBondContact O-CB 3.29Å; R65-D69 PolarHBondContact O-N 3.07Å; D69-R73 VanDerWaalsContact O-CD 3.3Å; D69-R73 WeakPolarHBondContact O-CD 3.32Å; D69-R73 WeakPolarHBondContact O-CG 3.26Å; D69-R73 PolarHBondContact O-N 3.1Å; D69-R73 IonicContact OD2-CZ 3.66Å; D69-R73 IonicContact OD2-NH1 2.77Å; D69-R73 IonicContact OD2-NH2 3.46Å; D69-R73 PolarHBondContact OD2-NH2 3.03Å
70	V	92.7	Very high	90	Very high	85 Å²	85	105 Å²	105	52%	0.515	50%	0.495	S	S	.	.	H	α-helix	trans	-71.8	-40.5	179.3	166.8	0	0	0	0	110.8	E66 H67 E68 R73 T74	E66-V70 WeakPolarHBondContact O-CB 3.21Å; E66-V70 VanDerWaalsContact O-CG2 3.25Å; E66-V70 WeakPolarHBondContact O-CG2 3.47Å; E66-V70 PolarHBondContact O-N 3.34Å; H67-V70 PolarHBondContact O-N 3.34Å; E68-V70 VanDerWaalsContact C-N 3.35Å; E68-V70 PolarHBondContact O-N 2.86Å; V70-R73 PolarHBondContact O-N 3.49Å; V70-T74 PolarHBondContact O-N 2.97Å; V70-T74 VanDerWaalsContact O-N 3.1Å
71	Q	87.3	Confident	90.6	Very high	104 Å²	104	106 Å²	106	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-46.6	177.4	-173.2	172	-9.5	0	0	111	H67 E68 R73 T74 T75	H67-Q71 PolarHBondContact CE1-OE1 3.39Å; H67-Q71 WeakPolarHBondContact O-CB 3.03Å; H67-Q71 PolarHBondContact O-N 3.49Å; E68-Q71 PolarHBondContact O-N 2.98Å; Q71-R73 VanDerWaalsContact C-N 3.34Å; Q71-R73 PolarHBondContact O-N 3.11Å; Q71-T74 PolarHBondContact O-N 3.36Å; Q71-T74 PolarHBondContact O-OG1 3.44Å; Q71-T75 PolarHBondContact O-N 2.85Å; Q71-T75 PolarHBondContact O-OG1 3.16Å
72	E	91.6	Very high	91.2	Very high	122 Å²	122	107.1 Å²	107.1	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-56	-45.9	174	-173.3	178.9	-138.5	0	0	111.4	E68 T74 T75 L76	E68-E72 WeakPolarHBondContact O-CB 3.22Å; E68-E72 PolarHBondContact O-N 3.1Å; E72-T74 PolarHBondContact O-N 2.93Å; E72-T75 PolarHBondContact O-N 3.33Å; E72-T75 VanDerWaalsContact O-N 3.16Å; E72-L76 HydrophobicContact CG-CD1 4.05Å; E72-L76 HydrophobicContact CG-CG 4.37Å; E72-L76 WeakPolarHBondContact O-CB 3.49Å; E72-L76 WeakPolarHBondContact O-CG 3.35Å; E72-L76 PolarHBondContact O-N 2.94Å
73	R	94.1	Very high	91.4	Very high	127 Å²	127	106.5 Å²	106.5	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-18.5	175.1	-70.3	166.2	-168	134.3	14.1	114.7	D69 V70 Q71 R77	D69-R73 VanDerWaalsContact O-CD 3.3Å; D69-R73 WeakPolarHBondContact O-CD 3.32Å; D69-R73 WeakPolarHBondContact O-CG 3.26Å; D69-R73 PolarHBondContact O-N 3.1Å; D69-R73 IonicContact OD2-CZ 3.66Å; D69-R73 IonicContact OD2-NH1 2.77Å; D69-R73 IonicContact OD2-NH2 3.46Å; D69-R73 PolarHBondContact OD2-NH2 3.03Å; V70-R73 PolarHBondContact O-N 3.49Å; Q71-R73 VanDerWaalsContact C-N 3.34Å; Q71-R73 PolarHBondContact O-N 3.11Å; R73-R77 PolarHBondContact O-NE 2.92Å; R73-R77 VanDerWaalsContact O-NE 3.14Å
74	T	89.9	Confident	91.8	Very high	55 Å²	55	105.7 Å²	105.7	34%	0.337	49%	0.491	S	S	.	.	H	α-helix	trans	-86.1	-43	169.8	60.6	0	0	0	0	111.5	V70 Q71 E72 L76 R77 Y78	V70-T74 PolarHBondContact O-N 2.97Å; V70-T74 VanDerWaalsContact O-N 3.1Å; Q71-T74 PolarHBondContact O-N 3.36Å; Q71-T74 PolarHBondContact O-OG1 3.44Å; E72-T74 PolarHBondContact O-N 2.93Å; T74-L76 PolarHBondContact O-N 3.37Å; T74-R77 PolarHBondContact O-N 3.36Å; T74-Y78 WeakPolarHBondContact O-CD2 3.23Å; T74-Y78 PolarHBondContact O-N 3.27Å; T74-Y78 VanDerWaalsContact O-N 3.13Å
75	T	90.5	Very high	92.4	Very high	62 Å²	62	104.6 Å²	104.6	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-56.3	-49.3	174.3	-55.2	0	0	0	0	111.2	Q71 E72 R77 Y78 E79	Q71-T75 PolarHBondContact O-N 2.85Å; Q71-T75 PolarHBondContact O-OG1 3.16Å; E72-T75 PolarHBondContact O-N 3.33Å; E72-T75 VanDerWaalsContact O-N 3.16Å; T75-R77 VanDerWaalsContact C-N 3.3Å; T75-R77 PolarHBondContact O-N 3.09Å; T75-Y78 CarbonylContact O-C 3.56Å; T75-Y78 WeakPolarHBondContact O-CA 3.42Å; T75-Y78 WeakPolarHBondContact O-CB 3.26Å; T75-Y78 PolarHBondContact O-N 2.87Å; T75-E79 HydrophobicContact CG2-CG 4.42Å; T75-E79 PolarHBondContact O-N 3.43Å
76	L	93.2	Very high	92.4	Very high	79 Å²	79	103.9 Å²	103.9	41%	0.414	49%	0.489	S	S	.	.	H	α-helix	trans	-57.8	-39.9	179	-72.1	170.3	0	0	0	112.4	E72 T74 Y78 E79 E80	E72-L76 HydrophobicContact CG-CD1 4.05Å; E72-L76 HydrophobicContact CG-CG 4.37Å; E72-L76 WeakPolarHBondContact O-CB 3.49Å; E72-L76 WeakPolarHBondContact O-CG 3.35Å; E72-L76 PolarHBondContact O-N 2.94Å; T74-L76 PolarHBondContact O-N 3.37Å; L76-Y78 VanDerWaalsContact C-N 3.35Å; L76-Y78 PolarHBondContact O-N 3.46Å; L76-E79 PolarHBondContact O-N 2.97Å; L76-E80 WeakPolarHBondContact O-CB 3.5Å; L76-E80 VanDerWaalsContact O-CG 3.27Å; L76-E80 WeakPolarHBondContact O-CG 3.47Å; L76-E80 PolarHBondContact O-N 2.99Å
77	R	94.1	Very high	92.7	Very high	163 Å²	163	103.3 Å²	103.3	62%	0.615	50%	0.495	S	S	*	.	H	α-helix	trans	-66.7	-34.5	175.2	-79.4	-172.8	-99.7	-177.6	-9.5	113.2	R73 T74 T75 R81	R73-R77 PolarHBondContact O-NE 2.92Å; R73-R77 VanDerWaalsContact O-NE 3.14Å; T74-R77 PolarHBondContact O-N 3.36Å; T75-R77 VanDerWaalsContact C-N 3.3Å; T75-R77 PolarHBondContact O-N 3.09Å; R77-R81 WeakPolarHBondContact O-CB 3.26Å; R77-R81 PolarHBondContact O-N 3.03Å; R77-R81 VanDerWaalsContact O-N 3.07Å
78	Y	92	Very high	93.2	Very high	167 Å²	167	101.3 Å²	101.3	66%	0.655	49%	0.491	S	S	*	.	H	α-helix	trans	-70.6	-39.4	172.6	-66.9	-57.6	0	0	0	111.4	T74 T75 L76 R81 I82	T74-Y78 WeakPolarHBondContact O-CD2 3.23Å; T74-Y78 PolarHBondContact O-N 3.27Å; T74-Y78 VanDerWaalsContact O-N 3.13Å; T75-Y78 CarbonylContact O-C 3.56Å; T75-Y78 WeakPolarHBondContact O-CA 3.42Å; T75-Y78 WeakPolarHBondContact O-CB 3.26Å; T75-Y78 PolarHBondContact O-N 2.87Å; L76-Y78 VanDerWaalsContact C-N 3.35Å; L76-Y78 PolarHBondContact O-N 3.46Å; Y78-R81 PolarHBondContact O-N 3.26Å; Y78-I82 WeakPolarHBondContact O-CB 3.4Å; Y78-I82 WeakPolarHBondContact O-CD1 3.29Å; Y78-I82 WeakPolarHBondContact O-CG1 3.39Å; Y78-I82 PolarHBondContact O-N 2.94Å
79	E	94	Very high	93.4	Very high	107 Å²	107	100.3 Å²	100.3	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-47.4	174.1	-70.1	-175.5	162	0	0	111.9	T75 L76 R81 I82 T83	T75-E79 HydrophobicContact CG2-CG 4.42Å; T75-E79 PolarHBondContact O-N 3.43Å; L76-E79 PolarHBondContact O-N 2.97Å; E79-R81 PolarHBondContact O-N 2.62Å; E79-I82 CarbonylContact O-C 3.56Å; E79-I82 WeakPolarHBondContact O-CB 3.4Å; E79-I82 PolarHBondContact O-N 3.41Å; E79-I82 VanDerWaalsContact O-N 3.11Å; E79-T83 WeakPolarHBondContact O-CG2 3.44Å; E79-T83 PolarHBondContact O-N 3.44Å
80	E	95	Very high	93.5	Very high	117 Å²	117	100.4 Å²	100.4	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-51	-54.7	171.7	-76.1	171.1	159.5	0	0	110.4	L76 I82 T83 E84	L76-E80 WeakPolarHBondContact O-CB 3.5Å; L76-E80 VanDerWaalsContact O-CG 3.27Å; L76-E80 WeakPolarHBondContact O-CG 3.47Å; L76-E80 PolarHBondContact O-N 2.99Å; E80-I82 VanDerWaalsContact C-N 3.29Å; E80-I82 PolarHBondContact O-N 3.09Å; E80-T83 PolarHBondContact O-N 3.46Å; E80-T83 PolarHBondContact O-OG1 2.99Å; E80-E84 PolarHBondContact O-N 3.49Å
81	R	96.6	Very high	93.5	Very high	140 Å²	140	102.6 Å²	102.6	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-34	178.8	-174.7	53.7	173.4	179.8	-0.2	113.2	R77 Y78 E79 E84 L85	R77-R81 WeakPolarHBondContact O-CB 3.26Å; R77-R81 PolarHBondContact O-N 3.03Å; R77-R81 VanDerWaalsContact O-N 3.07Å; Y78-R81 PolarHBondContact O-N 3.26Å; E79-R81 PolarHBondContact O-N 2.62Å; R81-E84 WeakPolarHBondContact CD-OE2 3.48Å; R81-E84 IonicContact CZ-OE2 2.68Å; R81-E84 IonicContact NE-OE2 3.68Å; R81-E84 IonicContact NH1-OE2 3.94Å; R81-E84 PolarHBondContact NH1-OE2 3.4Å; R81-L85 HydrophobicContact CG-CD1 4.39Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 2.81Å; R81-L85 PolarHBondContact O-N 3.07Å
82	I	95.9	Very high	93.8	Very high	89 Å²	89	102.2 Å²	102.2	46%	0.456	50%	0.502	S	S	.	.	H	α-helix	trans	-67.8	-38.4	173.5	-74.1	164.5	0	0	0	110.5	Y78 E79 E80 L85 H86	Y78-I82 WeakPolarHBondContact O-CB 3.4Å; Y78-I82 WeakPolarHBondContact O-CD1 3.29Å; Y78-I82 WeakPolarHBondContact O-CG1 3.39Å; Y78-I82 PolarHBondContact O-N 2.94Å; E79-I82 CarbonylContact O-C 3.56Å; E79-I82 WeakPolarHBondContact O-CB 3.4Å; E79-I82 PolarHBondContact O-N 3.41Å; E79-I82 VanDerWaalsContact O-N 3.11Å; E80-I82 VanDerWaalsContact C-N 3.29Å; E80-I82 PolarHBondContact O-N 3.09Å; I82-L85 PolarHBondContact O-N 3.29Å; I82-H86 VanDerWaalsContact CG2-CE1 3.49Å; I82-H86 WeakPolarHBondContact CG2-CE1 3.44Å; I82-H86 WeakPolarHBondContact CG2-ND1 3.37Å; I82-H86 PolarHBondContact O-N 2.9Å; I82-H86 PolarHBondContact O-ND1 3.05Å
83	T	95.4	Very high	93.7	Very high	91 Å²	91	100.2 Å²	100.2	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-69.8	-37.3	175	64	0	0	0	0	112.8	E79 E80 H86 S87	E79-T83 WeakPolarHBondContact O-CG2 3.44Å; E79-T83 PolarHBondContact O-N 3.44Å; E80-T83 PolarHBondContact O-N 3.46Å; E80-T83 PolarHBondContact O-OG1 2.99Å; T83-H86 PolarHBondContact O-N 3.38Å; T83-S87 WeakPolarHBondContact O-CB 3.49Å; T83-S87 PolarHBondContact O-N 2.98Å
84	E	96.1	Very high	93.7	Very high	99 Å²	99	99.8 Å²	99.8	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-57.3	-49.6	170.5	-69.3	-177	152.2	0	0	111.1	E80 R81 H86 S87 V88	E80-E84 PolarHBondContact O-N 3.49Å; R81-E84 WeakPolarHBondContact CD-OE2 3.48Å; R81-E84 IonicContact CZ-OE2 2.68Å; R81-E84 IonicContact NE-OE2 3.68Å; R81-E84 IonicContact NH1-OE2 3.94Å; R81-E84 PolarHBondContact NH1-OE2 3.4Å; E84-H86 PolarHBondContact O-N 2.66Å; E84-S87 WeakPolarHBondContact O-CB 3.05Å; E84-S87 PolarHBondContact O-N 2.93Å; E84-S87 VanDerWaalsContact O-N 3.13Å; E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.14Å
85	L	96.1	Very high	93.9	Very high	82 Å²	82	103.4 Å²	103.4	43%	0.429	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-40.2	179.8	-71.5	169.7	0	0	0	111.9	R81 I82 S87 V88 I89	R81-L85 HydrophobicContact CG-CD1 4.39Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 2.81Å; R81-L85 PolarHBondContact O-N 3.07Å; I82-L85 PolarHBondContact O-N 3.29Å; L85-S87 VanDerWaalsContact C-N 3.33Å; L85-S87 PolarHBondContact O-N 2.94Å; L85-V88 PolarHBondContact O-N 3.39Å; L85-I89 WeakPolarHBondContact O-CB 3.46Å; L85-I89 WeakPolarHBondContact O-CD1 3.36Å; L85-I89 WeakPolarHBondContact O-CG1 3.39Å; L85-I89 PolarHBondContact O-N 2.93Å
86	H	92.1	Very high	94	Very high	119 Å²	119	104.3 Å²	104.3	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-64	-36.6	172.5	-76.3	106.3	0	0	0	112.7	I82 T83 E84 I89 A90	I82-H86 VanDerWaalsContact CG2-CE1 3.49Å; I82-H86 WeakPolarHBondContact CG2-CE1 3.44Å; I82-H86 WeakPolarHBondContact CG2-ND1 3.37Å; I82-H86 PolarHBondContact O-N 2.9Å; I82-H86 PolarHBondContact O-ND1 3.05Å; T83-H86 PolarHBondContact O-N 3.38Å; E84-H86 PolarHBondContact O-N 2.66Å; H86-I89 PolarHBondContact O-N 2.93Å; H86-A90 WeakPolarHBondContact O-CB 3.39Å; H86-A90 PolarHBondContact O-N 3.26Å
87	S	93.9	Very high	93.8	Very high	79 Å²	79	105.2 Å²	105.2	55%	0.552	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-45.5	174.6	-168.1	0	0	0	0	111.6	T83 E84 L85 I89 A90 E91	T83-S87 WeakPolarHBondContact O-CB 3.49Å; T83-S87 PolarHBondContact O-N 2.98Å; E84-S87 WeakPolarHBondContact O-CB 3.05Å; E84-S87 PolarHBondContact O-N 2.93Å; E84-S87 VanDerWaalsContact O-N 3.13Å; L85-S87 VanDerWaalsContact C-N 3.33Å; L85-S87 PolarHBondContact O-N 2.94Å; S87-I89 PolarHBondContact O-N 2.78Å; S87-A90 PolarHBondContact O-N 3.15Å; S87-E91 PolarHBondContact O-N 3.34Å
88	V	97.2	Very high	93.6	Very high	76 Å²	76	104.1 Å²	104.1	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-43.2	174.7	171.9	0	0	0	0	111.3	E84 L85 A90 E91 L92	E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.14Å; L85-V88 PolarHBondContact O-N 3.39Å; V88-A90 VanDerWaalsContact C-N 3.34Å; V88-A90 PolarHBondContact O-N 2.71Å; V88-E91 PolarHBondContact O-N 3.4Å; V88-L92 HydrophobicContact CG1-CD1 3.88Å; V88-L92 HydrophobicContact CG1-CG 4.32Å; V88-L92 WeakPolarHBondContact O-CB 3.23Å; V88-L92 VanDerWaalsContact O-CG 3.26Å; V88-L92 WeakPolarHBondContact O-CG 3.45Å; V88-L92 PolarHBondContact O-N 3.11Å
89	I	93	Very high	93.1	Very high	88 Å²	88	101.2 Å²	101.2	45%	0.451	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-42.3	174.7	-70.3	162.9	0	0	0	110.8	L85 H86 S87 L92 N93	L85-I89 WeakPolarHBondContact O-CB 3.46Å; L85-I89 WeakPolarHBondContact O-CD1 3.36Å; L85-I89 WeakPolarHBondContact O-CG1 3.39Å; L85-I89 PolarHBondContact O-N 2.93Å; H86-I89 PolarHBondContact O-N 2.93Å; S87-I89 PolarHBondContact O-N 2.78Å; I89-L92 PolarHBondContact O-N 3.06Å; I89-N93 WeakPolarHBondContact O-CB 3.43Å; I89-N93 PolarHBondContact O-N 3.42Å; I89-N93 PolarHBondContact O-ND2 3.06Å
90	A	92.8	Very high	92.4	Very high	57 Å²	57	101.4 Å²	101.4	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-37.6	177.2	0	0	0	0	0	112.7	H86 S87 V88 K94	H86-A90 WeakPolarHBondContact O-CB 3.39Å; H86-A90 PolarHBondContact O-N 3.26Å; S87-A90 PolarHBondContact O-N 3.15Å; V88-A90 VanDerWaalsContact C-N 3.34Å; V88-A90 PolarHBondContact O-N 2.71Å; A90-K94 WeakPolarHBondContact O-CB 3.44Å; A90-K94 PolarHBondContact O-N 3.08Å
91	E	93.6	Very high	91.5	Very high	131 Å²	131	97.6 Å²	97.6	61%	0.612	50%	0.498	S	S	*	.	H	α-helix	trans	-71.4	-39.1	175	-178.1	161.8	-141.3	0	0	112.4	S87 V88 K94 K95	S87-E91 PolarHBondContact O-N 3.34Å; V88-E91 PolarHBondContact O-N 3.4Å; E91-K94 CarbonylContact O-C 3.54Å; E91-K94 PolarHBondContact O-N 2.85Å; E91-K95 WeakPolarHBondContact O-CB 3.46Å; E91-K95 PolarHBondContact O-N 3.34Å
92	L	93.6	Very high	90.2	Very high	96 Å²	96	93.6 Å²	93.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-63.9	-45.7	173.4	-72.8	172.7	0	0	0	111.5	V88 I89 K95 I96	V88-L92 HydrophobicContact CG1-CD1 3.88Å; V88-L92 HydrophobicContact CG1-CG 4.32Å; V88-L92 WeakPolarHBondContact O-CB 3.23Å; V88-L92 VanDerWaalsContact O-CG 3.26Å; V88-L92 WeakPolarHBondContact O-CG 3.45Å; V88-L92 PolarHBondContact O-N 3.11Å; I89-L92 PolarHBondContact O-N 3.06Å; L92-K95 CarbonylContact O-C 3.59Å; L92-K95 WeakPolarHBondContact O-CA 3.49Å; L92-K95 WeakPolarHBondContact O-CB 3.47Å; L92-K95 PolarHBondContact O-N 3.15Å; L92-I96 WeakPolarHBondContact O-CG1 3.45Å; L92-I96 PolarHBondContact O-N 3.02Å
93	N	89	Confident	88.6	Confident	80 Å²	80	93.1 Å²	93.1	43%	0.428	49%	0.491	S	S	.	.	H	α-helix	trans	-59	-48.9	173.1	-71	-14.5	0	0	0	110.5	I89 K95 I96 D97	I89-N93 WeakPolarHBondContact O-CB 3.43Å; I89-N93 PolarHBondContact O-N 3.42Å; I89-N93 PolarHBondContact O-ND2 3.06Å; N93-K95 PolarHBondContact O-N 2.72Å; N93-K95 VanDerWaalsContact O-N 3.11Å; N93-I96 CarbonylContact O-C 3.53Å; N93-I96 WeakPolarHBondContact O-CA 3.42Å; N93-I96 WeakPolarHBondContact O-CB 3.43Å; N93-I96 PolarHBondContact O-N 3.44Å; N93-D97 PolarHBondContact O-N 3.1Å
94	K	93.9	Very high	86.7	Confident	119 Å²	119	93 Å²	93	52%	0.517	49%	0.486	S	S	.	.	H	α-helix	trans	-60.9	-24	175.3	-170.7	172.1	-173.6	171.7	0	113.4	A90 E91 R98	A90-K94 WeakPolarHBondContact O-CB 3.44Å; A90-K94 PolarHBondContact O-N 3.08Å; E91-K94 CarbonylContact O-C 3.54Å; E91-K94 PolarHBondContact O-N 2.85Å; K94-R98 VanDerWaalsContact O-CB 3.32Å; K94-R98 WeakPolarHBondContact O-CB 3.41Å; K94-R98 VanDerWaalsContact O-CD 3.28Å; K94-R98 WeakPolarHBondContact O-CD 3.49Å; K94-R98 WeakPolarHBondContact O-CG 3.49Å; K94-R98 PolarHBondContact O-N 3.38Å; K94-R98 VanDerWaalsContact O-N 3.11Å
95	K	94.8	Very high	84.8	Confident	131 Å²	131	93.3 Å²	93.3	57%	0.57	48%	0.483	S	S	*	.	H	α-helix	trans	-78.5	-36.9	172.2	-167.1	176.1	-178.7	-179.7	0	111.6	E91 L92 N93 L99	E91-K95 WeakPolarHBondContact O-CB 3.46Å; E91-K95 PolarHBondContact O-N 3.34Å; L92-K95 CarbonylContact O-C 3.59Å; L92-K95 WeakPolarHBondContact O-CA 3.49Å; L92-K95 WeakPolarHBondContact O-CB 3.47Å; L92-K95 PolarHBondContact O-N 3.15Å; N93-K95 PolarHBondContact O-N 2.72Å; N93-K95 VanDerWaalsContact O-N 3.11Å; K95-L99 VanDerWaalsContact O-CG 3.27Å; K95-L99 WeakPolarHBondContact O-CG 3.48Å; K95-L99 PolarHBondContact O-N 3.4Å
96	I	91.1	Very high	82.8	Confident	81 Å²	81	94 Å²	94	42%	0.415	48%	0.484	S	S	.	.	H	α-helix	trans	-64.4	-50.4	170.5	-65.7	162.8	0	0	0	110	L92 N93 R98 L99 Q100	L92-I96 WeakPolarHBondContact O-CG1 3.45Å; L92-I96 PolarHBondContact O-N 3.02Å; N93-I96 CarbonylContact O-C 3.53Å; N93-I96 WeakPolarHBondContact O-CA 3.42Å; N93-I96 WeakPolarHBondContact O-CB 3.43Å; N93-I96 PolarHBondContact O-N 3.44Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 PolarHBondContact O-N 3.23Å; I96-L99 PolarHBondContact O-N 3.25Å; I96-Q100 HydrophobicContact CG2-CG 4.41Å; I96-Q100 WeakPolarHBondContact O-CG 3.32Å; I96-Q100 PolarHBondContact O-N 2.61Å
97	D	90.6	Very high	81	Confident	98 Å²	98	94.1 Å²	94.1	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-57.7	-38.4	176.7	-57	-29	0	0	0	111.7	N93 G101	N93-D97 PolarHBondContact O-N 3.1Å; D97-G101 WeakPolarHBondContact O-CA 3.24Å; D97-G101 PolarHBondContact O-N 2.87Å
98	R	87.9	Confident	79.1	Confident	140 Å²	140	94.8 Å²	94.8	53%	0.528	48%	0.482	S	S	.	.	H	α-helix	trans	-66.7	-44.1	173.3	-82.5	166.6	176.8	151.8	-11.8	112.4	K94 I96 G101 T102	K94-R98 VanDerWaalsContact O-CB 3.32Å; K94-R98 WeakPolarHBondContact O-CB 3.41Å; K94-R98 VanDerWaalsContact O-CD 3.28Å; K94-R98 WeakPolarHBondContact O-CD 3.49Å; K94-R98 WeakPolarHBondContact O-CG 3.49Å; K94-R98 PolarHBondContact O-N 3.38Å; K94-R98 VanDerWaalsContact O-N 3.11Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 PolarHBondContact O-N 3.23Å; R98-G101 CarbonylContact O-C 3.57Å; R98-G101 PolarHBondContact O-N 2.84Å; R98-T102 PolarHBondContact O-N 2.94Å; R98-T102 PolarHBondContact O-OG1 3.22Å
99	L	83.5	Confident	77	Confident	105 Å²	105	95.3 Å²	95.3	55%	0.55	48%	0.48	S	S	.	.	H	α-helix	trans	-65	-46	179.6	-74.9	165.8	0	0	0	110.7	K95 I96 G101 T102 T103	K95-L99 VanDerWaalsContact O-CG 3.27Å; K95-L99 WeakPolarHBondContact O-CG 3.48Å; K95-L99 PolarHBondContact O-N 3.4Å; I96-L99 PolarHBondContact O-N 3.25Å; L99-G101 VanDerWaalsContact C-N 3.35Å; L99-T102 WeakPolarHBondContact CA-OG1 3.48Å; L99-T102 PolarHBondContact O-N 2.9Å; L99-T102 PolarHBondContact O-OG1 3.4Å; L99-T103 PolarHBondContact O-N 2.8Å; L99-T103 PolarHBondContact O-OG1 3.16Å; L99-T103 VanDerWaalsContact O-OG1 3.08Å
100	Q	79.1	Confident	74.9	Confident	112 Å²	112	99.9 Å²	99.9	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-43.8	172.3	-68.8	176.3	-7.3	0	0	111.2	I96 T102 T103 I104	I96-Q100 HydrophobicContact CG2-CG 4.41Å; I96-Q100 WeakPolarHBondContact O-CG 3.32Å; I96-Q100 PolarHBondContact O-N 2.61Å; Q100-T102 PolarHBondContact O-N 2.85Å; Q100-T103 PolarHBondContact O-N 2.86Å; Q100-I104 WeakPolarHBondContact O-CB 3.39Å; Q100-I104 VanDerWaalsContact O-CG1 3.26Å; Q100-I104 WeakPolarHBondContact O-CG1 3.33Å; Q100-I104 PolarHBondContact O-N 3.48Å
101	G	75.6	Confident	73	Confident	36 Å²	36	100 Å²	100	37%	0.371	49%	0.489	S	S	.	.	H	α-helix	trans	-66.6	-31	176.6	0	0	0	0	0	114.5	D97 R98 L99 R105	D97-G101 WeakPolarHBondContact O-CA 3.24Å; D97-G101 PolarHBondContact O-N 2.87Å; R98-G101 CarbonylContact O-C 3.57Å; R98-G101 PolarHBondContact O-N 2.84Å; L99-G101 VanDerWaalsContact C-N 3.35Å; G101-R105 WeakPolarHBondContact O-CB 3.29Å; G101-R105 PolarHBondContact O-N 2.88Å
102	T	68.2	Low	70.9	Confident	56 Å²	56	100.3 Å²	100.3	34%	0.344	49%	0.491	S	S	.	.	H	α-helix	trans	-72.2	-40.9	170.6	42.7	0	0	0	0	111.5	R98 L99 Q100 R105 E106	R98-T102 PolarHBondContact O-N 2.94Å; R98-T102 PolarHBondContact O-OG1 3.22Å; L99-T102 WeakPolarHBondContact CA-OG1 3.48Å; L99-T102 PolarHBondContact O-N 2.9Å; L99-T102 PolarHBondContact O-OG1 3.4Å; Q100-T102 PolarHBondContact O-N 2.85Å; T102-R105 PolarHBondContact O-N 3.39Å; T102-E106 WeakPolarHBondContact O-CB 3.32Å; T102-E106 VanDerWaalsContact O-CD 3.27Å; T102-E106 WeakPolarHBondContact O-CG 3.31Å; T102-E106 PolarHBondContact O-N 2.92Å
103	T	62.9	Low	68.8	Low	79 Å²	79	101.8 Å²	101.8	49%	0.485	50%	0.499	S	S	.	.	H	α-helix	trans	-60.1	-49.1	173.2	-57.9	0	0	0	0	111.2	L99 Q100 E106 E107	L99-T103 PolarHBondContact O-N 2.8Å; L99-T103 PolarHBondContact O-OG1 3.16Å; L99-T103 VanDerWaalsContact O-OG1 3.08Å; Q100-T103 PolarHBondContact O-N 2.86Å; T103-E106 PolarHBondContact O-N 2.91Å; T103-E107 PolarHBondContact O-N 3.07Å
104	I	56.3	Low	67	Low	90 Å²	90	107 Å²	107	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-43.3	178.4	-66.7	162.5	0	0	0	111	Q100 E106 E107 D108	Q100-I104 WeakPolarHBondContact O-CB 3.39Å; Q100-I104 VanDerWaalsContact O-CG1 3.26Å; Q100-I104 WeakPolarHBondContact O-CG1 3.33Å; Q100-I104 PolarHBondContact O-N 3.48Å; I104-E106 VanDerWaalsContact C-N 3.29Å; I104-E106 PolarHBondContact O-N 3.49Å; I104-E107 CarbonylContact O-C 3.47Å; I104-E107 PolarHBondContact O-N 3.28Å; I104-D108 WeakPolarHBondContact O-CB 3.46Å; I104-D108 PolarHBondContact O-N 2.76Å
105	R	55.1	Low	64.9	Low	105 Å²	105	104.5 Å²	104.5	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-34.7	175.3	-176.7	-163.3	62.4	86	15.5	112.2	G101 T102 D108 E109	G101-R105 WeakPolarHBondContact O-CB 3.29Å; G101-R105 PolarHBondContact O-N 2.88Å; T102-R105 PolarHBondContact O-N 3.39Å; R105-D108 PolarHBondContact O-N 3.32Å; R105-E109 HydrophobicContact CG-CG 4.41Å; R105-E109 WeakPolarHBondContact CG-OE1 3.42Å; R105-E109 IonicContact CZ-OE1 3.71Å; R105-E109 IonicContact CZ-OE2 3.82Å; R105-E109 IonicContact NE-OE1 3.89Å; R105-E109 IonicContact NH1-OE1 3.75Å; R105-E109 PolarHBondContact NH1-OE1 2.6Å; R105-E109 IonicContact NH1-OE2 3.47Å; R105-E109 PolarHBondContact NH1-OE2 3.37Å; R105-E109 WeakPolarHBondContact O-CB 3.42Å; R105-E109 WeakPolarHBondContact O-CG 3.49Å; R105-E109 PolarHBondContact O-N 3.32Å
106	E	54.7	Low	62.5	Low	95 Å²	95	105.4 Å²	105.4	44%	0.444	52%	0.516	S	S	.	.	H	α-helix	trans	-71.5	-34.9	175	-78.4	151.1	-141.1	0	0	111.5	T102 T103 I104 Y110	T102-E106 WeakPolarHBondContact O-CB 3.32Å; T102-E106 VanDerWaalsContact O-CD 3.27Å; T102-E106 WeakPolarHBondContact O-CG 3.31Å; T102-E106 PolarHBondContact O-N 2.92Å; T103-E106 PolarHBondContact O-N 2.91Å; I104-E106 VanDerWaalsContact C-N 3.29Å; I104-E106 PolarHBondContact O-N 3.49Å; E106-Y110 WeakPolarHBondContact O-CB 3.25Å; E106-Y110 WeakPolarHBondContact O-CD2 3.49Å; E106-Y110 PolarHBondContact O-N 2.99Å; E106-Y110 VanDerWaalsContact O-N 3.12Å
107	E	54.4	Low	60.3	Low	123 Å²	123	107.2 Å²	107.2	58%	0.575	53%	0.526	S	S	*	.	H	α-helix	trans	-66.9	-39	168.1	-69.7	-176.2	120.9	0	0	112.6	T103 I104 S111	T103-E107 PolarHBondContact O-N 3.07Å; I104-E107 CarbonylContact O-C 3.47Å; I104-E107 PolarHBondContact O-N 3.28Å; E107-S111 VanDerWaalsContact O-CB 3.26Å; E107-S111 WeakPolarHBondContact O-CB 3.46Å; E107-S111 PolarHBondContact O-N 3.41Å; E107-S111 PolarHBondContact O-OG 3.49Å
108	D	54.4	Low	58.3	Low	92 Å²	92	106.3 Å²	106.3	49%	0.492	53%	0.527	S	S	.	.	H	α-helix	trans	-68.8	-44.8	177.3	-77.1	-30.8	0	0	0	111.6	I104 R105 Y110 S111 E112	I104-D108 WeakPolarHBondContact O-CB 3.46Å; I104-D108 PolarHBondContact O-N 2.76Å; R105-D108 PolarHBondContact O-N 3.32Å; D108-Y110 VanDerWaalsContact C-N 3.32Å; D108-Y110 PolarHBondContact O-N 3.03Å; D108-S111 CarbonylContact O-C 3.59Å; D108-S111 WeakPolarHBondContact O-CA 3.28Å; D108-S111 WeakPolarHBondContact O-CB 3.44Å; D108-S111 PolarHBondContact O-N 2.95Å; D108-E112 PolarHBondContact O-N 3.06Å
109	E	52.9	Low	55.9	Low	88 Å²	88	108 Å²	108	41%	0.411	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-34.9	176.4	-76.3	170.8	-170.4	0	0	111.5	R105 S111 L113	R105-E109 HydrophobicContact CG-CG 4.41Å; R105-E109 WeakPolarHBondContact CG-OE1 3.42Å; R105-E109 IonicContact CZ-OE1 3.71Å; R105-E109 IonicContact CZ-OE2 3.82Å; R105-E109 IonicContact NE-OE1 3.89Å; R105-E109 IonicContact NH1-OE1 3.75Å; R105-E109 PolarHBondContact NH1-OE1 2.6Å; R105-E109 IonicContact NH1-OE2 3.47Å; R105-E109 PolarHBondContact NH1-OE2 3.37Å; R105-E109 WeakPolarHBondContact O-CB 3.42Å; R105-E109 WeakPolarHBondContact O-CG 3.49Å; R105-E109 PolarHBondContact O-N 3.32Å; E109-S111 VanDerWaalsContact C-N 3.31Å; E109-L113 PolarHBondContact O-N 2.62Å
110	Y	47.7	Very low	53.8	Low	184 Å²	184	107 Å²	107	72%	0.722	54%	0.543	S	S	*	.	H	α-helix	trans	-68	-28	167.5	-97.4	-97.2	0	0	0	113.2	E106 D108 R114	E106-Y110 WeakPolarHBondContact O-CB 3.25Å; E106-Y110 WeakPolarHBondContact O-CD2 3.49Å; E106-Y110 PolarHBondContact O-N 2.99Å; E106-Y110 VanDerWaalsContact O-N 3.12Å; D108-Y110 VanDerWaalsContact C-N 3.32Å; D108-Y110 PolarHBondContact O-N 3.03Å; Y110-R114 WeakPolarHBondContact O-CB 3.49Å; Y110-R114 PolarHBondContact O-N 3.31Å
111	S	53.4	Low	52	Low	58 Å²	58	109.1 Å²	109.1	41%	0.406	55%	0.553	S	S	.	*	H	α-helix	trans	-83.7	-33.6	-179.2	-63.7	0	0	0	0	113	E107 D108 E109 R114 S115	E107-S111 VanDerWaalsContact O-CB 3.26Å; E107-S111 WeakPolarHBondContact O-CB 3.46Å; E107-S111 PolarHBondContact O-N 3.41Å; E107-S111 PolarHBondContact O-OG 3.49Å; D108-S111 CarbonylContact O-C 3.59Å; D108-S111 WeakPolarHBondContact O-CA 3.28Å; D108-S111 WeakPolarHBondContact O-CB 3.44Å; D108-S111 PolarHBondContact O-N 2.95Å; E109-S111 VanDerWaalsContact C-N 3.31Å; S111-R114 PolarHBondContact O-N 3.46Å; S111-S115 VanDerWaalsContact O-CB 3.29Å; S111-S115 WeakPolarHBondContact O-CB 3.24Å; S111-S115 PolarHBondContact O-N 3.45Å; S111-S115 PolarHBondContact O-OG 2.9Å
112	E	50.5	Low	50.2	Low	139 Å²	139	115.6 Å²	115.6	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-66.8	-47	169.7	-74.7	-163.7	134.8	0	0	110.7	D108 R114 S115 E116	D108-E112 PolarHBondContact O-N 3.06Å; E112-R114 PolarHBondContact O-N 3.46Å; E112-S115 CarbonylContact O-C 3.58Å; E112-S115 WeakPolarHBondContact O-CA 3.41Å; E112-S115 PolarHBondContact O-N 3.41Å; E112-E116 PolarHBondContact O-N 3.46Å
113	L	49.6	Very low	49	Very low	127 Å²	127	121.5 Å²	121.5	67%	0.665	60%	0.597	S	S	*	*	H	α-helix	trans	-57.3	-37.5	173	-101.1	69.8	0	0	0	112.5	E109 S115 L117	E109-L113 PolarHBondContact O-N 2.62Å; L113-S115 VanDerWaalsContact C-N 3.35Å; L113-L117 WeakPolarHBondContact O-CB 3.28Å; L113-L117 PolarHBondContact O-N 3.21Å
114	R	50.5	Low	47.6	Very low	190 Å²	190	123.4 Å²	123.4	72%	0.717	61%	0.608	S	S	*	*	H	α-helix	trans	-70	-31.5	174.1	-171.6	-178.6	-69.2	-141.8	1.4	112.2	Y110 S111 E112 S118	Y110-R114 WeakPolarHBondContact O-CB 3.49Å; Y110-R114 PolarHBondContact O-N 3.31Å; S111-R114 PolarHBondContact O-N 3.46Å; E112-R114 PolarHBondContact O-N 3.46Å; R114-S118 WeakPolarHBondContact O-CB 3.15Å; R114-S118 PolarHBondContact O-N 2.9Å; R114-S118 VanDerWaalsContact O-N 3.08Å
115	S	49.6	Very low	46.6	Very low	65 Å²	65	125.6 Å²	125.6	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-80.4	-40.7	-177.7	-62.2	0	0	0	0	113	S111 E112 L113 L117 S118 Q119	S111-S115 VanDerWaalsContact O-CB 3.29Å; S111-S115 WeakPolarHBondContact O-CB 3.24Å; S111-S115 PolarHBondContact O-N 3.45Å; S111-S115 PolarHBondContact O-OG 2.9Å; E112-S115 CarbonylContact O-C 3.58Å; E112-S115 WeakPolarHBondContact O-CA 3.41Å; E112-S115 PolarHBondContact O-N 3.41Å; L113-S115 VanDerWaalsContact C-N 3.35Å; S115-L117 VanDerWaalsContact C-N 3.28Å; S115-L117 PolarHBondContact O-N 2.89Å; S115-S118 WeakPolarHBondContact O-CB 3.16Å; S115-S118 PolarHBondContact O-N 3.09Å; S115-S118 VanDerWaalsContact O-N 3.14Å; S115-Q119 PolarHBondContact O-N 3.01Å
116	E	44.5	Very low	45.8	Very low	151 Å²	151	127.9 Å²	127.9	71%	0.706	64%	0.636	S	S	*	*	H	α-helix	trans	-60	-40.6	171.5	-69.5	-163.6	146.1	0	0	111.1	E112	E112-E116 PolarHBondContact O-N 3.46Å
117	L	45.1	Very low	44.8	Very low	119 Å²	119	129.3 Å²	129.3	62%	0.623	65%	0.647	S	S	*	*	H	α-helix	trans	-63.4	-42.5	173.3	-173.7	62.3	0	0	0	111.8	L113 S115 S120	L113-L117 WeakPolarHBondContact O-CB 3.28Å; L113-L117 PolarHBondContact O-N 3.21Å; S115-L117 VanDerWaalsContact C-N 3.28Å; S115-L117 PolarHBondContact O-N 2.89Å; L117-S120 PolarHBondContact O-N 2.96Å; L117-S120 PolarHBondContact O-OG 3.43Å
118	S	48.9	Very low	43.8	Very low	79 Å²	79	128.6 Å²	128.6	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-66.1	-38.2	-178.6	-167.4	0	0	0	0	113.5	R114 S115 S120 Q121	R114-S118 WeakPolarHBondContact O-CB 3.15Å; R114-S118 PolarHBondContact O-N 2.9Å; R114-S118 VanDerWaalsContact O-N 3.08Å; S115-S118 WeakPolarHBondContact O-CB 3.16Å; S115-S118 PolarHBondContact O-N 3.09Å; S115-S118 VanDerWaalsContact O-N 3.14Å; S118-S120 PolarHBondContact O-N 3.3Å; S118-S120 VanDerWaalsContact O-N 3.1Å; S118-Q121 PolarHBondContact O-N 2.89Å
119	Q	36.8	Very low	42.9	Very low	174 Å²	174	135.3 Å²	135.3	81%	0.813	67%	0.674	S	S	*	*	H	α-helix	trans	-64.2	-15.9	177.9	-74.2	-172.2	2.4	0	0	113.8	S115 Q121	S115-Q119 PolarHBondContact O-N 3.01Å; Q119-Q121 VanDerWaalsContact C-N 3.32Å
120	S	39.4	Very low	41.8	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-7.1	173.7	75.7	0	0	0	0	114.8	L117 S118	L117-S120 PolarHBondContact O-N 2.96Å; L117-S120 PolarHBondContact O-OG 3.43Å; S118-S120 PolarHBondContact O-N 3.3Å; S118-S120 VanDerWaalsContact O-N 3.1Å
121	Q	42.3	Very low	41.3	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	23.8	-169.7	-62.6	-164	-12	0	0	115.3	S118 Q119	S118-Q121 PolarHBondContact O-N 2.89Å; Q119-Q121 VanDerWaalsContact C-N 3.32Å
122	H	37.1	Very low	40.4	Very low	173 Å²	173	139.5 Å²	139.5	80%	0.801	71%	0.713	S	S	*	*			trans	-136	51.9	177.6	-133.4	54.2	0	0	0	116.2
123	E	42.3	Very low	39.5	Very low	179 Å²	179	139.9 Å²	139.9	84%	0.836	72%	0.715	S	S	*	*			trans	-83.1	162.9	139.9	-68.7	-165.2	154.8	0	0	109.8
124	V	35.1	Very low	38.6	Very low	119 Å²	119	140.1 Å²	140.1	72%	0.721	72%	0.717	S	S	*	*			trans	85.3	85.3	171.1	-166.8	0	0	0	0	117.6
125	N	33.9	Very low	37.9	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	72%	0.718	S	S	*	*				96.5	112.1	127.9	-77.7	34.1	0	0	0	124.5
126	E	39.6	Very low	36.9	Very low	153 Å²	153	141.6 Å²	141.6	72%	0.715	73%	0.733	S	S	*	*				84.3	101	118.9	-62.7	-75	120.6	0	0	121.6
127	D	32.6	Very low	36.4	Very low	125 Å²	125	139.4 Å²	139.4	67%	0.668	74%	0.735	S	S	*	*				50.8	115.9	116.6	-89.6	44.9	0	0	0	122.2
128	S	34.6	Very low	35.7	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	75%	0.745	S	S	*	*				-169.7	108.9	99.3	-82.7	0	0	0	0	115.6
129	R	33.9	Very low	34.8	Very low	233 Å²	233	142.1 Å²	142.1	88%	0.879	76%	0.758	S	S	*	*			trans	46.8	121.8	138.6	-57.1	177.2	179.6	-175.5	-1.3	121.5
130	S	30.5	Very low	34.6	Very low	121 Å²	121	141.6 Å²	141.6	85%	0.846	76%	0.759	S	S	*	*				-151	163.8	101.4	65.8	0	0	0	0	110.7
131	M	37.8	Very low	35.3	Very low	156 Å²	156	142.6 Å²	142.6	77%	0.768	76%	0.764	S	S	*	*			trans	-104.3	174.6	-175.5	-69.6	-167.3	68.9	0	0	113.3
132	D	33.1	Very low	34.7	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	77%	0.772	S	S	*	*			trans	113.4	99.7	159.6	-56.6	-8.2	0	0	0	112.1
133	Q	32.8	Very low	34.5	Very low	147 Å²	147	142.8 Å²	142.8	69%	0.687	77%	0.769	S	S	*	*				66.7	113.9	56.1	-166.4	175.9	-20.9	0	0	110.5
134	D	31.1	Very low	34	Very low	132 Å²	132	143.1 Å²	143.1	71%	0.706	77%	0.771	S	S	*	*				-151.1	-177.7	57	-133.7	-36.1	0	0	0	116.3
135	Q	35.7	Very low	33.7	Very low	159 Å²	159	142.3 Å²	142.3	74%	0.743	77%	0.771	S	S	*	*			trans	-105.6	-176.1	-177	-57.4	-178.5	3.9	0	0	113.3
136	T	28.8	Very low	33.5	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	77%	0.771	S	S	*	*			trans	70.1	158.3	158.5	66.4	0	0	0	0	118.6
137	S	32.3	Very low	33	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	78%	0.776	S	S	*	*			cis	-165.4	164.6	-33	56	0	0	0	0	110.8
138	V	31.5	Very low	33.1	Very low	137 Å²	137	142.4 Å²	142.4	83%	0.83	78%	0.781	S	S	*	*			trans	-44.1	135.6	169	175.2	0	0	0	0	114.2
139	S	29.2	Very low	33.1	Very low	117 Å²	117	143.5 Å²	143.5	82%	0.818	78%	0.784	S	S	*	*			trans	-172	145.3	140.7	-83.8	0	0	0	0	114.5
140	I	33.3	Very low	33.7	Very low	163 Å²	163	136.1 Å²	136.1	84%	0.836	77%	0.772	S	S	*	*			trans	-151.6	154	174	-68.2	178	0	0	0	104.9
141	P	54.8	Low	34.5	Very low	107 Å²	107	137.4 Å²	137.4	70%	0.695	77%	0.77	S	S	*	*			cis	-121.2	-173.3	-11.6	38.1	-23.7	0	0	0	112.6
142	E	29.6	Very low	35.1	Very low	193 Å²	193	137.7 Å²	137.7	90%	0.902	77%	0.771	S	S	*	*			trans	-145.8	150.7	140.3	-147.5	164.4	-151.7	0	0	111.8
143	N	32.4	Very low	35.8	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	77%	0.767	S	S	*	*			trans	-122.4	137.2	-169.6	-93.1	-45.8	0	0	0	112
144	Q	30.9	Very low	36.7	Very low	186 Å²	186	136.5 Å²	136.5	87%	0.869	77%	0.769	S	S	*	*			trans	-161.3	111.4	149.6	-121	154.4	99.5	0	0	115.2
145	S	28.8	Very low	37.5	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	77%	0.768	S	S	*	*			trans	38	130.5	138.6	-160.2	0	0	0	0	118.9
146	T	30.3	Very low	38.5	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	75%	0.753	S	S	*	*				-179.2	161.2	67.3	-50.3	0	0	0	0	111
147	M	28.7	Very low	40.2	Very low	167 Å²	167	129.5 Å²	129.5	82%	0.823	74%	0.744	S	S	*	*			trans	79.4	138.4	168.3	-68	-143.7	66.5	0	0	118.5
148	V	36.2	Very low	42.1	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	74%	0.74	S	S	*	*			trans	-99.8	125.5	170.8	172.7	0	0	0	0	108.6
149	T	33.9	Very low	44	Very low	131 Å²	131	128.1 Å²	128.1	80%	0.804	72%	0.723	S	S	*	*			trans	-132	123.5	153.3	46.5	0	0	0	0	107
150	A	45.9	Very low	46.4	Very low	77 Å²	77	125.3 Å²	125.3	64%	0.636	70%	0.703	S	S	*	*			trans	-76.8	160.8	173.1	0	0	0	0	0	110.9
151	D	46.8	Very low	48.6	Very low	149 Å²	149	121.4 Å²	121.4	80%	0.797	68%	0.681	S	S	*	*	S	Bend	trans	63.4	87.6	160.1	-49.7	-31.4	0	0	0	118
152	M	52.2	Low	49.7	Very low	162 Å²	162	121 Å²	121	80%	0.798	67%	0.673	S	S	*	*	S	Bend	trans	-157.9	-24.6	135.6	-157.1	52.7	61.3	0	0	115.3	N154	M152-N154 PolarHBondContact O-N 2.89Å
153	D	47.2	Very low	52.1	Low	123 Å²	123	117 Å²	117	66%	0.658	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	0.7	-162.7	-59.8	-44.3	0	0	0	117.4	C155 S156 D157	D153-C155 PolarHBondContact O-N 3.06Å; D153-S156 WeakPolarHBondContact CA-OG 3.42Å; D153-S156 PolarHBondContact O-N 2.97Å; D153-S156 PolarHBondContact O-OG 3.36Å; D153-D157 PolarHBondContact O-N 3.49Å
154	N	51.1	Low	54.6	Low	140 Å²	140	117.8 Å²	117.8	75%	0.749	65%	0.647	S	S	*	*	H	α-helix	trans	-67.2	-9.4	-177	-163.1	69	0	0	0	114.2	M152	M152-N154 PolarHBondContact O-N 2.89Å
155	C	48	Very low	57	Low	99 Å²	99	112.5 Å²	112.5	67%	0.669	63%	0.627	S	S	*	*	H	α-helix	trans	-90.5	-28.5	171.8	-66.7	0	0	0	0	113.2	D153 N159	D153-C155 PolarHBondContact O-N 3.06Å; C155-N159 WeakPolarHBondContact O-CB 3.33Å; C155-N159 PolarHBondContact O-N 3.15Å
156	S	56.2	Low	59.3	Low	61 Å²	61	111.6 Å²	111.6	43%	0.427	61%	0.614	S	S	.	*	H	α-helix	trans	-69.4	-42.9	176.8	12.6	0	0	0	0	111.6	D153 N159 S160	D153-S156 WeakPolarHBondContact CA-OG 3.42Å; D153-S156 PolarHBondContact O-N 2.97Å; D153-S156 PolarHBondContact O-OG 3.36Å; S156-N159 PolarHBondContact O-N 3.43Å; S156-S160 WeakPolarHBondContact O-CB 3.41Å; S156-S160 PolarHBondContact O-N 2.72Å
157	D	65.9	Low	61.7	Low	111 Å²	111	109.2 Å²	109.2	59%	0.594	60%	0.599	S	S	*	*	H	α-helix	trans	-63.2	-49.4	176.1	-81.8	-3.8	0	0	0	110.6	D153 N159 S160 E161	D153-D157 PolarHBondContact O-N 3.49Å; D157-N159 VanDerWaalsContact C-N 3.3Å; D157-N159 PolarHBondContact O-N 2.66Å; D157-S160 PolarHBondContact O-N 2.73Å; D157-S160 VanDerWaalsContact O-N 3.14Å; D157-S160 PolarHBondContact O-OG 3.46Å; D157-E161 WeakPolarHBondContact O-CB 3.41Å; D157-E161 PolarHBondContact O-N 3.07Å
158	L	71.9	Confident	64	Low	127 Å²	127	102.9 Å²	102.9	67%	0.665	58%	0.577	S	S	*	*	H	α-helix	trans	-59.6	-38.1	177.2	-175.7	63.2	0	0	0	112.7	E161 L162	L158-E161 PolarHBondContact O-N 2.97Å; L158-L162 WeakPolarHBondContact O-CB 3.38Å; L158-L162 PolarHBondContact O-N 3.38Å
159	N	70.9	Confident	65.8	Low	87 Å²	87	101.3 Å²	101.3	47%	0.465	56%	0.564	S	S	.	*	H	α-helix	trans	-70.4	-40.4	175.6	-176.5	83.1	0	0	0	112.1	C155 S156 D157 E161 L162 Q163	C155-N159 WeakPolarHBondContact O-CB 3.33Å; C155-N159 PolarHBondContact O-N 3.15Å; S156-N159 PolarHBondContact O-N 3.43Å; D157-N159 VanDerWaalsContact C-N 3.3Å; D157-N159 PolarHBondContact O-N 2.66Å; N159-E161 VanDerWaalsContact C-N 3.27Å; N159-E161 PolarHBondContact O-N 2.8Å; N159-L162 PolarHBondContact O-N 3.35Å; N159-Q163 PolarHBondContact ND2-OE1 3.43Å; N159-Q163 WeakPolarHBondContact O-CB 3.35Å; N159-Q163 PolarHBondContact O-N 3.24Å
160	S	79	Confident	67.8	Low	57 Å²	57	100.8 Å²	100.8	40%	0.399	55%	0.552	S	S	.	*	H	α-helix	trans	-64	-35.8	174.9	79.2	0	0	0	0	111.7	S156 D157 Q163 R164	S156-S160 WeakPolarHBondContact O-CB 3.41Å; S156-S160 PolarHBondContact O-N 2.72Å; D157-S160 PolarHBondContact O-N 2.73Å; D157-S160 VanDerWaalsContact O-N 3.14Å; D157-S160 PolarHBondContact O-OG 3.46Å; S160-Q163 WeakPolarHBondContact O-CB 3.35Å; S160-Q163 PolarHBondContact O-N 3.07Å; S160-R164 VanDerWaalsContact O-CB 3.25Å; S160-R164 WeakPolarHBondContact O-CB 3.28Å; S160-R164 PolarHBondContact O-N 2.97Å
161	E	79.3	Confident	68.9	Low	81 Å²	81	102.3 Å²	102.3	38%	0.379	55%	0.55	S	S	.	.	H	α-helix	trans	-68.1	-41.2	173.9	-135.3	72.2	-46.1	0	0	111.6	D157 L158 N159 R164 V165	D157-E161 WeakPolarHBondContact O-CB 3.41Å; D157-E161 PolarHBondContact O-N 3.07Å; L158-E161 PolarHBondContact O-N 2.97Å; N159-E161 VanDerWaalsContact C-N 3.27Å; N159-E161 PolarHBondContact O-N 2.8Å; E161-R164 VanDerWaalsContact CD-CZ 3.47Å; E161-R164 PolarHBondContact O-N 2.98Å; E161-R164 IonicContact OE1-CZ 2.94Å; E161-R164 IonicContact OE1-NE 3.47Å; E161-R164 PolarHBondContact OE1-NE 3.41Å; E161-R164 IonicContact OE1-NH2 3.81Å; E161-R164 PolarHBondContact OE1-NH2 3.01Å; E161-R164 IonicContact OE2-CZ 3.02Å; E161-R164 IonicContact OE2-NH2 3.88Å; E161-R164 PolarHBondContact OE2-NH2 2.75Å; E161-V165 WeakPolarHBondContact O-CB 3.3Å; E161-V165 VanDerWaalsContact O-CG2 3.28Å; E161-V165 WeakPolarHBondContact O-CG2 3.45Å; E161-V165 PolarHBondContact O-N 3.27Å
162	L	79.5	Confident	70	Confident	100 Å²	100	98.7 Å²	98.7	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-43.2	173.1	-167.1	72.7	0	0	0	111	L158 N159 R164 V165 L166	L158-L162 WeakPolarHBondContact O-CB 3.38Å; L158-L162 PolarHBondContact O-N 3.38Å; N159-L162 PolarHBondContact O-N 3.35Å; L162-R164 VanDerWaalsContact C-N 3.32Å; L162-R164 PolarHBondContact O-N 3.45Å; L162-V165 PolarHBondContact O-N 2.97Å; L162-L166 HydrophobicContact CG-CD1 4.12Å; L162-L166 WeakPolarHBondContact O-CB 3.23Å; L162-L166 VanDerWaalsContact O-CG 3.24Å; L162-L166 WeakPolarHBondContact O-CG 3.32Å; L162-L166 PolarHBondContact O-N 3.46Å
163	Q	79.1	Confident	70.5	Confident	108 Å²	108	94.9 Å²	94.9	51%	0.505	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-42.2	173.4	-128.7	92	42.3	0	0	111.4	N159 S160 T167	N159-Q163 PolarHBondContact ND2-OE1 3.43Å; N159-Q163 WeakPolarHBondContact O-CB 3.35Å; N159-Q163 PolarHBondContact O-N 3.24Å; S160-Q163 WeakPolarHBondContact O-CB 3.35Å; S160-Q163 PolarHBondContact O-N 3.07Å; Q163-T167 WeakPolarHBondContact O-CB 3.29Å; Q163-T167 PolarHBondContact O-N 3Å; Q163-T167 PolarHBondContact O-OG1 3.27Å
164	R	84.9	Confident	70.8	Confident	155 Å²	155	92.5 Å²	92.5	59%	0.585	51%	0.511	S	S	*	.	H	α-helix	trans	-71.4	-39.6	-179.4	178.7	162	63.3	98.8	-31.6	112.6	S160 E161 L162 G168	S160-R164 VanDerWaalsContact O-CB 3.25Å; S160-R164 WeakPolarHBondContact O-CB 3.28Å; S160-R164 PolarHBondContact O-N 2.97Å; E161-R164 VanDerWaalsContact CD-CZ 3.47Å; E161-R164 PolarHBondContact O-N 2.98Å; E161-R164 IonicContact OE1-CZ 2.94Å; E161-R164 IonicContact OE1-NE 3.47Å; E161-R164 PolarHBondContact OE1-NE 3.41Å; E161-R164 IonicContact OE1-NH2 3.81Å; E161-R164 PolarHBondContact OE1-NH2 3.01Å; E161-R164 IonicContact OE2-CZ 3.02Å; E161-R164 IonicContact OE2-NH2 3.88Å; E161-R164 PolarHBondContact OE2-NH2 2.75Å; L162-R164 VanDerWaalsContact C-N 3.32Å; L162-R164 PolarHBondContact O-N 3.45Å; R164-G168 PolarHBondContact O-N 2.95Å
165	V	80.4	Confident	70.8	Confident	76 Å²	76	87.8 Å²	87.8	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-71	-39.3	174.2	170.6	0	0	0	0	110.8	E161 L162 G168 L169	E161-V165 WeakPolarHBondContact O-CB 3.3Å; E161-V165 VanDerWaalsContact O-CG2 3.28Å; E161-V165 WeakPolarHBondContact O-CG2 3.45Å; E161-V165 PolarHBondContact O-N 3.27Å; L162-V165 PolarHBondContact O-N 2.97Å; V165-G168 PolarHBondContact O-N 3.11Å; V165-L169 HydrophobicContact CG1-CD1 3.96Å; V165-L169 HydrophobicContact CG1-CG 4.47Å; V165-L169 WeakPolarHBondContact O-CB 3.38Å; V165-L169 VanDerWaalsContact O-CG 3.3Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 3.47Å
166	L	79.1	Confident	70.9	Confident	83 Å²	83	90.9 Å²	90.9	44%	0.435	49%	0.493	S	S	.	.	H	α-helix	trans	-61.2	-50.2	170.7	-79	166.3	0	0	0	111.1	L162 G168 L169 E170	L162-L166 HydrophobicContact CG-CD1 4.12Å; L162-L166 WeakPolarHBondContact O-CB 3.23Å; L162-L166 VanDerWaalsContact O-CG 3.24Å; L162-L166 WeakPolarHBondContact O-CG 3.32Å; L162-L166 PolarHBondContact O-N 3.46Å; L166-G168 VanDerWaalsContact C-N 3.28Å; L166-G168 PolarHBondContact O-N 2.93Å; L166-L169 CarbonylContact O-C 3.56Å; L166-L169 PolarHBondContact O-N 2.95Å; L166-L169 VanDerWaalsContact O-N 3.14Å; L166-E170 WeakPolarHBondContact O-CB 3.48Å; L166-E170 WeakPolarHBondContact O-CG 3.35Å; L166-E170 PolarHBondContact O-N 3.09Å
167	T	80.4	Confident	70.1	Confident	70 Å²	70	95 Å²	95	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-60.9	-37.5	176.8	-53.7	0	0	0	0	111.4	Q163 N171	Q163-T167 WeakPolarHBondContact O-CB 3.29Å; Q163-T167 PolarHBondContact O-N 3Å; Q163-T167 PolarHBondContact O-OG1 3.27Å; T167-N171 WeakPolarHBondContact O-CB 3.29Å; T167-N171 PolarHBondContact O-N 2.91Å; T167-N171 PolarHBondContact O-ND2 3.39Å
168	G	75.9	Confident	69.2	Low	35 Å²	35	99 Å²	99	36%	0.361	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-45.1	173.4	0	0	0	0	0	112.6	R164 V165 L166 N171 V172	R164-G168 PolarHBondContact O-N 2.95Å; V165-G168 PolarHBondContact O-N 3.11Å; L166-G168 VanDerWaalsContact C-N 3.28Å; L166-G168 PolarHBondContact O-N 2.93Å; G168-N171 PolarHBondContact O-N 3.46Å; G168-V172 WeakPolarHBondContact O-CB 3.46Å; G168-V172 WeakPolarHBondContact O-CG2 3.27Å; G168-V172 PolarHBondContact O-N 3.13Å
169	L	73.5	Confident	68.1	Low	95 Å²	95	97.5 Å²	97.5	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-42	175.3	-76.6	167.6	0	0	0	111.9	V165 L166 N171 V172 V173	V165-L169 HydrophobicContact CG1-CD1 3.96Å; V165-L169 HydrophobicContact CG1-CG 4.47Å; V165-L169 WeakPolarHBondContact O-CB 3.38Å; V165-L169 VanDerWaalsContact O-CG 3.3Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 3.47Å; L166-L169 CarbonylContact O-C 3.56Å; L166-L169 PolarHBondContact O-N 2.95Å; L166-L169 VanDerWaalsContact O-N 3.14Å; L169-N171 VanDerWaalsContact C-N 3.34Å; L169-N171 PolarHBondContact O-N 2.97Å; L169-V172 CarbonylContact O-C 3.53Å; L169-V172 PolarHBondContact O-N 3.37Å; L169-V173 VanDerWaalsContact O-CB 3.24Å; L169-V173 WeakPolarHBondContact O-CB 3.21Å; L169-V173 WeakPolarHBondContact O-CG2 3.45Å; L169-V173 PolarHBondContact O-N 2.84Å
170	E	75.9	Confident	66.8	Low	120 Å²	120	97.3 Å²	97.3	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-39.5	175.2	-75.7	-177.8	155.1	0	0	111.4	L166 V173 C174	L166-E170 WeakPolarHBondContact O-CB 3.48Å; L166-E170 WeakPolarHBondContact O-CG 3.35Å; L166-E170 PolarHBondContact O-N 3.09Å; E170-V173 PolarHBondContact O-N 3.36Å; E170-C174 WeakPolarHBondContact O-CB 3.36Å; E170-C174 PolarHBondContact O-N 3.35Å; E170-C174 PolarHBondContact O-SG 3.01Å
171	N	69.7	Low	65	Low	110 Å²	110	99.8 Å²	99.8	59%	0.588	54%	0.537	S	S	*	.	H	α-helix	trans	-67.9	-40.3	172.8	-78.2	-53.2	0	0	0	112.5	T167 G168 L169 G175	T167-N171 WeakPolarHBondContact O-CB 3.29Å; T167-N171 PolarHBondContact O-N 2.91Å; T167-N171 PolarHBondContact O-ND2 3.39Å; G168-N171 PolarHBondContact O-N 3.46Å; L169-N171 VanDerWaalsContact C-N 3.34Å; L169-N171 PolarHBondContact O-N 2.97Å; N171-G175 PolarHBondContact O-N 3.32Å
172	V	69.3	Low	63.4	Low	72 Å²	72	100.5 Å²	100.5	44%	0.436	55%	0.551	S	S	.	*	H	α-helix	trans	-68.7	-32.8	175.5	165.7	0	0	0	0	112.3	G168 L169 R176	G168-V172 WeakPolarHBondContact O-CB 3.46Å; G168-V172 WeakPolarHBondContact O-CG2 3.27Å; G168-V172 PolarHBondContact O-N 3.13Å; L169-V172 CarbonylContact O-C 3.53Å; L169-V172 PolarHBondContact O-N 3.37Å; V172-R176 VanDerWaalsContact CG1-NH2 3.26Å; V172-R176 WeakPolarHBondContact O-CB 3.46Å; V172-R176 PolarHBondContact O-N 2.93Å
173	V	63	Low	62.2	Low	83 Å²	83	100.6 Å²	100.6	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-77.6	-41.4	175.7	168.1	0	0	0	0	110.7	L169 E170 G175 R176 K177	L169-V173 VanDerWaalsContact O-CB 3.24Å; L169-V173 WeakPolarHBondContact O-CB 3.21Å; L169-V173 WeakPolarHBondContact O-CG2 3.45Å; L169-V173 PolarHBondContact O-N 2.84Å; E170-V173 PolarHBondContact O-N 3.36Å; V173-G175 VanDerWaalsContact C-N 3.33Å; V173-R176 PolarHBondContact O-N 2.81Å; V173-K177 WeakPolarHBondContact O-CB 3.25Å; V173-K177 PolarHBondContact O-N 3.38Å
174	C	52.9	Low	61.5	Low	73 Å²	73	98.2 Å²	98.2	49%	0.493	55%	0.546	S	S	.	.	H	α-helix	trans	-65.4	-36.7	172.2	-71.2	0	0	0	0	111.7	E170 K177 K178	E170-C174 WeakPolarHBondContact O-CB 3.36Å; E170-C174 PolarHBondContact O-N 3.35Å; E170-C174 PolarHBondContact O-SG 3.01Å; C174-K177 PolarHBondContact O-N 2.92Å; C174-K178 PolarHBondContact O-N 3.36Å
175	G	51.6	Low	60.7	Low	41 Å²	41	96 Å²	96	42%	0.423	55%	0.55	S	S	.	*	H	α-helix	trans	-59.4	-54.8	170.1	0	0	0	0	0	111.6	N171 V173 K177 K178 S179	N171-G175 PolarHBondContact O-N 3.32Å; V173-G175 VanDerWaalsContact C-N 3.33Å; G175-K177 VanDerWaalsContact C-N 3.26Å; G175-K177 PolarHBondContact O-N 3.2Å; G175-K178 PolarHBondContact O-N 3.02Å; G175-K178 VanDerWaalsContact O-N 3.17Å; G175-S179 PolarHBondContact O-N 3.45Å; G175-S179 VanDerWaalsContact O-N 3.15Å; G175-S179 PolarHBondContact O-OG 3.4Å
176	R	50	Low	60.3	Low	164 Å²	164	95.8 Å²	95.8	62%	0.619	56%	0.556	S	S	*	*	H	α-helix	trans	-62.1	-29.2	175.4	-91	-174.7	-88.5	-168.1	-9.2	114	V172 V173 S179 S180	V172-R176 VanDerWaalsContact CG1-NH2 3.26Å; V172-R176 WeakPolarHBondContact O-CB 3.46Å; V172-R176 PolarHBondContact O-N 2.93Å; V173-R176 PolarHBondContact O-N 2.81Å; R176-S179 PolarHBondContact O-OG 3.11Å; R176-S180 WeakPolarHBondContact O-CB 3.5Å; R176-S180 PolarHBondContact O-N 3.31Å; R176-S180 PolarHBondContact O-OG 3.39Å
177	K	40.8	Very low	60.1	Low	147 Å²	147	96.9 Å²	96.9	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-81.4	-20.1	177.7	-166.1	172.3	-178.5	180	0	113.1	V173 C174 G175	V173-K177 WeakPolarHBondContact O-CB 3.25Å; V173-K177 PolarHBondContact O-N 3.38Å; C174-K177 PolarHBondContact O-N 2.92Å; G175-K177 VanDerWaalsContact C-N 3.26Å; G175-K177 PolarHBondContact O-N 3.2Å
178	K	46.5	Very low	59.8	Low	195 Å²	195	96.3 Å²	96.3	85%	0.848	56%	0.555	S	S	*	*	H	α-helix	trans	-80.3	-30.8	167.7	-80.4	-174.2	171.9	-174	0	112.9	C174 G175	C174-K178 PolarHBondContact O-N 3.36Å; G175-K178 PolarHBondContact O-N 3.02Å; G175-K178 VanDerWaalsContact O-N 3.17Å
179	S	47.8	Very low	59.9	Low	95 Å²	95	98.7 Å²	98.7	66%	0.664	56%	0.56	S	S	*	*	H	α-helix	trans	-83.3	-27.4	171.7	58	0	0	0	0	113.8	G175 R176 C181	G175-S179 PolarHBondContact O-N 3.45Å; G175-S179 VanDerWaalsContact O-N 3.15Å; G175-S179 PolarHBondContact O-OG 3.4Å; R176-S179 PolarHBondContact O-OG 3.11Å; S179-C181 PolarHBondContact O-N 3.1Å; S179-C181 VanDerWaalsContact O-N 3.13Å
180	S	44.1	Very low	60.3	Low	83 Å²	83	100 Å²	100	58%	0.58	56%	0.561	S	S	*	*	S	Bend	trans	-88.5	70.2	177.5	-53.1	0	0	0	0	112.5	R176	R176-S180 WeakPolarHBondContact O-CB 3.5Å; R176-S180 PolarHBondContact O-N 3.31Å; R176-S180 PolarHBondContact O-OG 3.39Å
181	C	42.2	Very low	60.6	Low	110 Å²	110	99 Å²	99	74%	0.743	56%	0.556	S	S	*	*	S	Bend	trans	24.2	93.8	163.9	-163.2	0	0	0	0	118	S179	S179-C181 PolarHBondContact O-N 3.1Å; S179-C181 VanDerWaalsContact O-N 3.13Å
182	S	44.5	Very low	61.2	Low	96 Å²	96	98 Å²	98	67%	0.671	55%	0.55	S	S	*	*			trans	-144	79.5	139.6	62.6	0	0	0	0	108.8	S184	S182-S184 PolarHBondContact O-N 3.4Å
183	L	54.7	Low	61.9	Low	102 Å²	102	101.1 Å²	101.1	53%	0.534	56%	0.56	S	S	.	*			trans	-54.4	132.7	167.8	-68.2	169.7	0	0	0	108.3	E187 V188	L183-E187 HydrophobicContact CB-CB 4.48Å; L183-E187 HydrophobicContact CD2-CB 4.31Å; L183-V188 HydrophobicContact CB-CG2 3.61Å; L183-V188 HydrophobicContact CD1-CG2 4.16Å
184	S	64.2	Low	62.9	Low	57 Å²	57	102.3 Å²	102.3	40%	0.399	56%	0.56	S	S	.	*			trans	-67.4	154.8	171.4	68.1	0	0	0	0	110	S182 A186 E187 V188	S182-S184 PolarHBondContact O-N 3.4Å; S184-A186 PolarHBondContact O-N 3.36Å; S184-E187 VanDerWaalsContact CB-OE2 3.24Å; S184-E187 WeakPolarHBondContact CB-OE2 3.31Å; S184-E187 PolarHBondContact N-OE2 3.02Å; S184-E187 WeakPolarHBondContact O-CA 3.29Å; S184-E187 WeakPolarHBondContact O-CB 3.45Å; S184-E187 PolarHBondContact O-N 2.68Å; S184-E187 VanDerWaalsContact OG-CD 3.24Å; S184-E187 WeakPolarHBondContact OG-CG 3.36Å; S184-E187 PolarHBondContact OG-N 3.44Å; S184-E187 PolarHBondContact OG-OE2 2.96Å; S184-V188 PolarHBondContact O-N 3.26Å
185	V	68.9	Low	64.2	Low	110 Å²	110	103.9 Å²	103.9	67%	0.667	56%	0.563	S	S	*	*	H	α-helix	trans	-55.1	-39.6	-177.8	-176.9	0	0	0	0	111.2	E187 V188 D189	V185-E187 VanDerWaalsContact C-N 3.34Å; V185-E187 PolarHBondContact O-N 3.13Å; V185-V188 WeakPolarHBondContact O-CB 3.46Å; V185-V188 PolarHBondContact O-N 3.27Å; V185-D189 WeakPolarHBondContact O-CB 3.46Å; V185-D189 PolarHBondContact O-N 3.05Å
186	A	71.6	Confident	65.7	Low	71 Å²	71	105.2 Å²	105.2	59%	0.587	56%	0.563	S	S	*	*	H	α-helix	trans	-67.6	-27.6	176.1	0	0	0	0	0	114.5	S184 K190	S184-A186 PolarHBondContact O-N 3.36Å; A186-K190 VanDerWaalsContact O-CB 3.26Å; A186-K190 WeakPolarHBondContact O-CB 3.48Å; A186-K190 PolarHBondContact O-N 2.84Å; A186-K190 VanDerWaalsContact O-N 3.1Å
187	E	75.5	Confident	67.5	Low	106 Å²	106	101.2 Å²	101.2	50%	0.495	56%	0.557	S	S	.	*	H	α-helix	trans	-76.2	-35.2	171.9	-70.8	160.8	136.3	0	0	111.1	L183 S184 V185 H191	L183-E187 HydrophobicContact CB-CB 4.48Å; L183-E187 HydrophobicContact CD2-CB 4.31Å; S184-E187 VanDerWaalsContact CB-OE2 3.24Å; S184-E187 WeakPolarHBondContact CB-OE2 3.31Å; S184-E187 PolarHBondContact N-OE2 3.02Å; S184-E187 WeakPolarHBondContact O-CA 3.29Å; S184-E187 WeakPolarHBondContact O-CB 3.45Å; S184-E187 PolarHBondContact O-N 2.68Å; S184-E187 VanDerWaalsContact OG-CD 3.24Å; S184-E187 WeakPolarHBondContact OG-CG 3.36Å; S184-E187 PolarHBondContact OG-N 3.44Å; S184-E187 PolarHBondContact OG-OE2 2.96Å; V185-E187 VanDerWaalsContact C-N 3.34Å; V185-E187 PolarHBondContact O-N 3.13Å; E187-H191 VanDerWaalsContact O-CB 3.32Å; E187-H191 WeakPolarHBondContact O-CB 3.15Å; E187-H191 PolarHBondContact O-N 3.41Å
188	V	74.1	Confident	69.3	Low	57 Å²	57	96.7 Å²	96.7	35%	0.345	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-48.9	171.9	178.5	0	0	0	0	110.8	L183 S184 V185 K190 H191 I192	L183-V188 HydrophobicContact CB-CG2 3.61Å; L183-V188 HydrophobicContact CD1-CG2 4.16Å; S184-V188 PolarHBondContact O-N 3.26Å; V185-V188 WeakPolarHBondContact O-CB 3.46Å; V185-V188 PolarHBondContact O-N 3.27Å; V188-K190 VanDerWaalsContact C-N 3.34Å; V188-K190 PolarHBondContact O-N 3.41Å; V188-H191 CarbonylContact O-C 3.59Å; V188-H191 PolarHBondContact O-N 3.32Å; V188-H191 VanDerWaalsContact O-N 3.08Å; V188-I192 HydrophobicContact CG1-CD1 3.88Å; V188-I192 HydrophobicContact CG1-CG1 4.48Å; V188-I192 WeakPolarHBondContact O-CG1 3.33Å; V188-I192 PolarHBondContact O-N 3Å
189	D	77.8	Confident	70.9	Confident	86 Å²	86	90.4 Å²	90.4	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-58.3	-45.8	178	-66.3	-27.4	0	0	0	110.9	V185 H191 I192 E193	V185-D189 WeakPolarHBondContact O-CB 3.46Å; V185-D189 PolarHBondContact O-N 3.05Å; D189-H191 VanDerWaalsContact C-N 3.34Å; D189-H191 PolarHBondContact O-N 2.92Å; D189-I192 WeakPolarHBondContact O-CB 3.38Å; D189-I192 PolarHBondContact O-N 3.02Å; D189-E193 PolarHBondContact O-N 3.46Å
190	K	81.8	Confident	72.7	Confident	123 Å²	123	91 Å²	91	54%	0.535	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-39.8	174.3	-176.7	-179.2	176.5	-174.1	0	112.4	A186 V188 I192 E193 Q194	A186-K190 VanDerWaalsContact O-CB 3.26Å; A186-K190 WeakPolarHBondContact O-CB 3.48Å; A186-K190 PolarHBondContact O-N 2.84Å; A186-K190 VanDerWaalsContact O-N 3.1Å; V188-K190 VanDerWaalsContact C-N 3.34Å; V188-K190 PolarHBondContact O-N 3.41Å; K190-I192 VanDerWaalsContact C-N 3.29Å; K190-I192 PolarHBondContact O-N 2.94Å; K190-E193 PolarHBondContact O-N 2.96Å; K190-Q194 WeakPolarHBondContact O-CB 3.21Å; K190-Q194 VanDerWaalsContact O-CG 3.3Å; K190-Q194 WeakPolarHBondContact O-CG 3.41Å; K190-Q194 PolarHBondContact O-N 2.89Å
191	H	80.8	Confident	74.6	Confident	98 Å²	98	93.8 Å²	93.8	45%	0.454	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-30.5	177.1	-158.2	-29.2	0	0	0	111.7	E187 V188 D189 L195	E187-H191 VanDerWaalsContact O-CB 3.32Å; E187-H191 WeakPolarHBondContact O-CB 3.15Å; E187-H191 PolarHBondContact O-N 3.41Å; V188-H191 CarbonylContact O-C 3.59Å; V188-H191 PolarHBondContact O-N 3.32Å; V188-H191 VanDerWaalsContact O-N 3.08Å; D189-H191 VanDerWaalsContact C-N 3.34Å; D189-H191 PolarHBondContact O-N 2.92Å; H191-L195 WeakPolarHBondContact O-CB 3.42Å; H191-L195 WeakPolarHBondContact O-CG 3.33Å; H191-L195 PolarHBondContact O-N 3.45Å
192	I	82.6	Confident	76.3	Confident	90 Å²	90	92.1 Å²	92.1	46%	0.462	51%	0.512	S	S	.	.	H	α-helix	trans	-68.9	-44.3	171.1	-69	165.3	0	0	0	110.7	V188 D189 K190 Q194 L195 T196	V188-I192 HydrophobicContact CG1-CD1 3.88Å; V188-I192 HydrophobicContact CG1-CG1 4.48Å; V188-I192 WeakPolarHBondContact O-CG1 3.33Å; V188-I192 PolarHBondContact O-N 3Å; D189-I192 WeakPolarHBondContact O-CB 3.38Å; D189-I192 PolarHBondContact O-N 3.02Å; K190-I192 VanDerWaalsContact C-N 3.29Å; K190-I192 PolarHBondContact O-N 2.94Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 2.9Å; I192-L195 PolarHBondContact O-N 3.37Å; I192-T196 WeakPolarHBondContact O-CB 3.46Å; I192-T196 PolarHBondContact O-N 3.45Å; I192-T196 PolarHBondContact O-OG1 3.3Å
193	E	85.1	Confident	78	Confident	137 Å²	137	91.9 Å²	91.9	64%	0.64	50%	0.503	S	S	*	.	H	α-helix	trans	-59.5	-41.2	172.9	-71.7	-175	150.6	0	0	111.7	D189 K190 T196 T197	D189-E193 PolarHBondContact O-N 3.46Å; K190-E193 PolarHBondContact O-N 2.96Å; E193-T196 PolarHBondContact O-N 3.04Å; E193-T197 WeakPolarHBondContact O-CB 3.33Å; E193-T197 WeakPolarHBondContact O-CG2 3.3Å; E193-T197 PolarHBondContact O-N 2.91Å; E193-T197 PolarHBondContact O-OG1 2.86Å
194	Q	83	Confident	79.5	Confident	107 Å²	107	92 Å²	92	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-40.1	176.3	-72.2	176.6	-53.6	0	0	112.5	K190 I192 T197 A198	K190-Q194 WeakPolarHBondContact O-CB 3.21Å; K190-Q194 VanDerWaalsContact O-CG 3.3Å; K190-Q194 WeakPolarHBondContact O-CG 3.41Å; K190-Q194 PolarHBondContact O-N 2.89Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 2.9Å; Q194-T197 PolarHBondContact O-OG1 3.44Å; Q194-A198 VanDerWaalsContact O-CB 3.22Å; Q194-A198 WeakPolarHBondContact O-CB 3.48Å; Q194-A198 PolarHBondContact O-N 3.21Å
195	L	81	Confident	80.2	Confident	107 Å²	107	91.6 Å²	91.6	56%	0.56	50%	0.504	S	S	*	.	H	α-helix	trans	-68.8	-35.4	173.6	-79.3	163	0	0	0	112.4	H191 I192 S199	H191-L195 WeakPolarHBondContact O-CB 3.42Å; H191-L195 WeakPolarHBondContact O-CG 3.33Å; H191-L195 PolarHBondContact O-N 3.45Å; I192-L195 PolarHBondContact O-N 3.37Å; L195-S199 WeakPolarHBondContact O-CB 3.3Å; L195-S199 PolarHBondContact O-N 3.26Å
196	T	83.3	Confident	80.7	Confident	68 Å²	68	90.9 Å²	90.9	42%	0.417	50%	0.495	S	S	.	.	H	α-helix	trans	-68.3	-49.8	178.4	-54.2	0	0	0	0	110.4	I192 E193 A198 S199 E200	I192-T196 WeakPolarHBondContact O-CB 3.46Å; I192-T196 PolarHBondContact O-N 3.45Å; I192-T196 PolarHBondContact O-OG1 3.3Å; E193-T196 PolarHBondContact O-N 3.04Å; T196-A198 VanDerWaalsContact C-N 3.31Å; T196-A198 PolarHBondContact O-N 2.86Å; T196-S199 WeakPolarHBondContact O-CB 3.45Å; T196-S199 PolarHBondContact O-N 3.23Å; T196-S199 VanDerWaalsContact O-N 3.11Å; T196-E200 WeakPolarHBondContact O-CG 3.39Å; T196-E200 PolarHBondContact O-N 2.88Å
197	T	86.3	Confident	81.2	Confident	81 Å²	81	93 Å²	93	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-30.3	176.6	49.3	0	0	0	0	112.9	E193 Q194 H201	E193-T197 WeakPolarHBondContact O-CB 3.33Å; E193-T197 WeakPolarHBondContact O-CG2 3.3Å; E193-T197 PolarHBondContact O-N 2.91Å; E193-T197 PolarHBondContact O-OG1 2.86Å; Q194-T197 PolarHBondContact O-OG1 3.44Å; T197-H201 WeakPolarHBondContact O-CB 3.4Å; T197-H201 PolarHBondContact O-N 3.37Å; T197-H201 VanDerWaalsContact O-N 3.11Å
198	A	78.8	Confident	81.3	Confident	51 Å²	51	91.4 Å²	91.4	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-42.4	168.7	0	0	0	0	0	112.1	Q194 T196 H201 C202	Q194-A198 VanDerWaalsContact O-CB 3.22Å; Q194-A198 WeakPolarHBondContact O-CB 3.48Å; Q194-A198 PolarHBondContact O-N 3.21Å; T196-A198 VanDerWaalsContact C-N 3.31Å; T196-A198 PolarHBondContact O-N 2.86Å; A198-H201 PolarHBondContact O-N 3.41Å; A198-C202 PolarHBondContact O-N 3.38Å; A198-C202 PolarHBondContact O-SG 2.94Å
199	S	79.9	Confident	81.4	Confident	63 Å²	63	92.5 Å²	92.5	44%	0.441	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-48	174.3	-166.9	0	0	0	0	111.4	L195 T196 H201 C202 D203	L195-S199 WeakPolarHBondContact O-CB 3.3Å; L195-S199 PolarHBondContact O-N 3.26Å; T196-S199 WeakPolarHBondContact O-CB 3.45Å; T196-S199 PolarHBondContact O-N 3.23Å; T196-S199 VanDerWaalsContact O-N 3.11Å; S199-H201 PolarHBondContact O-N 2.84Å; S199-C202 CarbonylContact O-C 3.6Å; S199-C202 WeakPolarHBondContact O-CA 3.38Å; S199-C202 WeakPolarHBondContact O-CB 3.49Å; S199-C202 PolarHBondContact O-N 2.91Å; S199-D203 PolarHBondContact O-N 3.48Å
200	E	87	Confident	81.2	Confident	109 Å²	109	92.7 Å²	92.7	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-56.8	-36.3	175.6	-70.2	173	170.1	0	0	112	T196 L204	T196-E200 WeakPolarHBondContact O-CG 3.39Å; T196-E200 PolarHBondContact O-N 2.88Å; E200-L204 WeakPolarHBondContact O-CB 3.46Å; E200-L204 WeakPolarHBondContact O-CD1 3.43Å; E200-L204 VanDerWaalsContact O-CG 3.29Å; E200-L204 WeakPolarHBondContact O-CG 3.31Å; E200-L204 PolarHBondContact O-N 2.89Å
201	H	83.8	Confident	81	Confident	140 Å²	140	92.1 Å²	92.1	65%	0.648	49%	0.493	S	S	*	.	H	α-helix	trans	-72.4	-37.9	175.6	-160	63.7	0	0	0	112.7	T197 A198 S199 L204 A205	T197-H201 WeakPolarHBondContact O-CB 3.4Å; T197-H201 PolarHBondContact O-N 3.37Å; T197-H201 VanDerWaalsContact O-N 3.11Å; A198-H201 PolarHBondContact O-N 3.41Å; S199-H201 PolarHBondContact O-N 2.84Å; H201-L204 PolarHBondContact O-N 3.28Å; H201-A205 WeakPolarHBondContact O-CB 3.49Å; H201-A205 PolarHBondContact O-N 3.32Å
202	C	77.4	Confident	80.6	Confident	76 Å²	76	92.3 Å²	92.3	51%	0.514	50%	0.496	S	S	.	.	H	α-helix	trans	-64.2	-41.5	171.1	-72.1	0	0	0	0	112	A198 S199 L204 A205 I206	A198-C202 PolarHBondContact O-N 3.38Å; A198-C202 PolarHBondContact O-SG 2.94Å; S199-C202 CarbonylContact O-C 3.6Å; S199-C202 WeakPolarHBondContact O-CA 3.38Å; S199-C202 WeakPolarHBondContact O-CB 3.49Å; S199-C202 PolarHBondContact O-N 2.91Å; C202-L204 VanDerWaalsContact C-N 3.33Å; C202-L204 PolarHBondContact O-N 2.99Å; C202-A205 WeakPolarHBondContact O-CB 3.1Å; C202-A205 PolarHBondContact O-N 3.15Å; C202-A205 VanDerWaalsContact O-N 3.16Å; C202-I206 VanDerWaalsContact O-CG1 3.3Å; C202-I206 WeakPolarHBondContact O-CG1 3.14Å; C202-I206 PolarHBondContact O-N 3.04Å
203	D	81.5	Confident	79.9	Confident	90 Å²	90	91.4 Å²	91.4	48%	0.481	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-37.9	176.7	-68	-39.2	0	0	0	111.5	S199 K207	S199-D203 PolarHBondContact O-N 3.48Å; D203-K207 VanDerWaalsContact O-CB 3.25Å; D203-K207 WeakPolarHBondContact O-CB 3.23Å; D203-K207 PolarHBondContact O-N 3.47Å
204	L	84.3	Confident	79	Confident	106 Å²	106	87.5 Å²	87.5	56%	0.555	49%	0.486	S	S	*	.	H	α-helix	trans	-66.2	-38.1	171.1	-75.4	166.2	0	0	0	112.7	E200 H201 C202 T208	E200-L204 WeakPolarHBondContact O-CB 3.46Å; E200-L204 WeakPolarHBondContact O-CD1 3.43Å; E200-L204 VanDerWaalsContact O-CG 3.29Å; E200-L204 WeakPolarHBondContact O-CG 3.31Å; E200-L204 PolarHBondContact O-N 2.89Å; H201-L204 PolarHBondContact O-N 3.28Å; C202-L204 VanDerWaalsContact C-N 3.33Å; C202-L204 PolarHBondContact O-N 2.99Å; L204-T208 WeakPolarHBondContact O-CG2 3.46Å; L204-T208 PolarHBondContact O-N 3.07Å; L204-T208 PolarHBondContact O-OG1 3Å
205	A	79.7	Confident	78.2	Confident	47 Å²	47	88.6 Å²	88.6	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-67.1	-44.5	175.2	0	0	0	0	0	111.8	H201 C202 T208 V209	H201-A205 WeakPolarHBondContact O-CB 3.49Å; H201-A205 PolarHBondContact O-N 3.32Å; C202-A205 WeakPolarHBondContact O-CB 3.1Å; C202-A205 PolarHBondContact O-N 3.15Å; C202-A205 VanDerWaalsContact O-N 3.16Å; A205-T208 WeakPolarHBondContact CA-OG1 3.26Å; A205-T208 PolarHBondContact O-N 2.89Å; A205-T208 PolarHBondContact O-OG1 3.18Å; A205-T208 VanDerWaalsContact O-OG1 3.05Å; A205-V209 WeakPolarHBondContact O-CG2 3.42Å; A205-V209 PolarHBondContact O-N 3.46Å
206	I	79.4	Confident	77.2	Confident	96 Å²	96	89 Å²	89	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-59	-49.7	173.8	-69.3	162.7	0	0	0	109.6	C202 T208 V209 E210	C202-I206 VanDerWaalsContact O-CG1 3.3Å; C202-I206 WeakPolarHBondContact O-CG1 3.14Å; C202-I206 PolarHBondContact O-N 3.04Å; I206-T208 PolarHBondContact O-N 3.16Å; I206-V209 CarbonylContact O-C 3.58Å; I206-V209 WeakPolarHBondContact O-CB 3.23Å; I206-V209 PolarHBondContact O-N 3.47Å; I206-V209 VanDerWaalsContact O-N 3.13Å; I206-E210 HydrophobicContact CG2-CG 4.43Å; I206-E210 WeakPolarHBondContact O-CG 3.49Å; I206-E210 PolarHBondContact O-N 2.86Å
207	K	82.4	Confident	76	Confident	116 Å²	116	87.4 Å²	87.4	50%	0.504	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-39	-179.1	-172.9	178.8	177.9	-171.3	0	113.2	D203 E210 E211	D203-K207 VanDerWaalsContact O-CB 3.25Å; D203-K207 WeakPolarHBondContact O-CB 3.23Å; D203-K207 PolarHBondContact O-N 3.47Å; K207-E210 PolarHBondContact O-N 2.87Å; K207-E211 VanDerWaalsContact CE-OE1 3.27Å; K207-E211 WeakPolarHBondContact CE-OE1 3.5Å; K207-E211 WeakPolarHBondContact O-CG 3.33Å; K207-E211 PolarHBondContact O-N 3.41Å
208	T	78.2	Confident	74.6	Confident	72 Å²	72	91.4 Å²	91.4	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-32.5	175.7	46.3	0	0	0	0	112.2	L204 A205 I206 I212	L204-T208 WeakPolarHBondContact O-CG2 3.46Å; L204-T208 PolarHBondContact O-N 3.07Å; L204-T208 PolarHBondContact O-OG1 3Å; A205-T208 WeakPolarHBondContact CA-OG1 3.26Å; A205-T208 PolarHBondContact O-N 2.89Å; A205-T208 PolarHBondContact O-OG1 3.18Å; A205-T208 VanDerWaalsContact O-OG1 3.05Å; I206-T208 PolarHBondContact O-N 3.16Å; T208-I212 WeakPolarHBondContact O-CB 3.42Å; T208-I212 WeakPolarHBondContact O-CD1 3.46Å; T208-I212 VanDerWaalsContact O-CG1 3.22Å; T208-I212 WeakPolarHBondContact O-CG1 3.35Å; T208-I212 PolarHBondContact O-N 3.39Å
209	V	74.6	Confident	73.3	Confident	80 Å²	80	95.8 Å²	95.8	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-44.6	167.8	170.3	0	0	0	0	111.3	A205 I206 E211 I212 E213	A205-V209 WeakPolarHBondContact O-CG2 3.42Å; A205-V209 PolarHBondContact O-N 3.46Å; I206-V209 CarbonylContact O-C 3.58Å; I206-V209 WeakPolarHBondContact O-CB 3.23Å; I206-V209 PolarHBondContact O-N 3.47Å; I206-V209 VanDerWaalsContact O-N 3.13Å; V209-E211 PolarHBondContact O-N 3.33Å; V209-I212 CarbonylContact O-C 3.59Å; V209-I212 WeakPolarHBondContact O-CB 3.49Å; V209-I212 PolarHBondContact O-N 2.97Å; V209-I212 VanDerWaalsContact O-N 3.14Å; V209-E213 HydrophobicContact CG1-CG 4.4Å; V209-E213 WeakPolarHBondContact O-CG 3.45Å; V209-E213 PolarHBondContact O-N 3.2Å
210	E	74.2	Confident	72.2	Confident	90 Å²	90	98.8 Å²	98.8	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-64.8	-35.5	177.1	-69.5	-168.3	139.6	0	0	113.1	I206 K207 G214 R228	I206-E210 HydrophobicContact CG2-CG 4.43Å; I206-E210 WeakPolarHBondContact O-CG 3.49Å; I206-E210 PolarHBondContact O-N 2.86Å; K207-E210 PolarHBondContact O-N 2.87Å; E210-G214 PolarHBondContact O-N 2.83Å; E210-R228 IonicContact OE1-NH2 2.75Å; E210-R228 PolarHBondContact OE1-NH2 3.17Å
211	E	78.9	Confident	70.7	Confident	111 Å²	111	101.9 Å²	101.9	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-66.6	-37.5	171.8	-74.8	176.7	-167.7	0	0	111.4	K207 V209 G214 V215	K207-E211 VanDerWaalsContact CE-OE1 3.27Å; K207-E211 WeakPolarHBondContact CE-OE1 3.5Å; K207-E211 WeakPolarHBondContact O-CG 3.33Å; K207-E211 PolarHBondContact O-N 3.41Å; V209-E211 PolarHBondContact O-N 3.33Å; E211-G214 PolarHBondContact O-N 3.41Å; E211-V215 VanDerWaalsContact O-CG2 3.31Å; E211-V215 WeakPolarHBondContact O-CG2 3.41Å; E211-V215 PolarHBondContact O-N 2.88Å
212	I	71.8	Confident	69.6	Low	101 Å²	101	99.1 Å²	99.1	52%	0.518	54%	0.535	S	S	.	.	H	α-helix	trans	-68.3	-44.6	173.7	-70.7	164.1	0	0	0	111.6	T208 V209 G214 V215 L216	T208-I212 WeakPolarHBondContact O-CB 3.42Å; T208-I212 WeakPolarHBondContact O-CD1 3.46Å; T208-I212 VanDerWaalsContact O-CG1 3.22Å; T208-I212 WeakPolarHBondContact O-CG1 3.35Å; T208-I212 PolarHBondContact O-N 3.39Å; V209-I212 CarbonylContact O-C 3.59Å; V209-I212 WeakPolarHBondContact O-CB 3.49Å; V209-I212 PolarHBondContact O-N 2.97Å; V209-I212 VanDerWaalsContact O-N 3.14Å; I212-G214 VanDerWaalsContact C-N 3.28Å; I212-G214 PolarHBondContact O-N 3.13Å; I212-V215 PolarHBondContact O-N 3Å; I212-L216 HydrophobicContact CG2-CD1 3.72Å; I212-L216 HydrophobicContact CG2-CG 4.36Å; I212-L216 WeakPolarHBondContact O-CB 3.38Å; I212-L216 WeakPolarHBondContact O-CG 3.48Å; I212-L216 PolarHBondContact O-N 3.39Å
213	E	66.5	Low	68.8	Low	72 Å²	72	101.4 Å²	101.4	34%	0.336	54%	0.542	S	S	.	.	H	α-helix	trans	-58.9	-39.9	172.4	-72.7	-174.7	143.7	0	0	111.4	V209 G217 R228	V209-E213 HydrophobicContact CG1-CG 4.4Å; V209-E213 WeakPolarHBondContact O-CG 3.45Å; V209-E213 PolarHBondContact O-N 3.2Å; E213-G217 PolarHBondContact O-N 3.42Å; E213-G217 VanDerWaalsContact O-N 3.09Å; E213-R228 VanDerWaalsContact CD-NH1 3.28Å; E213-R228 IonicContact OE1-NH1 3.27Å; E213-R228 PolarHBondContact OE1-NH1 3.06Å; E213-R228 IonicContact OE2-CZ 3.16Å; E213-R228 IonicContact OE2-NH1 2.65Å; E213-R228 PolarHBondContact OE2-NH1 3.13Å
214	G	66.6	Low	67.9	Low	55 Å²	55	102.5 Å²	102.5	57%	0.567	55%	0.547	S	S	*	.	H	α-helix	trans	-65.4	-37.5	176.3	0	0	0	0	0	113.7	E210 E211 I212	E210-G214 PolarHBondContact O-N 2.83Å; E211-G214 PolarHBondContact O-N 3.41Å; I212-G214 VanDerWaalsContact C-N 3.28Å; I212-G214 PolarHBondContact O-N 3.13Å
215	V	66	Low	67.1	Low	130 Å²	130	99.6 Å²	99.6	79%	0.788	54%	0.538	S	S	*	.	H	α-helix	trans	-78.1	-34.2	177.9	168.7	0	0	0	0	112.6	E211 I212	E211-V215 VanDerWaalsContact O-CG2 3.31Å; E211-V215 WeakPolarHBondContact O-CG2 3.41Å; E211-V215 PolarHBondContact O-N 2.88Å; I212-V215 PolarHBondContact O-N 3Å
216	L	60.4	Low	66.8	Low	116 Å²	116	102.9 Å²	102.9	61%	0.607	55%	0.546	S	S	*	.	H	α-helix	trans	-79.1	-20.5	178.5	-70.2	173.7	0	0	0	113.7	I212 L220	I212-L216 HydrophobicContact CG2-CD1 3.72Å; I212-L216 HydrophobicContact CG2-CG 4.36Å; I212-L216 WeakPolarHBondContact O-CB 3.38Å; I212-L216 WeakPolarHBondContact O-CG 3.48Å; I212-L216 PolarHBondContact O-N 3.39Å; L216-L220 WeakPolarHBondContact O-CD1 3.25Å
217	G	58.3	Low	66.5	Low	33 Å²	33	102.8 Å²	102.8	34%	0.34	54%	0.543	S	S	.	.			trans	89.6	126.2	177.4	0	0	0	0	0	112.6	E213 D219	E213-G217 PolarHBondContact O-N 3.42Å; E213-G217 VanDerWaalsContact O-N 3.09Å; G217-D219 PolarHBondContact O-N 2.96Å
218	R	56.8	Low	66	Low	165 Å²	165	101.1 Å²	101.1	62%	0.623	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-6.1	-172.5	-160.2	171.7	-68.6	-117	-4.9	114.5
219	D	52	Low	66	Low	144 Å²	144	101 Å²	101	77%	0.77	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.5	-168.4	-54.6	-39.3	0	0	0	114.4	G217 Y221	G217-D219 PolarHBondContact O-N 2.96Å; D219-Y221 VanDerWaalsContact C-N 3.33Å; D219-Y221 PolarHBondContact O-N 3.28Å
220	L	55.4	Low	66.2	Low	125 Å²	125	105.4 Å²	105.4	65%	0.654	54%	0.544	S	S	*	.	S	Bend	trans	-66.9	-29.1	-175.8	-78.9	165.2	0	0	0	114	L216	L216-L220 WeakPolarHBondContact O-CD1 3.25Å
221	Y	56.8	Low	66.2	Low	174 Å²	174	108.2 Å²	108.2	68%	0.682	55%	0.551	S	S	*	*			trans	-142.3	85.6	176.8	-81.2	-87.5	0	0	0	111.6	D219 N223 L224 A225	D219-Y221 VanDerWaalsContact C-N 3.33Å; D219-Y221 PolarHBondContact O-N 3.28Å; Y221-N223 PolarHBondContact O-N 3.39Å; Y221-N223 VanDerWaalsContact O-N 3.17Å; Y221-L224 PolarHBondContact O-N 3.02Å; Y221-A225 PolarHBondContact O-N 2.87Å
222	P	59.8	Low	66.3	Low	83 Å²	83	108 Å²	108	54%	0.539	55%	0.549	S	S	.	.	H	α-helix	trans	-55.3	-35.8	179.6	-27.7	35.7	0	0	0	113.8	L224 A225 E226	P222-L224 VanDerWaalsContact C-N 3.27Å; P222-L224 PolarHBondContact O-N 3.01Å; P222-A225 PolarHBondContact O-N 2.98Å; P222-A225 VanDerWaalsContact O-N 3.16Å; P222-E226 PolarHBondContact O-N 3Å
223	N	61.7	Low	67.2	Low	124 Å²	124	111.1 Å²	111.1	66%	0.663	56%	0.559	S	S	*	*	H	α-helix	trans	-59.9	-37.2	179.5	-147.3	30.6	0	0	0	112.1	Y221 E227	Y221-N223 PolarHBondContact O-N 3.39Å; Y221-N223 VanDerWaalsContact O-N 3.17Å; N223-E227 VanDerWaalsContact O-CB 3.3Å; N223-E227 WeakPolarHBondContact O-CB 3.37Å; N223-E227 PolarHBondContact O-N 3.16Å
224	L	62.7	Low	68.3	Low	113 Å²	113	112.9 Å²	112.9	59%	0.592	57%	0.568	S	S	*	*	H	α-helix	trans	-74.4	-31	179.5	-138.6	76.4	0	0	0	111.9	Y221 P222 R228	Y221-L224 PolarHBondContact O-N 3.02Å; P222-L224 VanDerWaalsContact C-N 3.27Å; P222-L224 PolarHBondContact O-N 3.01Å; L224-R228 VanDerWaalsContact O-CB 3.25Å; L224-R228 WeakPolarHBondContact O-CB 3.35Å; L224-R228 PolarHBondContact O-N 3.46Å
225	A	66.9	Low	68.9	Low	45 Å²	45	114.8 Å²	114.8	37%	0.372	56%	0.564	S	S	.	*	H	α-helix	trans	-72.5	-39.6	174.3	0	0	0	0	0	112	Y221 P222 S229	Y221-A225 PolarHBondContact O-N 2.87Å; P222-A225 PolarHBondContact O-N 2.98Å; P222-A225 VanDerWaalsContact O-N 3.16Å; A225-S229 WeakPolarHBondContact O-CB 3.48Å; A225-S229 PolarHBondContact O-N 3.01Å
226	E	74	Confident	70.1	Confident	116 Å²	116	111.1 Å²	111.1	54%	0.542	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-40.4	171	-73.9	-169.8	-149.9	0	0	112	P222 S229 R230	P222-E226 PolarHBondContact O-N 3Å; E226-S229 PolarHBondContact O-N 3.15Å; E226-R230 VanDerWaalsContact O-CG 3.31Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 2.95Å
227	E	72.8	Confident	71.5	Confident	94 Å²	94	107.2 Å²	107.2	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-67	-46.4	177	-172.7	161.5	-144.8	0	0	111.9	N223 S229 R230 W231	N223-E227 VanDerWaalsContact O-CB 3.3Å; N223-E227 WeakPolarHBondContact O-CB 3.37Å; N223-E227 PolarHBondContact O-N 3.16Å; E227-S229 VanDerWaalsContact C-N 3.32Å; E227-S229 PolarHBondContact O-N 3.49Å; E227-R230 WeakPolarHBondContact O-CB 3.35Å; E227-R230 PolarHBondContact O-N 3.47Å; E227-R230 VanDerWaalsContact O-N 3.13Å; E227-W231 PolarHBondContact O-N 2.93Å
228	R	72.1	Confident	72.8	Confident	80 Å²	80	110.3 Å²	110.3	30%	0.302	54%	0.543	S	S	.	.	H	α-helix	trans	-56.8	-43.6	171.7	178.2	169.1	174.3	172.3	-1.2	111.6	E210 E213 L224 R230 W231 E232	E210-R228 IonicContact OE1-NH2 2.75Å; E210-R228 PolarHBondContact OE1-NH2 3.17Å; E213-R228 VanDerWaalsContact CD-NH1 3.28Å; E213-R228 IonicContact OE1-NH1 3.27Å; E213-R228 PolarHBondContact OE1-NH1 3.06Å; E213-R228 IonicContact OE2-CZ 3.16Å; E213-R228 IonicContact OE2-NH1 2.65Å; E213-R228 PolarHBondContact OE2-NH1 3.13Å; L224-R228 VanDerWaalsContact O-CB 3.25Å; L224-R228 WeakPolarHBondContact O-CB 3.35Å; L224-R228 PolarHBondContact O-N 3.46Å; R228-R230 VanDerWaalsContact C-N 3.33Å; R228-R230 PolarHBondContact O-N 2.89Å; R228-W231 PolarHBondContact O-N 3.32Å; R228-E232 HydrophobicContact CG-CG 4.28Å; R228-E232 VanDerWaalsContact CG-OE1 3.23Å; R228-E232 WeakPolarHBondContact CG-OE1 3.39Å; R228-E232 IonicContact CZ-OE1 3.6Å; R228-E232 IonicContact NE-OE1 3.95Å; R228-E232 PolarHBondContact NE-OE1 2.89Å; R228-E232 IonicContact NH2-OE1 3.82Å; R228-E232 WeakPolarHBondContact O-CB 3.37Å; R228-E232 VanDerWaalsContact O-CG 3.3Å; R228-E232 WeakPolarHBondContact O-CG 3.37Å; R228-E232 PolarHBondContact O-N 3.47Å
229	S	78	Confident	74.4	Confident	70 Å²	70	110.9 Å²	110.9	49%	0.49	55%	0.545	S	S	.	.	H	α-helix	trans	-65.9	-31.6	177.3	-171.9	0	0	0	0	113.4	A225 E226 E227 K233	A225-S229 WeakPolarHBondContact O-CB 3.48Å; A225-S229 PolarHBondContact O-N 3.01Å; E226-S229 PolarHBondContact O-N 3.15Å; E227-S229 VanDerWaalsContact C-N 3.32Å; E227-S229 PolarHBondContact O-N 3.49Å; S229-K233 WeakPolarHBondContact O-CB 3.48Å; S229-K233 PolarHBondContact O-N 3.15Å; S229-K233 VanDerWaalsContact O-N 3.13Å
230	R	79.3	Confident	76.4	Confident	173 Å²	173	111 Å²	111	65%	0.653	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-50.2	171.2	-72	163.9	-176.6	-88	-0.5	111.1	E226 E227 R228 K233 E234	E226-R230 VanDerWaalsContact O-CG 3.31Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 2.95Å; E227-R230 WeakPolarHBondContact O-CB 3.35Å; E227-R230 PolarHBondContact O-N 3.47Å; E227-R230 VanDerWaalsContact O-N 3.13Å; R228-R230 VanDerWaalsContact C-N 3.33Å; R228-R230 PolarHBondContact O-N 2.89Å; R230-K233 PolarHBondContact O-N 3.21Å; R230-E234 WeakPolarHBondContact O-CB 3.47Å; R230-E234 PolarHBondContact O-N 3.11Å
231	W	73.5	Confident	78.1	Confident	149 Å²	149	110.1 Å²	110.1	56%	0.564	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-41.6	178.8	-67.8	120.2	0	0	0	112.6	E227 R228 K233 E234 L235	E227-W231 PolarHBondContact O-N 2.93Å; R228-W231 PolarHBondContact O-N 3.32Å; W231-K233 VanDerWaalsContact C-N 3.29Å; W231-K233 PolarHBondContact O-N 2.91Å; W231-E234 PolarHBondContact O-N 3.24Å; W231-L235 WeakPolarHBondContact O-CB 3.16Å; W231-L235 PolarHBondContact O-N 2.74Å
232	E	81.4	Confident	79.3	Confident	105 Å²	105	106.6 Å²	106.6	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-59.3	-39.6	173.8	-75.6	170.3	-178.8	0	0	111.6	R228 A236	R228-E232 HydrophobicContact CG-CG 4.28Å; R228-E232 VanDerWaalsContact CG-OE1 3.23Å; R228-E232 WeakPolarHBondContact CG-OE1 3.39Å; R228-E232 IonicContact CZ-OE1 3.6Å; R228-E232 IonicContact NE-OE1 3.95Å; R228-E232 PolarHBondContact NE-OE1 2.89Å; R228-E232 IonicContact NH2-OE1 3.82Å; R228-E232 WeakPolarHBondContact O-CB 3.37Å; R228-E232 VanDerWaalsContact O-CG 3.3Å; R228-E232 WeakPolarHBondContact O-CG 3.37Å; R228-E232 PolarHBondContact O-N 3.47Å; E232-A236 VanDerWaalsContact O-CB 3.31Å; E232-A236 WeakPolarHBondContact O-CB 3.33Å; E232-A236 PolarHBondContact O-N 2.77Å
233	K	90.2	Very high	80.9	Confident	168 Å²	168	110 Å²	110	73%	0.73	54%	0.535	S	S	*	.	H	α-helix	trans	-72.5	-39.5	177.1	-174.4	176.4	-179.8	-180	0	113.2	S229 R230 W231 A236 G237	S229-K233 WeakPolarHBondContact O-CB 3.48Å; S229-K233 PolarHBondContact O-N 3.15Å; S229-K233 VanDerWaalsContact O-N 3.13Å; R230-K233 PolarHBondContact O-N 3.21Å; W231-K233 VanDerWaalsContact C-N 3.29Å; W231-K233 PolarHBondContact O-N 2.91Å; K233-A236 PolarHBondContact O-N 2.66Å; K233-G237 PolarHBondContact O-N 3.36Å
234	E	88.8	Confident	82.4	Confident	109 Å²	109	106.9 Å²	106.9	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-66.9	-43.5	176.5	-171.2	168.6	155.6	0	0	111	R230 W231 A236 G237 L238	R230-E234 WeakPolarHBondContact O-CB 3.47Å; R230-E234 PolarHBondContact O-N 3.11Å; W231-E234 PolarHBondContact O-N 3.24Å; E234-A236 VanDerWaalsContact C-N 3.34Å; E234-A236 PolarHBondContact O-N 3.41Å; E234-G237 PolarHBondContact O-N 3.15Å; E234-G237 VanDerWaalsContact O-N 3.16Å; E234-L238 HydrophobicContact CG-CD1 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.17Å; E234-L238 PolarHBondContact O-N 2.83Å
235	L	81	Confident	83.6	Confident	94 Å²	94	105.2 Å²	105.2	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-34.2	176.2	-162.4	154.4	0	0	0	111.7	W231 R239	W231-L235 WeakPolarHBondContact O-CB 3.16Å; W231-L235 PolarHBondContact O-N 2.74Å; L235-R239 HydrophobicContact CD2-CG 4.41Å; L235-R239 WeakPolarHBondContact O-CG 3.25Å; L235-R239 PolarHBondContact O-N 3.02Å; L235-R239 VanDerWaalsContact O-N 3.07Å
236	A	89.9	Confident	84.6	Confident	53 Å²	53	106.3 Å²	106.3	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-44.2	169.2	0	0	0	0	0	112.3	E232 K233 E234 R239 E240	E232-A236 VanDerWaalsContact O-CB 3.31Å; E232-A236 WeakPolarHBondContact O-CB 3.33Å; E232-A236 PolarHBondContact O-N 2.77Å; K233-A236 PolarHBondContact O-N 2.66Å; E234-A236 VanDerWaalsContact C-N 3.34Å; E234-A236 PolarHBondContact O-N 3.41Å; A236-R239 WeakPolarHBondContact O-CB 3.33Å; A236-R239 PolarHBondContact O-N 2.94Å; A236-E240 PolarHBondContact O-N 2.76Å
237	G	90.9	Very high	85.5	Confident	34 Å²	34	103.8 Å²	103.8	35%	0.351	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-42.8	175.7	0	0	0	0	0	113	K233 E234 R239 E240 E241	K233-G237 PolarHBondContact O-N 3.36Å; E234-G237 PolarHBondContact O-N 3.15Å; E234-G237 VanDerWaalsContact O-N 3.16Å; G237-R239 VanDerWaalsContact C-N 3.29Å; G237-R239 PolarHBondContact O-N 3.4Å; G237-E240 PolarHBondContact O-N 3.19Å; G237-E241 WeakPolarHBondContact O-CB 3.42Å; G237-E241 PolarHBondContact O-N 2.81Å
238	L	85.8	Confident	86.3	Confident	98 Å²	98	104.2 Å²	104.2	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-29.7	174.9	-70.4	169.4	0	0	0	112.9	E234 N242	E234-L238 HydrophobicContact CG-CD1 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.17Å; E234-L238 PolarHBondContact O-N 2.83Å; L238-N242 WeakPolarHBondContact O-CB 3.23Å; L238-N242 PolarHBondContact O-N 3.15Å
239	R	90.3	Very high	86.8	Confident	177 Å²	177	106.2 Å²	106.2	67%	0.668	54%	0.535	S	S	*	.	H	α-helix	trans	-70.6	-44.9	171.7	-75.5	176	-174.6	-83.4	2.3	111.7	L235 A236 G237 N242 E243	L235-R239 HydrophobicContact CD2-CG 4.41Å; L235-R239 WeakPolarHBondContact O-CG 3.25Å; L235-R239 PolarHBondContact O-N 3.02Å; L235-R239 VanDerWaalsContact O-N 3.07Å; A236-R239 WeakPolarHBondContact O-CB 3.33Å; A236-R239 PolarHBondContact O-N 2.94Å; G237-R239 VanDerWaalsContact C-N 3.29Å; G237-R239 PolarHBondContact O-N 3.4Å; R239-N242 PolarHBondContact O-N 3.41Å; R239-E243 WeakPolarHBondContact O-CB 3.22Å; R239-E243 PolarHBondContact O-N 2.94Å
240	E	92.8	Very high	87.4	Confident	146 Å²	146	106.4 Å²	106.4	68%	0.682	54%	0.536	S	S	*	.	H	α-helix	trans	-62.4	-42.3	176	-174	175.8	-173.1	0	0	111.4	A236 G237 E243 S244	A236-E240 PolarHBondContact O-N 2.76Å; G237-E240 PolarHBondContact O-N 3.19Å; E240-E243 PolarHBondContact O-N 3.35Å; E240-S244 WeakPolarHBondContact O-CB 3.16Å; E240-S244 PolarHBondContact O-N 3.35Å
241	E	92.4	Very high	88	Confident	108 Å²	108	100.6 Å²	100.6	51%	0.505	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-48.3	173.7	-175.5	173.1	-168.8	0	0	111.3	G237 E243 S244 L245	G237-E241 WeakPolarHBondContact O-CB 3.42Å; G237-E241 PolarHBondContact O-N 2.81Å; E241-E243 PolarHBondContact O-N 2.9Å; E241-S244 WeakPolarHBondContact O-CB 3.36Å; E241-S244 PolarHBondContact O-N 3.3Å; E241-S244 VanDerWaalsContact O-N 3.15Å; E241-S244 PolarHBondContact O-OG 2.97Å; E241-L245 HydrophobicContact CG-CD1 4Å; E241-L245 HydrophobicContact CG-CG 4.38Å; E241-L245 WeakPolarHBondContact O-CG 3.42Å; E241-L245 PolarHBondContact O-N 2.92Å
242	N	81.4	Confident	88.7	Confident	100 Å²	100	97.3 Å²	97.3	54%	0.535	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-38.4	179.7	-166.8	-9.8	0	0	0	112.7	L238 R239 L245 T246	L238-N242 WeakPolarHBondContact O-CB 3.23Å; L238-N242 PolarHBondContact O-N 3.15Å; R239-N242 PolarHBondContact O-N 3.41Å; N242-L245 PolarHBondContact O-N 2.95Å; N242-T246 WeakPolarHBondContact O-CB 3.45Å; N242-T246 PolarHBondContact O-N 3.3Å; N242-T246 PolarHBondContact O-OG1 3.14Å
243	E	93.3	Very high	88.9	Confident	153 Å²	153	97.9 Å²	97.9	72%	0.715	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-42.2	171.5	-172.6	171.5	-179.2	0	0	111.2	R239 E240 E241 T246 A247	R239-E243 WeakPolarHBondContact O-CB 3.22Å; R239-E243 PolarHBondContact O-N 2.94Å; E240-E243 PolarHBondContact O-N 3.35Å; E241-E243 PolarHBondContact O-N 2.9Å; E243-T246 PolarHBondContact O-N 3.49Å; E243-A247 WeakPolarHBondContact O-CB 3.44Å; E243-A247 PolarHBondContact O-N 2.92Å
244	S	92.1	Very high	89	Confident	60 Å²	60	95.2 Å²	95.2	42%	0.42	50%	0.504	S	S	.	.	H	α-helix	trans	-65	-40.5	176	85.1	0	0	0	0	113	E240 E241 A247 M248	E240-S244 WeakPolarHBondContact O-CB 3.16Å; E240-S244 PolarHBondContact O-N 3.35Å; E241-S244 WeakPolarHBondContact O-CB 3.36Å; E241-S244 PolarHBondContact O-N 3.3Å; E241-S244 VanDerWaalsContact O-N 3.15Å; E241-S244 PolarHBondContact O-OG 2.97Å; S244-A247 PolarHBondContact O-N 3.07Å; S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.02Å
245	L	88.4	Confident	88.9	Confident	78 Å²	78	93.2 Å²	93.2	41%	0.408	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-40.9	176.1	-72.6	170.6	0	0	0	111	E241 N242 M248 L249	E241-L245 HydrophobicContact CG-CD1 4Å; E241-L245 HydrophobicContact CG-CG 4.38Å; E241-L245 WeakPolarHBondContact O-CG 3.42Å; E241-L245 PolarHBondContact O-N 2.92Å; N242-L245 PolarHBondContact O-N 2.95Å; L245-M248 HydrophobicContact CD2-CE 3.9Å; L245-M248 PolarHBondContact O-N 2.91Å; L245-L249 WeakPolarHBondContact O-CG 3.37Å; L245-L249 PolarHBondContact O-N 2.9Å
246	T	88.6	Confident	89	Confident	68 Å²	68	92.9 Å²	92.9	42%	0.417	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-45.8	174.4	-59.8	0	0	0	0	111	N242 E243 M248 L249 C250	N242-T246 WeakPolarHBondContact O-CB 3.45Å; N242-T246 PolarHBondContact O-N 3.3Å; N242-T246 PolarHBondContact O-OG1 3.14Å; E243-T246 PolarHBondContact O-N 3.49Å; T246-M248 VanDerWaalsContact C-N 3.35Å; T246-M248 PolarHBondContact O-N 3.02Å; T246-L249 PolarHBondContact O-N 2.74Å; T246-C250 PolarHBondContact O-N 3.4Å; T246-C250 PolarHBondContact O-SG 2.69Å; T246-C250 VanDerWaalsContact O-SG 3.39Å
247	A	92.4	Very high	89	Confident	62 Å²	62	93.8 Å²	93.8	51%	0.512	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-38.9	175.1	0	0	0	0	0	112.6	E243 S244 S251	E243-A247 WeakPolarHBondContact O-CB 3.44Å; E243-A247 PolarHBondContact O-N 2.92Å; S244-A247 PolarHBondContact O-N 3.07Å; A247-S251 PolarHBondContact O-N 3.02Å
248	M	88.9	Confident	89.1	Confident	103 Å²	103	98.4 Å²	98.4	51%	0.507	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-41.9	173.1	-75	-153.4	-65.8	0	0	112.4	S244 L245 T246 S251 K252	S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.02Å; L245-M248 HydrophobicContact CD2-CE 3.9Å; L245-M248 PolarHBondContact O-N 2.91Å; T246-M248 VanDerWaalsContact C-N 3.35Å; T246-M248 PolarHBondContact O-N 3.02Å; M248-S251 PolarHBondContact O-N 3.19Å; M248-K252 WeakPolarHBondContact O-CB 3.36Å; M248-K252 VanDerWaalsContact O-CG 3.29Å; M248-K252 WeakPolarHBondContact O-CG 3.46Å; M248-K252 PolarHBondContact O-N 3.42Å
249	L	83.8	Confident	88.9	Confident	123 Å²	123	97.3 Å²	97.3	64%	0.644	50%	0.495	S	S	*	.	H	α-helix	trans	-59.7	-46.4	175.4	-76.1	169.4	0	0	0	111.3	L245 T246 S251 K252 E253	L245-L249 WeakPolarHBondContact O-CG 3.37Å; L245-L249 PolarHBondContact O-N 2.9Å; T246-L249 PolarHBondContact O-N 2.74Å; L249-S251 PolarHBondContact O-N 3.28Å; L249-K252 PolarHBondContact O-N 2.97Å; L249-E253 PolarHBondContact O-N 3.29Å
250	C	90.1	Very high	88.8	Confident	74 Å²	74	92.8 Å²	92.8	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-59.1	-45.1	174.5	-66.1	0	0	0	0	112.2	T246 K252 E253 E254	T246-C250 PolarHBondContact O-N 3.4Å; T246-C250 PolarHBondContact O-SG 2.69Å; T246-C250 VanDerWaalsContact O-SG 3.39Å; C250-K252 VanDerWaalsContact C-N 3.33Å; C250-K252 PolarHBondContact O-N 2.69Å; C250-E253 PolarHBondContact O-N 3Å; C250-E254 PolarHBondContact O-N 3.01Å
251	S	92.1	Very high	88.8	Confident	50 Å²	50	88.6 Å²	88.6	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-40.4	176.1	-172.5	0	0	0	0	112.3	A247 M248 L249 E254 E255	A247-S251 PolarHBondContact O-N 3.02Å; M248-S251 PolarHBondContact O-N 3.19Å; L249-S251 PolarHBondContact O-N 3.28Å; S251-E254 PolarHBondContact O-N 3.4Å; S251-E255 WeakPolarHBondContact O-CG 3.21Å; S251-E255 PolarHBondContact O-N 3.46Å; S251-E255 PolarHBondContact OG-OE1 3.4Å
252	K	87.8	Confident	88.6	Confident	80 Å²	80	87.4 Å²	87.4	35%	0.348	47%	0.471	S	S	.	.	H	α-helix	trans	-72.1	-33.4	178.9	-67	-67.9	161.5	-138.3	0	112.5	M248 L249 C250 E255 L256	M248-K252 WeakPolarHBondContact O-CB 3.36Å; M248-K252 VanDerWaalsContact O-CG 3.29Å; M248-K252 WeakPolarHBondContact O-CG 3.46Å; M248-K252 PolarHBondContact O-N 3.42Å; L249-K252 PolarHBondContact O-N 2.97Å; C250-K252 VanDerWaalsContact C-N 3.33Å; C250-K252 PolarHBondContact O-N 2.69Å; K252-E255 WeakPolarHBondContact CD-OE2 3.31Å; K252-E255 IonicContact NZ-OE1 3.32Å; K252-E255 PolarHBondContact NZ-OE1 2.95Å; K252-E255 IonicContact NZ-OE2 2.6Å; K252-E255 PolarHBondContact NZ-OE2 3.49Å; K252-E255 PolarHBondContact O-N 3.34Å; K252-L256 VanDerWaalsContact O-CB 3.25Å; K252-L256 WeakPolarHBondContact O-CB 3.47Å; K252-L256 PolarHBondContact O-N 3.26Å
253	E	86.1	Confident	88.7	Confident	117 Å²	117	87 Å²	87	55%	0.547	47%	0.467	S	S	.	.	H	α-helix	trans	-68.1	-39.5	171.3	179.8	146.7	-135.6	0	0	111.8	L249 C250 L256 N257	L249-E253 PolarHBondContact O-N 3.29Å; C250-E253 PolarHBondContact O-N 3Å; E253-L256 PolarHBondContact O-N 2.91Å; E253-N257 WeakPolarHBondContact CG-ND2 3.5Å; E253-N257 WeakPolarHBondContact O-CB 3.46Å; E253-N257 PolarHBondContact O-N 3.5Å; E253-N257 PolarHBondContact O-ND2 3.41Å; E253-N257 VanDerWaalsContact O-ND2 3.12Å
254	E	91.4	Very high	88.3	Confident	112 Å²	112	83.1 Å²	83.1	52%	0.523	45%	0.451	S	S	.	.	H	α-helix	trans	-62.3	-45.4	171.1	-73.8	-167.1	-152.6	0	0	112.5	C250 S251 L256 N257 R258	C250-E254 PolarHBondContact O-N 3.01Å; S251-E254 PolarHBondContact O-N 3.4Å; E254-L256 VanDerWaalsContact C-N 3.32Å; E254-L256 PolarHBondContact O-N 3.26Å; E254-N257 PolarHBondContact O-N 3.13Å; E254-N257 VanDerWaalsContact O-N 3.13Å; E254-R258 VanDerWaalsContact CB-NH2 3.27Å; E254-R258 VanDerWaalsContact O-CG 3.27Å; E254-R258 WeakPolarHBondContact O-CG 3.37Å; E254-R258 PolarHBondContact O-N 2.98Å; E254-R258 IonicContact OE2-CZ 3.4Å; E254-R258 IonicContact OE2-NE 2.71Å; E254-R258 IonicContact OE2-NH2 3.29Å; E254-R258 PolarHBondContact OE2-NH2 2.89Å
255	E	87.1	Confident	88.3	Confident	68 Å²	68	82.8 Å²	82.8	32%	0.318	45%	0.452	S	S	.	.	H	α-helix	trans	-58.1	-43.5	174.6	-73.8	167.7	-140.3	0	0	111.9	S251 K252 N257 R258 T259	S251-E255 WeakPolarHBondContact O-CG 3.21Å; S251-E255 PolarHBondContact O-N 3.46Å; S251-E255 PolarHBondContact OG-OE1 3.4Å; K252-E255 WeakPolarHBondContact CD-OE2 3.31Å; K252-E255 IonicContact NZ-OE1 3.32Å; K252-E255 PolarHBondContact NZ-OE1 2.95Å; K252-E255 IonicContact NZ-OE2 2.6Å; K252-E255 PolarHBondContact NZ-OE2 3.49Å; K252-E255 PolarHBondContact O-N 3.34Å; E255-N257 VanDerWaalsContact C-N 3.31Å; E255-N257 PolarHBondContact O-N 2.95Å; E255-R258 VanDerWaalsContact CG-NH1 3.3Å; E255-R258 PolarHBondContact O-N 2.91Å; E255-T259 WeakPolarHBondContact O-CG2 3.23Å; E255-T259 PolarHBondContact O-N 3.39Å; E255-T259 PolarHBondContact O-OG1 3.22Å
256	L	83.7	Confident	88.2	Confident	86 Å²	86	84.4 Å²	84.4	45%	0.45	46%	0.459	S	S	.	.	H	α-helix	trans	-62.4	-37.4	174.6	178	61.4	0	0	0	111.8	K252 E253 E254 T259 K260	K252-L256 VanDerWaalsContact O-CB 3.25Å; K252-L256 WeakPolarHBondContact O-CB 3.47Å; K252-L256 PolarHBondContact O-N 3.26Å; E253-L256 PolarHBondContact O-N 2.91Å; E254-L256 VanDerWaalsContact C-N 3.32Å; E254-L256 PolarHBondContact O-N 3.26Å; L256-T259 WeakPolarHBondContact CA-OG1 3.35Å; L256-T259 PolarHBondContact O-OG1 2.97Å; L256-K260 HydrophobicContact CG-CD 4.33Å; L256-K260 WeakPolarHBondContact O-CB 3.45Å; L256-K260 WeakPolarHBondContact O-CD 3.28Å; L256-K260 WeakPolarHBondContact O-CG 3.3Å; L256-K260 PolarHBondContact O-N 3.1Å
257	N	88.6	Confident	88.1	Confident	73 Å²	73	86.5 Å²	86.5	39%	0.39	46%	0.46	S	S	.	.	H	α-helix	trans	-75.5	-34.5	178.1	-68.9	-29	0	0	0	112.5	E253 E254 E255 K260 A261	E253-N257 WeakPolarHBondContact CG-ND2 3.5Å; E253-N257 WeakPolarHBondContact O-CB 3.46Å; E253-N257 PolarHBondContact O-N 3.5Å; E253-N257 PolarHBondContact O-ND2 3.41Å; E253-N257 VanDerWaalsContact O-ND2 3.12Å; E254-N257 PolarHBondContact O-N 3.13Å; E254-N257 VanDerWaalsContact O-N 3.13Å; E255-N257 VanDerWaalsContact C-N 3.31Å; E255-N257 PolarHBondContact O-N 2.95Å; N257-K260 WeakPolarHBondContact OD1-CD 3.32Å; N257-K260 PolarHBondContact OD1-NZ 3.47Å; N257-A261 PolarHBondContact O-N 3.4Å; N257-A261 VanDerWaalsContact O-N 3.09Å
258	R	93	Very high	88.1	Confident	130 Å²	130	90.1 Å²	90.1	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-44.1	170.2	-66.4	172.5	-141.7	137	-2.8	111.5	E254 E255 A261 T262	E254-R258 VanDerWaalsContact CB-NH2 3.27Å; E254-R258 VanDerWaalsContact O-CG 3.27Å; E254-R258 WeakPolarHBondContact O-CG 3.37Å; E254-R258 PolarHBondContact O-N 2.98Å; E254-R258 IonicContact OE2-CZ 3.4Å; E254-R258 IonicContact OE2-NE 2.71Å; E254-R258 IonicContact OE2-NH2 3.29Å; E254-R258 PolarHBondContact OE2-NH2 2.89Å; E255-R258 VanDerWaalsContact CG-NH1 3.3Å; E255-R258 PolarHBondContact O-N 2.91Å; R258-A261 WeakPolarHBondContact O-CB 3.45Å; R258-A261 PolarHBondContact O-N 3.19Å; R258-T262 PolarHBondContact O-N 2.84Å; R258-T262 VanDerWaalsContact O-N 3.1Å
259	T	82.6	Confident	88.2	Confident	75 Å²	75	91.4 Å²	91.4	46%	0.46	47%	0.471	S	S	.	.	H	α-helix	trans	-71.7	-36.3	178.1	50.3	0	0	0	0	113.3	E255 L256 A261 T262 M263	E255-T259 WeakPolarHBondContact O-CG2 3.23Å; E255-T259 PolarHBondContact O-N 3.39Å; E255-T259 PolarHBondContact O-OG1 3.22Å; L256-T259 WeakPolarHBondContact CA-OG1 3.35Å; L256-T259 PolarHBondContact O-OG1 2.97Å; T259-A261 VanDerWaalsContact C-N 3.28Å; T259-A261 PolarHBondContact O-N 2.99Å; T259-T262 PolarHBondContact O-N 3.04Å; T259-T262 PolarHBondContact O-OG1 3.22Å; T259-T262 VanDerWaalsContact O-OG1 3.05Å; T259-M263 WeakPolarHBondContact O-CB 3.42Å; T259-M263 PolarHBondContact O-N 3.21Å
260	K	89	Confident	88.4	Confident	83 Å²	83	90.7 Å²	90.7	36%	0.361	46%	0.459	S	S	.	.	H	α-helix	trans	-56.2	-42.9	167.2	-76	165.4	-172	159.1	0	111.3	L256 N257 N264	L256-K260 HydrophobicContact CG-CD 4.33Å; L256-K260 WeakPolarHBondContact O-CB 3.45Å; L256-K260 WeakPolarHBondContact O-CD 3.28Å; L256-K260 WeakPolarHBondContact O-CG 3.3Å; L256-K260 PolarHBondContact O-N 3.1Å; N257-K260 WeakPolarHBondContact OD1-CD 3.32Å; N257-K260 PolarHBondContact OD1-NZ 3.47Å; K260-N264 VanDerWaalsContact O-CG 3.27Å; K260-N264 PolarHBondContact O-N 2.94Å; K260-N264 PolarHBondContact O-ND2 2.8Å
261	A	91.4	Very high	88.3	Confident	57 Å²	57	89.7 Å²	89.7	47%	0.471	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-44	179.5	0	0	0	0	0	112.8	N257 R258 T259 N264 A265	N257-A261 PolarHBondContact O-N 3.4Å; N257-A261 VanDerWaalsContact O-N 3.09Å; R258-A261 WeakPolarHBondContact O-CB 3.45Å; R258-A261 PolarHBondContact O-N 3.19Å; T259-A261 VanDerWaalsContact C-N 3.28Å; T259-A261 PolarHBondContact O-N 2.99Å; A261-N264 PolarHBondContact O-N 3.31Å; A261-A265 PolarHBondContact O-N 3.43Å
262	T	87.8	Confident	88.5	Confident	84 Å²	84	95.7 Å²	95.7	52%	0.515	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-39.7	176.5	58.3	0	0	0	0	112.2	R258 T259 N264 A265 I266	R258-T262 PolarHBondContact O-N 2.84Å; R258-T262 VanDerWaalsContact O-N 3.1Å; T259-T262 PolarHBondContact O-N 3.04Å; T259-T262 PolarHBondContact O-OG1 3.22Å; T259-T262 VanDerWaalsContact O-OG1 3.05Å; T262-N264 VanDerWaalsContact C-N 3.3Å; T262-N264 PolarHBondContact O-N 3.01Å; T262-A265 PolarHBondContact O-N 3.27Å; T262-I266 WeakPolarHBondContact O-CG1 3.5Å; T262-I266 PolarHBondContact O-N 2.92Å
263	M	84.5	Confident	88.4	Confident	92 Å²	92	97.5 Å²	97.5	45%	0.453	48%	0.477	S	S	.	.	H	α-helix	trans	-58.9	-40.8	172.6	179	-174.8	55.6	0	0	112	T259 R267	T259-M263 WeakPolarHBondContact O-CB 3.42Å; T259-M263 PolarHBondContact O-N 3.21Å; M263-R267 WeakPolarHBondContact O-CB 3.27Å; M263-R267 PolarHBondContact O-N 3.4Å
264	N	85.8	Confident	88.5	Confident	71 Å²	71	98.5 Å²	98.5	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-42.6	178.2	-73.5	-18.6	0	0	0	111.8	K260 A261 T262 I266 R267 E268	K260-N264 VanDerWaalsContact O-CG 3.27Å; K260-N264 PolarHBondContact O-N 2.94Å; K260-N264 PolarHBondContact O-ND2 2.8Å; A261-N264 PolarHBondContact O-N 3.31Å; T262-N264 VanDerWaalsContact C-N 3.3Å; T262-N264 PolarHBondContact O-N 3.01Å; N264-I266 PolarHBondContact O-N 3.15Å; N264-R267 WeakPolarHBondContact O-CB 3.25Å; N264-R267 PolarHBondContact O-N 3.47Å; N264-R267 VanDerWaalsContact O-N 3.15Å; N264-E268 PolarHBondContact O-N 3.41Å
265	A	90.3	Very high	88.6	Confident	53 Å²	53	99.7 Å²	99.7	44%	0.438	48%	0.475	S	S	.	.	H	α-helix	trans	-58.5	-46.7	173.9	0	0	0	0	0	112.1	A261 T262 R267 E268 E269	A261-A265 PolarHBondContact O-N 3.43Å; T262-A265 PolarHBondContact O-N 3.27Å; A265-R267 VanDerWaalsContact C-N 3.29Å; A265-R267 PolarHBondContact O-N 2.94Å; A265-E268 PolarHBondContact O-N 3.41Å; A265-E269 PolarHBondContact O-N 2.92Å
266	I	86.3	Confident	88.7	Confident	111 Å²	111	102.6 Å²	102.6	57%	0.569	48%	0.484	S	S	*	.	H	α-helix	trans	-61.8	-37.1	176.4	-66.7	165.4	0	0	0	111.3	T262 N264 R270	T262-I266 WeakPolarHBondContact O-CG1 3.5Å; T262-I266 PolarHBondContact O-N 2.92Å; N264-I266 PolarHBondContact O-N 3.15Å; I266-R270 WeakPolarHBondContact O-CB 3.48Å; I266-R270 PolarHBondContact O-N 3.03Å
267	R	87.6	Confident	89	Confident	113 Å²	113	102.2 Å²	102.2	43%	0.426	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-45.9	175.2	-172.2	-177.4	-61.1	-166.5	0.9	111.3	M263 N264 A265 R270 D271	M263-R267 WeakPolarHBondContact O-CB 3.27Å; M263-R267 PolarHBondContact O-N 3.4Å; N264-R267 WeakPolarHBondContact O-CB 3.25Å; N264-R267 PolarHBondContact O-N 3.47Å; N264-R267 VanDerWaalsContact O-N 3.15Å; A265-R267 VanDerWaalsContact C-N 3.29Å; A265-R267 PolarHBondContact O-N 2.94Å; R267-R270 PolarHBondContact O-N 2.94Å; R267-D271 PolarHBondContact O-N 2.98Å
268	E	93	Very high	89	Confident	138 Å²	138	105.6 Å²	105.6	65%	0.645	49%	0.492	S	S	*	.	H	α-helix	trans	-63.9	-42.5	177	-73.7	-179	-152.7	0	0	112.7	N264 A265 D271 R272	N264-E268 PolarHBondContact O-N 3.41Å; A265-E268 PolarHBondContact O-N 3.41Å; E268-D271 PolarHBondContact O-N 3.03Å; E268-R272 VanDerWaalsContact O-CB 3.25Å; E268-R272 WeakPolarHBondContact O-CB 3.37Å; E268-R272 PolarHBondContact O-N 2.86Å
269	E	90.4	Very high	88.9	Confident	130 Å²	130	102.6 Å²	102.6	61%	0.607	48%	0.484	S	S	*	.	H	α-helix	trans	-62.8	-46.7	173.8	-72.5	-158.3	137.8	0	0	111.7	A265 D271 R272 L273	A265-E269 PolarHBondContact O-N 2.92Å; E269-D271 VanDerWaalsContact C-N 3.32Å; E269-D271 PolarHBondContact O-N 3.09Å; E269-R272 CarbonylContact O-C 3.58Å; E269-R272 WeakPolarHBondContact O-CA 3.42Å; E269-R272 WeakPolarHBondContact O-CB 3.3Å; E269-R272 PolarHBondContact O-N 3.12Å; E269-R272 VanDerWaalsContact O-N 3.11Å; E269-L273 WeakPolarHBondContact O-CG 3.22Å; E269-L273 PolarHBondContact O-N 3.39Å
270	R	88.6	Confident	89.2	Confident	107 Å²	107	103.6 Å²	103.6	40%	0.404	49%	0.485	S	S	.	.	H	α-helix	trans	-59.8	-40.6	176.5	172.6	-98.7	-80.2	170	-7.5	111.9	I266 R267 L273 R274	I266-R270 WeakPolarHBondContact O-CB 3.48Å; I266-R270 PolarHBondContact O-N 3.03Å; R267-R270 PolarHBondContact O-N 2.94Å; R270-L273 PolarHBondContact O-N 2.87Å; R270-R274 WeakPolarHBondContact O-CG 3.4Å; R270-R274 PolarHBondContact O-N 2.99Å
271	D	88	Confident	88.9	Confident	54 Å²	54	104.5 Å²	104.5	29%	0.289	49%	0.491	S	S	.	.	H	α-helix	trans	-80.8	-17.6	177	-66.4	-33.6	0	0	0	113.1	R267 E268 E269 R274 R275	R267-D271 PolarHBondContact O-N 2.98Å; E268-D271 PolarHBondContact O-N 3.03Å; E269-D271 VanDerWaalsContact C-N 3.32Å; E269-D271 PolarHBondContact O-N 3.09Å; D271-R274 WeakPolarHBondContact OD1-CD 3.37Å; D271-R274 IonicContact OD1-CZ 3.61Å; D271-R274 IonicContact OD1-NE 3.68Å; D271-R274 IonicContact OD1-NH1 3.46Å; D271-R274 PolarHBondContact OD1-NH1 3.47Å; D271-R275 WeakPolarHBondContact O-CG 3.43Å; D271-R275 PolarHBondContact O-N 3.09Å; D271-R275 PolarHBondContact O-NE 2.93Å
272	R	94.4	Very high	88.6	Confident	176 Å²	176	106.1 Å²	106.1	66%	0.664	50%	0.495	S	S	*	.	H	α-helix	trans	-70.6	-45.2	164.2	-175.6	-175.2	-179.5	105.3	0.7	111.3	E268 E269 R275 R276	E268-R272 VanDerWaalsContact O-CB 3.25Å; E268-R272 WeakPolarHBondContact O-CB 3.37Å; E268-R272 PolarHBondContact O-N 2.86Å; E269-R272 CarbonylContact O-C 3.58Å; E269-R272 WeakPolarHBondContact O-CA 3.42Å; E269-R272 WeakPolarHBondContact O-CB 3.3Å; E269-R272 PolarHBondContact O-N 3.12Å; E269-R272 VanDerWaalsContact O-N 3.11Å; R272-R275 VanDerWaalsContact CA-NH2 3.34Å; R272-R275 WeakPolarHBondContact O-CB 3.36Å; R272-R275 PolarHBondContact O-N 2.88Å; R272-R276 PolarHBondContact O-N 2.8Å
273	L	87.2	Confident	88.5	Confident	117 Å²	117	108.7 Å²	108.7	61%	0.613	50%	0.495	S	S	*	.	H	α-helix	trans	-63	-45.3	174.6	-69.4	171.3	0	0	0	111.1	E269 R270 R275 R276 V277	E269-L273 WeakPolarHBondContact O-CG 3.22Å; E269-L273 PolarHBondContact O-N 3.39Å; R270-L273 PolarHBondContact O-N 2.87Å; L273-R275 VanDerWaalsContact C-N 3.26Å; L273-R275 PolarHBondContact O-N 3.03Å; L273-R276 PolarHBondContact O-N 2.78Å; L273-V277 WeakPolarHBondContact O-CG2 3.4Å; L273-V277 PolarHBondContact O-N 3.27Å
274	R	87.9	Confident	88.2	Confident	139 Å²	139	109.2 Å²	109.2	53%	0.525	50%	0.499	S	S	.	.	H	α-helix	trans	-59.9	-29.8	173.3	-76.4	165.8	158.9	-171.5	-6.8	114.2	R270 D271 R278	R270-R274 WeakPolarHBondContact O-CG 3.4Å; R270-R274 PolarHBondContact O-N 2.99Å; D271-R274 WeakPolarHBondContact OD1-CD 3.37Å; D271-R274 IonicContact OD1-CZ 3.61Å; D271-R274 IonicContact OD1-NE 3.68Å; D271-R274 IonicContact OD1-NH1 3.46Å; D271-R274 PolarHBondContact OD1-NH1 3.47Å; R274-R278 WeakPolarHBondContact O-CG 3.49Å; R274-R278 PolarHBondContact O-N 3.38Å; R274-R278 PolarHBondContact O-NE 2.8Å
275	R	92.8	Very high	87.8	Confident	136 Å²	136	111.8 Å²	111.8	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-70.9	-44.9	170.4	-79.6	173.4	-73.8	154.1	-9.9	111.2	D271 R272 L273 R278 E279	D271-R275 WeakPolarHBondContact O-CG 3.43Å; D271-R275 PolarHBondContact O-N 3.09Å; D271-R275 PolarHBondContact O-NE 2.93Å; R272-R275 VanDerWaalsContact CA-NH2 3.34Å; R272-R275 WeakPolarHBondContact O-CB 3.36Å; R272-R275 PolarHBondContact O-N 2.88Å; L273-R275 VanDerWaalsContact C-N 3.26Å; L273-R275 PolarHBondContact O-N 3.03Å; R275-R278 PolarHBondContact O-N 2.94Å; R275-E279 PolarHBondContact O-N 3.08Å
276	R	89.9	Confident	87	Confident	130 Å²	130	112.6 Å²	112.6	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-36.6	180	-167	57.9	164.8	-174.4	-2.5	113	R272 L273 E279 L280	R272-R276 PolarHBondContact O-N 2.8Å; L273-R276 PolarHBondContact O-N 2.78Å; R276-E279 VanDerWaalsContact CD-OE2 3.29Å; R276-E279 WeakPolarHBondContact CD-OE2 3.44Å; R276-E279 IonicContact CZ-OE2 3.4Å; R276-E279 IonicContact NE-OE2 2.62Å; R276-E279 IonicContact NH1-OE1 3.65Å; R276-E279 PolarHBondContact NH1-OE1 3.21Å; R276-E279 IonicContact NH1-OE2 2.69Å; R276-E279 PolarHBondContact NH1-OE2 3.17Å; R276-E279 PolarHBondContact O-N 3.46Å; R276-L280 HydrophobicContact CG-CD1 4.39Å; R276-L280 VanDerWaalsContact O-CG 3.29Å; R276-L280 WeakPolarHBondContact O-CG 3.48Å; R276-L280 PolarHBondContact O-N 2.98Å
277	V	89.1	Confident	86.3	Confident	78 Å²	78	112.1 Å²	112.1	47%	0.473	51%	0.513	S	S	.	.	H	α-helix	trans	-60.5	-47.8	172.5	169.9	0	0	0	0	110.8	L273 E279 L280 Q281	L273-V277 WeakPolarHBondContact O-CG2 3.4Å; L273-V277 PolarHBondContact O-N 3.27Å; V277-E279 PolarHBondContact O-N 3.36Å; V277-L280 PolarHBondContact O-N 2.93Å; V277-Q281 HydrophobicContact CG1-CG 4.47Å; V277-Q281 WeakPolarHBondContact O-CG 3.35Å; V277-Q281 PolarHBondContact O-N 2.87Å
278	R	89.1	Confident	85.1	Confident	143 Å²	143	113.3 Å²	113.3	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-61	-44	176.1	-75.8	-179.9	-72.4	147	-14.4	112.4	R274 R275 L280 Q281 T282	R274-R278 WeakPolarHBondContact O-CG 3.49Å; R274-R278 PolarHBondContact O-N 3.38Å; R274-R278 PolarHBondContact O-NE 2.8Å; R275-R278 PolarHBondContact O-N 2.94Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 3.1Å; R278-Q281 WeakPolarHBondContact O-CB 3.44Å; R278-Q281 PolarHBondContact O-N 2.97Å; R278-T282 PolarHBondContact O-N 2.87Å; R278-T282 PolarHBondContact O-OG1 3.33Å; R278-T282 VanDerWaalsContact O-OG1 3.1Å
279	E	91.3	Very high	83.3	Confident	68 Å²	68	110.9 Å²	110.9	32%	0.318	53%	0.527	S	S	.	.	H	α-helix	trans	-59.4	-40.9	175.7	-166.4	-159.8	150.4	0	0	112.2	R275 R276 V277 R283	R275-E279 PolarHBondContact O-N 3.08Å; R276-E279 VanDerWaalsContact CD-OE2 3.29Å; R276-E279 WeakPolarHBondContact CD-OE2 3.44Å; R276-E279 IonicContact CZ-OE2 3.4Å; R276-E279 IonicContact NE-OE2 2.62Å; R276-E279 IonicContact NH1-OE1 3.65Å; R276-E279 PolarHBondContact NH1-OE1 3.21Å; R276-E279 IonicContact NH1-OE2 2.69Å; R276-E279 PolarHBondContact NH1-OE2 3.17Å; R276-E279 PolarHBondContact O-N 3.46Å; V277-E279 PolarHBondContact O-N 3.36Å; E279-R283 WeakPolarHBondContact O-CB 3.46Å; E279-R283 VanDerWaalsContact O-CG 3.26Å; E279-R283 WeakPolarHBondContact O-CG 3.28Å; E279-R283 PolarHBondContact O-N 2.76Å; E279-R283 IonicContact OE1-CZ 2.8Å; E279-R283 VanDerWaalsContact OE1-CZ 3.26Å; E279-R283 IonicContact OE1-NE 2.73Å; E279-R283 PolarHBondContact OE1-NE 2.85Å; E279-R283 IonicContact OE1-NH2 3.53Å; E279-R283 PolarHBondContact OE1-NH2 3.41Å
280	L	88.7	Confident	81.4	Confident	95 Å²	95	110.2 Å²	110.2	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-37.4	175.6	-70.6	169.7	0	0	0	112.3	R276 V277 R278 R283 L284	R276-L280 HydrophobicContact CG-CD1 4.39Å; R276-L280 VanDerWaalsContact O-CG 3.29Å; R276-L280 WeakPolarHBondContact O-CG 3.48Å; R276-L280 PolarHBondContact O-N 2.98Å; V277-L280 PolarHBondContact O-N 2.93Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 3.1Å; L280-R283 PolarHBondContact O-N 2.93Å; L280-L284 WeakPolarHBondContact O-CB 3.32Å; L280-L284 PolarHBondContact O-N 2.88Å
281	Q	82.3	Confident	79.2	Confident	103 Å²	103	108 Å²	108	48%	0.481	54%	0.543	S	S	.	.	H	α-helix	trans	-62.9	-45.5	173.3	-72.9	168.8	-36.6	0	0	111.5	V277 R278 R283 L284 Q285	V277-Q281 HydrophobicContact CG1-CG 4.47Å; V277-Q281 WeakPolarHBondContact O-CG 3.35Å; V277-Q281 PolarHBondContact O-N 2.87Å; R278-Q281 WeakPolarHBondContact O-CB 3.44Å; R278-Q281 PolarHBondContact O-N 2.97Å; Q281-R283 PolarHBondContact O-N 2.74Å; Q281-L284 PolarHBondContact O-N 3.41Å; Q281-Q285 WeakPolarHBondContact O-CG 3.34Å; Q281-Q285 PolarHBondContact O-N 2.98Å
282	T	85.2	Confident	77.2	Confident	90 Å²	90	111.7 Å²	111.7	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-62.6	-42.3	175.1	-52.6	0	0	0	0	111.8	R278 L284 Q285 S286	R278-T282 PolarHBondContact O-N 2.87Å; R278-T282 PolarHBondContact O-OG1 3.33Å; R278-T282 VanDerWaalsContact O-OG1 3.1Å; T282-L284 PolarHBondContact O-N 2.81Å; T282-Q285 PolarHBondContact O-N 3.45Å; T282-S286 PolarHBondContact O-N 3.14Å; T282-S286 PolarHBondContact O-OG 2.67Å
283	R	86.6	Confident	74.4	Confident	139 Å²	139	108.4 Å²	108.4	53%	0.525	57%	0.573	S	S	.	*	H	α-helix	trans	-60.3	-44	174.1	-73.5	168.5	-177.8	-104.5	4.6	111.6	E279 L280 Q281 S286 V287	E279-R283 WeakPolarHBondContact O-CB 3.46Å; E279-R283 VanDerWaalsContact O-CG 3.26Å; E279-R283 WeakPolarHBondContact O-CG 3.28Å; E279-R283 PolarHBondContact O-N 2.76Å; E279-R283 IonicContact OE1-CZ 2.8Å; E279-R283 VanDerWaalsContact OE1-CZ 3.26Å; E279-R283 IonicContact OE1-NE 2.73Å; E279-R283 PolarHBondContact OE1-NE 2.85Å; E279-R283 IonicContact OE1-NH2 3.53Å; E279-R283 PolarHBondContact OE1-NH2 3.41Å; L280-R283 PolarHBondContact O-N 2.93Å; Q281-R283 PolarHBondContact O-N 2.74Å; R283-S286 PolarHBondContact O-N 2.91Å; R283-S286 PolarHBondContact O-OG 3.38Å; R283-V287 WeakPolarHBondContact O-CG2 3.42Å; R283-V287 PolarHBondContact O-N 3.48Å; R283-V287 VanDerWaalsContact O-N 3.13Å
284	L	78.7	Confident	72.1	Confident	103 Å²	103	107.7 Å²	107.7	54%	0.539	58%	0.578	S	S	.	*	H	α-helix	trans	-62.6	-45.8	177.6	-177.7	62.5	0	0	0	112	L280 Q281 T282 S286 V287 Q288	L280-L284 WeakPolarHBondContact O-CB 3.32Å; L280-L284 PolarHBondContact O-N 2.88Å; Q281-L284 PolarHBondContact O-N 3.41Å; T282-L284 PolarHBondContact O-N 2.81Å; L284-S286 VanDerWaalsContact C-N 3.35Å; L284-S286 PolarHBondContact O-N 3.25Å; L284-V287 PolarHBondContact O-N 2.86Å; L284-Q288 WeakPolarHBondContact O-CG 3.46Å; L284-Q288 PolarHBondContact O-N 3.19Å
285	Q	75.8	Confident	70.6	Confident	125 Å²	125	107.3 Å²	107.3	58%	0.584	59%	0.594	S	S	*	*	H	α-helix	trans	-60.4	-42.3	175.7	-72.9	171.1	-19.1	0	0	111.8	Q281 T282 V287 Q288 A289	Q281-Q285 WeakPolarHBondContact O-CG 3.34Å; Q281-Q285 PolarHBondContact O-N 2.98Å; T282-Q285 PolarHBondContact O-N 3.45Å; Q285-V287 VanDerWaalsContact C-N 3.32Å; Q285-V287 PolarHBondContact O-N 2.87Å; Q285-Q288 PolarHBondContact O-N 3.32Å; Q285-A289 WeakPolarHBondContact O-CB 3.34Å; Q285-A289 PolarHBondContact O-N 2.92Å
286	S	74.7	Confident	67.7	Low	69 Å²	69	104.2 Å²	104.2	48%	0.483	60%	0.604	S	S	.	*	H	α-helix	trans	-64.8	-32.4	177.7	68.7	0	0	0	0	113.7	T282 R283 L284	T282-S286 PolarHBondContact O-N 3.14Å; T282-S286 PolarHBondContact O-OG 2.67Å; R283-S286 PolarHBondContact O-N 2.91Å; R283-S286 PolarHBondContact O-OG 3.38Å; L284-S286 VanDerWaalsContact C-N 3.35Å; L284-S286 PolarHBondContact O-N 3.25Å
287	V	71.6	Confident	65	Low	101 Å²	101	108.7 Å²	108.7	61%	0.612	62%	0.621	S	S	*	*	H	α-helix	trans	-74.2	-40.2	174.8	171.4	0	0	0	0	111.1	R283 L284 Q285 A289 T290	R283-V287 WeakPolarHBondContact O-CG2 3.42Å; R283-V287 PolarHBondContact O-N 3.48Å; R283-V287 VanDerWaalsContact O-N 3.13Å; L284-V287 PolarHBondContact O-N 2.86Å; Q285-V287 VanDerWaalsContact C-N 3.32Å; Q285-V287 PolarHBondContact O-N 2.87Å; V287-A289 VanDerWaalsContact C-N 3.29Å; V287-A289 PolarHBondContact O-N 3.49Å; V287-T290 PolarHBondContact O-N 2.92Å; V287-T290 PolarHBondContact O-OG1 2.77Å
288	Q	62.2	Low	62.3	Low	139 Å²	139	111.6 Å²	111.6	65%	0.65	63%	0.633	S	S	*	*	H	α-helix	trans	-64.9	-31.5	175.3	-73.4	-180	-34.9	0	0	112.8	L284 Q285 T290	L284-Q288 WeakPolarHBondContact O-CG 3.46Å; L284-Q288 PolarHBondContact O-N 3.19Å; Q285-Q288 PolarHBondContact O-N 3.32Å; Q288-T290 PolarHBondContact O-N 3.3Å
289	A	54	Low	59.6	Low	87 Å²	87	109.8 Å²	109.8	72%	0.719	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-4.9	177.1	0	0	0	0	0	114.9	Q285 V287	Q285-A289 WeakPolarHBondContact O-CB 3.34Å; Q285-A289 PolarHBondContact O-N 2.92Å; V287-A289 VanDerWaalsContact C-N 3.29Å; V287-A289 PolarHBondContact O-N 3.49Å
290	T	51.1	Low	56.8	Low	116 Å²	116	111.4 Å²	111.4	71%	0.712	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	12.9	-173.9	52	0	0	0	0	115.7	V287 Q288	V287-T290 PolarHBondContact O-N 2.92Å; V287-T290 PolarHBondContact O-OG1 2.77Å; Q288-T290 PolarHBondContact O-N 3.3Å
291	G	42.9	Very low	54.2	Low	60 Å²	60	112.7 Å²	112.7	62%	0.619	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-102.4	131.9	178.8	0	0	0	0	0	114.2
292	P	45	Very low	51.8	Low	132 Å²	132	114.9 Å²	114.9	86%	0.857	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-81.2	167.9	175.5	33.7	-35.4	0	0	0	113.6
293	S	36.4	Very low	49.6	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-71.3	138.4	-173.3	-169.8	0	0	0	0	115.1
294	S	38.7	Very low	47.4	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	71%	0.706	S	S	*	*			trans	25.9	162.9	136.4	-30.5	0	0	0	0	122.3
295	P	56.8	Low	45.1	Very low	131 Å²	131	119.2 Å²	119.2	85%	0.851	71%	0.707	S	S	*	*			cis	-136.3	-179.6	-5.6	42	-25.5	0	0	0	115.6
296	G	31	Very low	43.1	Very low	71 Å²	71	120.1 Å²	120.1	73%	0.732	72%	0.716	S	S	*	*			trans	132.8	122.5	139.5	0	0	0	0	0	121.3
297	R	33.6	Very low	41.8	Very low	224 Å²	224	121.9 Å²	121.9	85%	0.845	73%	0.726	S	S	*	*			trans	31.3	140.4	139	-84.6	-178.9	-174.3	-106.4	-0.7	120.6
298	L	33.4	Very low	39.8	Very low	139 Å²	139	122.5 Å²	122.5	73%	0.728	74%	0.735	S	S	*	*			cis	-149.8	146.9	46.3	-84	171.3	0	0	0	115.3
299	T	32.4	Very low	38.4	Very low	106 Å²	106	122.7 Å²	122.7	65%	0.65	75%	0.745	S	S	*	*			trans	-8.3	149	144.3	58.2	0	0	0	0	118.6
300	S	31.3	Very low	37.4	Very low	101 Å²	101	121.8 Å²	121.8	71%	0.706	74%	0.744	S	S	*	*				-168.4	165	50	-105.9	0	0	0	0	109
301	T	34.3	Very low	36.4	Very low	122 Å²	122	125.4 Å²	125.4	75%	0.748	75%	0.753	S	S	*	*			cis	-150.8	-173.6	1.5	-0.1	0	0	0	0	106.4
302	N	32.1	Very low	35.7	Very low	150 Å²	150	130.5 Å²	130.5	80%	0.802	77%	0.766	S	S	*	*			cis	-148.6	-170.7	9.3	-151.5	-6	0	0	0	111.3
303	R	38.3	Very low	35	Very low	183 Å²	183	129.6 Å²	129.6	69%	0.691	76%	0.762	S	S	*	*			trans	-145.2	160.1	170.4	-137.1	172.9	176.7	-165.2	-1.5	111.2	I305	R303-I305 HydrophobicContact CG-CG1 4.1Å
304	P	40.4	Very low	34.7	Very low	129 Å²	129	131.1 Å²	131.1	84%	0.838	77%	0.767	S	S	*	*				-132.3	178.3	108.3	38.6	-30.9	0	0	0	113.4
305	I	32.2	Very low	34.2	Very low	111 Å²	111	131.4 Å²	131.4	57%	0.569	77%	0.769	S	S	*	*			trans	-127.6	151	-166	-47.6	172.8	0	0	0	109.7	R303	R303-I305 HydrophobicContact CG-CG1 4.1Å
306	N	32.9	Very low	33.2	Very low	143 Å²	143	131.4 Å²	131.4	77%	0.765	77%	0.772	S	S	*	*			trans	132.1	166.1	135.9	-122.1	22.8	0	0	0	113.7
307	P	46.8	Very low	33.4	Very low	107 Å²	107	133.3 Å²	133.3	70%	0.695	78%	0.775	S	S	*	*				-133.2	154	-109.9	39.3	-20.9	0	0	0	115.6
308	S	30	Very low	33.4	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	76%	0.763	S	S	*	*			trans	-150.8	141.4	154.4	59.4	0	0	0	0	112.3
309	T	33.5	Very low	33.3	Very low	142 Å²	142	127.8 Å²	127.8	87%	0.871	77%	0.769	S	S	*	*			trans	-42.2	149.1	158.5	47.2	0	0	0	0	113.9
310	G	32.2	Very low	33.4	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	78%	0.777	S	S	*	*			trans	140.1	101.6	160.4	0	0	0	0	0	114.5
311	E	30.3	Very low	33.6	Very low	192 Å²	192	132.2 Å²	132.2	90%	0.897	78%	0.78	S	S	*	*			trans	9.4	122.1	152.3	-53.3	-175.3	145.2	0	0	119
312	L	29	Very low	34	Very low	168 Å²	168	132.6 Å²	132.6	88%	0.88	78%	0.784	S	S	*	*			trans	-136.6	122.1	153.4	-81.8	-179.3	0	0	0	111.3
313	S	30.5	Very low	34.1	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	79%	0.787	S	S	*	*			trans	-65.6	141.4	163.3	-51.9	0	0	0	0	110.5
314	T	28.3	Very low	33.9	Very low	137 Å²	137	129.1 Å²	129.1	84%	0.84	79%	0.79	S	S	*	*			trans	-109.1	87.2	170	56	0	0	0	0	110.6
315	S	29.8	Very low	34	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	79%	0.794	S	S	*	*			trans	-64	144.4	167.8	-51	0	0	0	0	110.7	S317	S315-S317 PolarHBondContact O-N 3.16Å
316	S	35.4	Very low	34.4	Very low	130 Å²	130	135.9 Å²	135.9	91%	0.909	81%	0.809	S	S	*	*			trans	-61.6	127.5	176.8	-56.1	0	0	0	0	112
317	S	34.7	Very low	34.6	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	81%	0.811	S	S	*	*			trans	-153.3	163.8	163.9	-164.2	0	0	0	0	111.7	S315	S315-S317 PolarHBondContact O-N 3.16Å
318	S	33.4	Very low	34.1	Very low	87 Å²	87	137.6 Å²	137.6	61%	0.608	82%	0.82	S	S	*	*			trans	-35.2	143.6	-170.7	55.7	0	0	0	0	118.3
319	N	31.1	Very low	35.1	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	83%	0.828	S	S	*	*			trans	-136.1	116.3	140.3	-93	-79	0	0	0	109.7
320	D	34.8	Very low	35.3	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	82%	0.819	S	S	*	*			trans	-70.9	152.9	172	-67.6	-79.6	0	0	0	112.1
321	I	35.9	Very low	36.1	Very low	150 Å²	150	149.7 Å²	149.7	77%	0.769	83%	0.829	S	S	*	*			trans	-126.2	126.3	168.7	-60.2	178.5	0	0	0	107.6	I323	I321-I323 PolarHBondContact O-N 2.88Å
322	P	42.1	Very low	36.3	Very low	130 Å²	130	147.9 Å²	147.9	84%	0.844	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.5	124.9	-164.8	28	-35.4	0	0	0	113.2
323	I	34.5	Very low	36.8	Very low	166 Å²	166	145.1 Å²	145.1	85%	0.851	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-85.5	130	173.7	-59.8	176.6	0	0	0	109.8	I321	I321-I323 PolarHBondContact O-N 2.88Å
324	A	33.3	Very low	37.2	Very low	93 Å²	93	147.8 Å²	147.8	77%	0.769	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-72.4	136.7	-178.1	0	0	0	0	0	112.6
325	K	43.7	Very low	37.4	Very low	208 Å²	208	148 Å²	148	90%	0.904	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.7	117.3	173.8	-70.4	179.9	178.2	176.6	0	111.4
326	I	39	Very low	37.9	Very low	174 Å²	174	151.4 Å²	151.4	89%	0.892	81%	0.814	S	S	*	*			trans	-128.3	144	146.3	-60	-178.2	0	0	0	106.2
327	A	38.9	Very low	38	Very low	99 Å²	99	150.3 Å²	150.3	82%	0.818	81%	0.807	S	S	*	*			trans	-124.4	139.6	-172.2	0	0	0	0	0	111.7
328	E	35.8	Very low	38.3	Very low	188 Å²	188	154.3 Å²	154.3	88%	0.879	81%	0.813	S	S	*	*			trans	-142.2	146.3	156.2	-171	157.1	-155.6	0	0	109.5
329	R	50.3	Low	38.4	Very low	254 Å²	254	155.3 Å²	155.3	96%	0.958	82%	0.82	S	S	*	*			trans	-95	97	-177.7	-77.7	-173.7	173.2	-164	-0.5	110.9
330	V	38.4	Very low	38.6	Very low	113 Å²	113	151.8 Å²	151.8	69%	0.685	81%	0.808	S	S	*	*			trans	-106.7	126.8	158	-178.4	0	0	0	0	108.4	L332	V330-L332 VanDerWaalsContact C-N 3.3Å; V330-L332 HydrophobicContact CG1-CD2 4.23Å; V330-L332 PolarHBondContact O-N 2.91Å
331	K	49.3	Very low	38.9	Very low	210 Å²	210	149.1 Å²	149.1	91%	0.913	80%	0.801	S	S	*	*			trans	-78	79.7	178.7	-173.5	-170.7	176.2	-171.1	0	109.3	S333	K331-S333 PolarHBondContact O-N 3.31Å
332	L	34.5	Very low	39.1	Very low	154 Å²	154	147 Å²	147	81%	0.806	80%	0.8	S	S	*	*			trans	-60.6	131.4	176.8	-64.8	175.5	0	0	0	110.5	V330	V330-L332 VanDerWaalsContact C-N 3.3Å; V330-L332 HydrophobicContact CG1-CD2 4.23Å; V330-L332 PolarHBondContact O-N 2.91Å
333	S	38.8	Very low	39	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	79%	0.79	S	S	*	*			trans	-70.5	149.1	174.1	37.3	0	0	0	0	111.1	K331 T335	K331-S333 PolarHBondContact O-N 3.31Å; S333-T335 PolarHBondContact O-N 2.89Å; S333-T335 VanDerWaalsContact O-N 3.13Å
334	K	38	Very low	39.5	Very low	170 Å²	170	149.1 Å²	149.1	74%	0.739	79%	0.789	S	S	*	*			trans	-67.9	108.2	-177.7	-170.3	175.8	-178.4	-177.5	0	109.4	R336	K334-R336 PolarHBondContact O-N 2.82Å; K334-R336 VanDerWaalsContact O-N 3.09Å
335	T	33.6	Very low	40.2	Very low	140 Å²	140	150.3 Å²	150.3	86%	0.859	79%	0.789	S	S	*	*			trans	-65.2	106.1	173.6	48.5	0	0	0	0	109.6	S333	S333-T335 PolarHBondContact O-N 2.89Å; S333-T335 VanDerWaalsContact O-N 3.13Å
336	R	41.2	Very low	40.6	Very low	181 Å²	181	144.9 Å²	144.9	68%	0.683	77%	0.773	S	S	*	*			trans	-84.2	144	171.3	-164	-177.5	-165.4	-145.4	5.7	108.7	K334 E338 Q369	K334-R336 PolarHBondContact O-N 2.82Å; K334-R336 VanDerWaalsContact O-N 3.09Å; R336-E338 PolarHBondContact O-N 2.82Å; R336-Q369 VanDerWaalsContact CZ-OE1 3.32Å
337	S	35.6	Very low	41.4	Very low	107 Å²	107	142 Å²	142	75%	0.748	76%	0.759	S	S	*	*			trans	-62.3	128.8	178.6	-47.5	0	0	0	0	111.4	S339	S337-S339 PolarHBondContact O-N 3.16Å
338	E	41.4	Very low	42.2	Very low	197 Å²	197	139 Å²	139	92%	0.921	74%	0.737	S	S	*	*			trans	-81.9	92.4	174.3	-67.5	-176.3	153.2	0	0	110	R336	R336-E338 PolarHBondContact O-N 2.82Å
339	S	36.5	Very low	43.2	Very low	107 Å²	107	134.2 Å²	134.2	75%	0.748	73%	0.725	S	S	*	*			trans	-151.7	45.6	178.3	69.2	0	0	0	0	114.1	S337	S337-S339 PolarHBondContact O-N 3.16Å
340	S	35.2	Very low	43.5	Very low	86 Å²	86	126.4 Å²	126.4	60%	0.601	70%	0.699	S	S	*	*			trans	-150.5	129.4	163.5	53.3	0	0	0	0	109.9
341	S	41.3	Very low	44.3	Very low	95 Å²	95	122.8 Å²	122.8	66%	0.664	68%	0.675	S	S	*	*	S	Bend	trans	-98.5	14.6	-164.9	51.9	0	0	0	0	115.7
342	S	39.6	Very low	44.6	Very low	106 Å²	106	116.4 Å²	116.4	74%	0.741	66%	0.657	S	S	*	*			trans	-116.7	-13	-170.4	-165.7	0	0	0	0	116
343	D	40.1	Very low	45.4	Very low	120 Å²	120	113.8 Å²	113.8	64%	0.642	65%	0.652	S	S	*	*			trans	-93.9	109.6	-170.1	-64.8	-37	0	0	0	112.4
344	R	44.4	Very low	46.4	Very low	219 Å²	219	115.1 Å²	115.1	83%	0.826	65%	0.649	S	S	*	*			trans	-65.6	129.6	153.4	-71.9	173.2	68.5	125.5	-5.1	107	V346	R344-V346 PolarHBondContact O-N 3.13Å
345	P	48.8	Very low	47.1	Very low	118 Å²	118	110.3 Å²	110.3	77%	0.766	65%	0.647	S	S	*	*			trans	-67.7	101	177.9	27	-33.4	0	0	0	109.5	L347	P345-L347 PolarHBondContact O-N 3Å; P345-L347 VanDerWaalsContact O-N 3.14Å
346	V	52.1	Low	48.2	Very low	95 Å²	95	106.4 Å²	106.4	58%	0.576	62%	0.623	S	S	*	*			trans	-57.6	116.5	179.8	-177	0	0	0	0	108.9	R344 E350 I351	R344-V346 PolarHBondContact O-N 3.13Å; V346-E350 WeakPolarHBondContact CA-OE2 3.48Å; V346-E350 HydrophobicContact CG1-CB 3.84Å; V346-I351 HydrophobicContact CG1-CD1 4.46Å; V346-I351 HydrophobicContact CG1-CG1 3.72Å
347	L	56.5	Low	49.5	Very low	114 Å²	114	100.6 Å²	100.6	60%	0.597	61%	0.611	S	S	*	*			trans	-73.6	144.8	-177.5	-75.5	160.9	0	0	0	109.2	P345 S349 E350 I351	P345-L347 PolarHBondContact O-N 3Å; P345-L347 VanDerWaalsContact O-N 3.14Å; L347-S349 PolarHBondContact O-N 3.05Å; L347-E350 HydrophobicContact CB-CG 4.48Å; L347-E350 PolarHBondContact N-OE2 3.38Å; L347-E350 WeakPolarHBondContact O-CA 3.37Å; L347-E350 WeakPolarHBondContact O-CB 3.5Å; L347-E350 PolarHBondContact O-N 3.4Å; L347-I351 PolarHBondContact O-N 2.94Å
348	G	55.6	Low	51.1	Low	35 Å²	35	97.8 Å²	97.8	36%	0.361	59%	0.591	S	S	.	*	H	α-helix	trans	-56.9	-21.1	-177.5	0	0	0	0	0	114.7	S352	G348-S352 WeakPolarHBondContact O-CB 3.29Å; G348-S352 PolarHBondContact O-N 2.96Å; G348-S352 VanDerWaalsContact O-N 3.09Å
349	S	57.1	Low	52.4	Low	88 Å²	88	91.4 Å²	91.4	62%	0.615	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-33.7	169.9	45.1	0	0	0	0	114.2	L347 S353	L347-S349 PolarHBondContact O-N 3.05Å; S349-S353 PolarHBondContact O-N 2.98Å
350	E	55	Low	54.1	Low	90 Å²	90	89.8 Å²	89.8	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-77.8	-39.9	178.2	-60.5	169.1	154.4	0	0	110.3	V346 L347 S352 S353	V346-E350 WeakPolarHBondContact CA-OE2 3.48Å; V346-E350 HydrophobicContact CG1-CB 3.84Å; L347-E350 HydrophobicContact CB-CG 4.48Å; L347-E350 PolarHBondContact N-OE2 3.38Å; L347-E350 WeakPolarHBondContact O-CA 3.37Å; L347-E350 WeakPolarHBondContact O-CB 3.5Å; L347-E350 PolarHBondContact O-N 3.4Å; E350-S352 VanDerWaalsContact C-N 3.28Å; E350-S352 PolarHBondContact O-N 3.27Å; E350-S353 PolarHBondContact O-N 3.42Å; E350-S353 PolarHBondContact O-OG 3.02Å
351	I	55	Low	55.9	Low	36 Å²	36	86.8 Å²	86.8	19%	0.185	53%	0.534	C	S	.	.	H	α-helix	trans	-59.4	-43	172.4	-49.7	179.3	0	0	0	110.3	V346 L347 S353 I354 V356 A361	V346-I351 HydrophobicContact CG1-CD1 4.46Å; V346-I351 HydrophobicContact CG1-CG1 3.72Å; L347-I351 PolarHBondContact O-N 2.94Å; I351-S353 VanDerWaalsContact C-N 3.31Å; I351-S353 PolarHBondContact O-N 3.35Å; I351-I354 PolarHBondContact O-N 2.86Å; I351-V356 CarbonylContact C-O 3.44Å; I351-V356 HydrophobicContact CG2-CB 3.98Å; I351-V356 HydrophobicContact CG2-CG1 4.09Å; I351-V356 PolarHBondContact O-N 2.96Å; I351-A361 HydrophobicContact CD1-CB 4.02Å; I351-A361 HydrophobicContact CG2-CB 3.82Å
352	S	57	Low	57.6	Low	77 Å²	77	87.3 Å²	87.3	54%	0.538	53%	0.526	S	S	.	.	H	α-helix	trans	-70.2	-19.2	179.2	-169.7	0	0	0	0	114.5	G348 E350 G355	G348-S352 WeakPolarHBondContact O-CB 3.29Å; G348-S352 PolarHBondContact O-N 2.96Å; G348-S352 VanDerWaalsContact O-N 3.09Å; E350-S352 VanDerWaalsContact C-N 3.28Å; E350-S352 PolarHBondContact O-N 3.27Å; S352-G355 PolarHBondContact O-N 3.48Å
353	S	50.7	Low	59.3	Low	98 Å²	98	88.6 Å²	88.6	69%	0.685	52%	0.52	S	S	*	.	H	α-helix	trans	-78.9	-23.6	176.9	76	0	0	0	0	112.5	S349 E350 I351	S349-S353 PolarHBondContact O-N 2.98Å; E350-S353 PolarHBondContact O-N 3.42Å; E350-S353 PolarHBondContact O-OG 3.02Å; I351-S353 VanDerWaalsContact C-N 3.31Å; I351-S353 PolarHBondContact O-N 3.35Å
354	I	59.8	Low	61.1	Low	139 Å²	139	85.2 Å²	85.2	71%	0.713	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-5.6	173.4	-63.3	166.8	0	0	0	111.3	I351	I351-I354 PolarHBondContact O-N 2.86Å
355	G	51.9	Low	62.7	Low	68 Å²	68	77.6 Å²	77.6	70%	0.701	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	7.7	178.8	0	0	0	0	0	114.7	S352	S352-G355 PolarHBondContact O-N 3.48Å
356	V	58.4	Low	64.2	Low	58 Å²	58	76.8 Å²	76.8	35%	0.352	47%	0.471	S	S	.	.			trans	-93.9	126.3	175.1	-178.8	0	0	0	0	109.2	I351 V360 A361	I351-V356 CarbonylContact C-O 3.44Å; I351-V356 HydrophobicContact CG2-CB 3.98Å; I351-V356 HydrophobicContact CG2-CG1 4.09Å; I351-V356 PolarHBondContact O-N 2.96Å; V356-V360 HydrophobicContact CG1-CB 4.31Å; V356-V360 HydrophobicContact CG1-CG1 4.28Å; V356-A361 HydrophobicContact CG1-CB 4.48Å
357	S	67.3	Low	65.4	Low	60 Å²	60	74.6 Å²	74.6	42%	0.42	46%	0.46	S	S	.	.			trans	-71	136.6	175.4	53.2	0	0	0	0	111.3	S359 V360 A361	S357-S359 PolarHBondContact O-N 3.16Å; S357-S359 VanDerWaalsContact O-N 3.09Å; S357-V360 WeakPolarHBondContact O-CB 3.47Å; S357-V360 PolarHBondContact O-N 2.63Å; S357-V360 VanDerWaalsContact OG-CG2 3.3Å; S357-V360 WeakPolarHBondContact OG-CG2 3.4Å; S357-A361 PolarHBondContact O-N 3.39Å
358	S	69.5	Low	66.4	Low	47 Å²	47	71.3 Å²	71.3	33%	0.329	44%	0.442	S	S	.	.	H	α-helix	trans	-46.3	-44.1	-179.5	-162.5	0	0	0	0	113.2	V360 A361 E362	S358-V360 VanDerWaalsContact C-N 3.28Å; S358-V360 PolarHBondContact O-N 2.8Å; S358-A361 PolarHBondContact O-N 3.47Å; S358-A361 VanDerWaalsContact O-N 3.1Å; S358-E362 VanDerWaalsContact C-OE1 3.28Å; S358-E362 WeakPolarHBondContact CB-OE1 3.44Å; S358-E362 WeakPolarHBondContact O-CB 3.49Å; S358-E362 WeakPolarHBondContact O-CG 3.46Å; S358-E362 PolarHBondContact O-N 2.86Å; S358-E362 PolarHBondContact OG-OE1 2.86Å
359	S	68.3	Low	67.6	Low	63 Å²	63	73.7 Å²	73.7	44%	0.441	44%	0.444	S	S	.	.	H	α-helix	trans	-57.8	-32.9	177.1	50.5	0	0	0	0	114.6	S357 H363	S357-S359 PolarHBondContact O-N 3.16Å; S357-S359 VanDerWaalsContact O-N 3.09Å; S359-H363 VanDerWaalsContact O-CB 3.31Å; S359-H363 WeakPolarHBondContact O-CB 3.49Å; S359-H363 PolarHBondContact O-CD2 2.78Å; S359-H363 PolarHBondContact O-N 2.91Å
360	V	72.7	Confident	68.8	Low	73 Å²	73	74.8 Å²	74.8	44%	0.442	44%	0.443	S	S	.	.	H	α-helix	trans	-76.6	-38.3	177.1	171.2	0	0	0	0	110.7	V356 S357 S358 H363 L364	V356-V360 HydrophobicContact CG1-CB 4.31Å; V356-V360 HydrophobicContact CG1-CG1 4.28Å; S357-V360 WeakPolarHBondContact O-CB 3.47Å; S357-V360 PolarHBondContact O-N 2.63Å; S357-V360 VanDerWaalsContact OG-CG2 3.3Å; S357-V360 WeakPolarHBondContact OG-CG2 3.4Å; S358-V360 VanDerWaalsContact C-N 3.28Å; S358-V360 PolarHBondContact O-N 2.8Å; V360-H363 PolarHBondContact O-N 3.13Å; V360-L364 WeakPolarHBondContact O-CB 3.47Å; V360-L364 PolarHBondContact O-N 2.94Å
361	A	73.3	Confident	70.1	Confident	24 Å²	24	71.7 Å²	71.7	20%	0.198	43%	0.431	C	S	.	.	H	α-helix	trans	-66.8	-40.6	173	0	0	0	0	0	111.7	I351 V356 S357 S358 L364 A365	I351-A361 HydrophobicContact CD1-CB 4.02Å; I351-A361 HydrophobicContact CG2-CB 3.82Å; V356-A361 HydrophobicContact CG1-CB 4.48Å; S357-A361 PolarHBondContact O-N 3.39Å; S358-A361 PolarHBondContact O-N 3.47Å; S358-A361 VanDerWaalsContact O-N 3.1Å; A361-L364 PolarHBondContact O-N 2.97Å; A361-A365 VanDerWaalsContact O-CB 3.27Å; A361-A365 WeakPolarHBondContact O-CB 3.27Å; A361-A365 PolarHBondContact O-N 3.21Å
362	E	76.9	Confident	71.1	Confident	106 Å²	106	75.6 Å²	75.6	50%	0.495	46%	0.462	S	S	.	.	H	α-helix	trans	-63.1	-44.9	173.3	-71.9	163.7	-122.7	0	0	111.6	S358 A365 H366	S358-E362 VanDerWaalsContact C-OE1 3.28Å; S358-E362 WeakPolarHBondContact CB-OE1 3.44Å; S358-E362 WeakPolarHBondContact O-CB 3.49Å; S358-E362 WeakPolarHBondContact O-CG 3.46Å; S358-E362 PolarHBondContact O-N 2.86Å; S358-E362 PolarHBondContact OG-OE1 2.86Å; E362-A365 PolarHBondContact O-N 3.14Å; E362-H366 WeakPolarHBondContact O-CB 3.5Å; E362-H366 PolarHBondContact O-CD2 3.38Å; E362-H366 VanDerWaalsContact O-CD2 3.26Å; E362-H366 PolarHBondContact O-N 3.01Å
363	H	74.1	Confident	72	Confident	132 Å²	132	75.7 Å²	75.7	61%	0.611	46%	0.456	S	S	*	.	H	α-helix	trans	-64.7	-39.1	175.2	-82.9	-57.4	0	0	0	112.6	S359 V360 S367	S359-H363 VanDerWaalsContact O-CB 3.31Å; S359-H363 WeakPolarHBondContact O-CB 3.49Å; S359-H363 PolarHBondContact O-CD2 2.78Å; S359-H363 PolarHBondContact O-N 2.91Å; V360-H363 PolarHBondContact O-N 3.13Å; H363-S367 WeakPolarHBondContact O-CB 3.37Å; H363-S367 PolarHBondContact O-N 2.69Å; H363-S367 PolarHBondContact O-OG 3.11Å
364	L	79.6	Confident	73.4	Confident	50 Å²	50	72.9 Å²	72.9	26%	0.262	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-49	175	-176.6	70.1	0	0	0	110.9	V360 A361 H366 S367 L368 H384	V360-L364 WeakPolarHBondContact O-CB 3.47Å; V360-L364 PolarHBondContact O-N 2.94Å; A361-L364 PolarHBondContact O-N 2.97Å; L364-H366 VanDerWaalsContact C-N 3.31Å; L364-H366 PolarHBondContact O-N 2.6Å; L364-S367 PolarHBondContact O-N 2.82Å; L364-L368 HydrophobicContact CD1-CD1 4.23Å; L364-L368 HydrophobicContact CD1-CG 4.49Å; L364-L368 HydrophobicContact CD2-CD1 4.5Å; L364-L368 HydrophobicContact CG-CD1 3.87Å; L364-L368 WeakPolarHBondContact O-CB 3.26Å; L364-L368 VanDerWaalsContact O-CG 3.3Å; L364-L368 WeakPolarHBondContact O-CG 3.37Å; L364-L368 PolarHBondContact O-N 3.24Å; L364-H384 HydrophobicContact CD1-CB 3.89Å; L364-H384 WeakPolarHBondContact CD1-CD2 3.27Å; L364-H384 VanDerWaalsContact CD1-CG 3.49Å
365	A	77.9	Confident	74.3	Confident	58 Å²	58	71.7 Å²	71.7	48%	0.479	42%	0.424	S	S	.	.	H	α-helix	trans	-61.2	-38.3	178.2	0	0	0	0	0	112.3	A361 E362 Q369	A361-A365 VanDerWaalsContact O-CB 3.27Å; A361-A365 WeakPolarHBondContact O-CB 3.27Å; A361-A365 PolarHBondContact O-N 3.21Å; E362-A365 PolarHBondContact O-N 3.14Å; A365-Q369 WeakPolarHBondContact O-CB 3.48Å; A365-Q369 PolarHBondContact O-N 3.2Å
366	H	78.6	Confident	75.7	Confident	102 Å²	102	72.8 Å²	72.8	47%	0.472	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-47.8	171.7	-89.1	-67.7	0	0	0	112.2	E362 L364 L368 Q369 D370	E362-H366 WeakPolarHBondContact O-CB 3.5Å; E362-H366 PolarHBondContact O-CD2 3.38Å; E362-H366 VanDerWaalsContact O-CD2 3.26Å; E362-H366 PolarHBondContact O-N 3.01Å; L364-H366 VanDerWaalsContact C-N 3.31Å; L364-H366 PolarHBondContact O-N 2.6Å; H366-L368 VanDerWaalsContact C-N 3.31Å; H366-L368 PolarHBondContact O-N 2.69Å; H366-Q369 PolarHBondContact O-N 2.9Å; H366-D370 PolarHBondContact O-N 3.41Å
367	S	77.6	Confident	76.9	Confident	48 Å²	48	72.7 Å²	72.7	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-58.9	-42.8	-179.9	-55.5	0	0	0	0	111.9	H363 L364 C371	H363-S367 WeakPolarHBondContact O-CB 3.37Å; H363-S367 PolarHBondContact O-N 2.69Å; H363-S367 PolarHBondContact O-OG 3.11Å; L364-S367 PolarHBondContact O-N 2.82Å; S367-C371 PolarHBondContact O-N 3.11Å; S367-C371 PolarHBondContact O-SG 3.04Å
368	L	79.1	Confident	77.6	Confident	45 Å²	45	70.7 Å²	70.7	24%	0.236	39%	0.392	C	S	.	.	H	α-helix	trans	-70.6	-29.7	176.1	-66.4	168	0	0	0	113.2	L364 H366 I377 T380 L381	L364-L368 HydrophobicContact CD1-CD1 4.23Å; L364-L368 HydrophobicContact CD1-CG 4.49Å; L364-L368 HydrophobicContact CD2-CD1 4.5Å; L364-L368 HydrophobicContact CG-CD1 3.87Å; L364-L368 WeakPolarHBondContact O-CB 3.26Å; L364-L368 VanDerWaalsContact O-CG 3.3Å; L364-L368 WeakPolarHBondContact O-CG 3.37Å; L364-L368 PolarHBondContact O-N 3.24Å; H366-L368 VanDerWaalsContact C-N 3.31Å; H366-L368 PolarHBondContact O-N 2.69Å; L368-I377 HydrophobicContact CD2-CG2 4.06Å; L368-T380 VanDerWaalsContact CD2-OG1 3.31Å; L368-T380 WeakPolarHBondContact CD2-OG1 3.48Å; L368-L381 HydrophobicContact CD1-CD2 4.15Å; L368-L381 HydrophobicContact CD2-CD2 4.01Å; L368-L381 HydrophobicContact CD2-CG 3.86Å
369	Q	80.4	Confident	78.2	Confident	86 Å²	86	74.7 Å²	74.7	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-80.1	-21.9	179.7	-176.1	61.2	91	0	0	112.9	R336 A365 H366	R336-Q369 VanDerWaalsContact CZ-OE1 3.32Å; A365-Q369 WeakPolarHBondContact O-CB 3.48Å; A365-Q369 PolarHBondContact O-N 3.2Å; H366-Q369 PolarHBondContact O-N 2.9Å
370	D	82.1	Confident	78.8	Confident	110 Å²	110	73.2 Å²	73.2	59%	0.588	39%	0.394	S	S	*	.	S	Bend	trans	-93	-5.8	177.3	-63.8	-23.9	0	0	0	112.5	H366	H366-D370 PolarHBondContact O-N 3.41Å
371	C	81.6	Confident	79.1	Confident	26 Å²	26	71.6 Å²	71.6	18%	0.176	38%	0.383	C	S	.	.			trans	-64.6	136.7	169.1	-68.6	0	0	0	0	111.9	S367 E376 I377	S367-C371 PolarHBondContact O-N 3.11Å; S367-C371 PolarHBondContact O-SG 3.04Å; C371-E376 HydrophobicContact CB-CB 3.97Å; C371-I377 HydrophobicContact CB-CD1 4.39Å; C371-I377 HydrophobicContact CB-CG1 3.52Å
372	S	76.6	Confident	79.4	Confident	118 Å²	118	74.9 Å²	74.9	83%	0.825	39%	0.391	S	S	*	.			trans	-100.4	-16.9	179.4	-61.2	0	0	0	0	113.7	E376	S372-E376 WeakPolarHBondContact CA-OE2 3.4Å; S372-E376 PolarHBondContact N-OE2 3.05Å
373	N	76.6	Confident	79.5	Confident	78 Å²	78	73.8 Å²	73.8	42%	0.417	40%	0.395	S	S	.	.	S	Bend	trans	-135.5	150.7	-179.9	-176.6	14	0	0	0	111.5	Q375 E376 I377	N373-Q375 PolarHBondContact O-N 3.44Å; N373-E376 HydrophobicContact CB-CG 4.29Å; N373-E376 PolarHBondContact N-OE2 2.92Å; N373-E376 WeakPolarHBondContact O-CB 3.41Å; N373-E376 PolarHBondContact O-N 2.91Å; N373-I377 PolarHBondContact O-N 2.94Å
374	I	78.6	Confident	79.5	Confident	40 Å²	40	72.7 Å²	72.7	21%	0.205	39%	0.39	C	S	.	.	H	α-helix	trans	-59.7	-29.7	178.7	-153.7	176.8	0	0	0	112.4	I377 F378 F396 E397 T400	I374-I377 WeakPolarHBondContact O-CB 3.23Å; I374-I377 PolarHBondContact O-N 2.85Å; I374-F378 HydrophobicContact CD1-CE2 3.86Å; I374-F378 HydrophobicContact CD1-CZ 4.18Å; I374-F378 HydrophobicContact CG1-CD2 4.21Å; I374-F378 HydrophobicContact CG1-CE2 3.6Å; I374-F378 HydrophobicContact CG1-CZ 4.12Å; I374-F378 HydrophobicContact CG2-CE2 4.46Å; I374-F378 WeakPolarHBondContact O-CD2 3.37Å; I374-F378 PolarHBondContact O-N 3.38Å; I374-F396 HydrophobicContact CD1-CB 4.28Å; I374-E397 HydrophobicContact CG2-CG 4.2Å; I374-T400 HydrophobicContact CD1-CG2 4.48Å; I374-T400 WeakPolarHBondContact CD1-OG1 3.45Å
375	Q	79.7	Confident	78.8	Confident	113 Å²	113	73.5 Å²	73.5	53%	0.528	41%	0.41	S	S	.	.	H	α-helix	trans	-69.7	-30.3	175	-67.5	179.2	-20.3	0	0	112.8	N373 Q379 E397	N373-Q375 PolarHBondContact O-N 3.44Å; Q375-Q379 VanDerWaalsContact O-CB 3.25Å; Q375-Q379 WeakPolarHBondContact O-CB 3.44Å; Q375-Q379 PolarHBondContact O-N 3.47Å; Q375-E397 WeakPolarHBondContact CG-OE1 3.37Å; Q375-E397 PolarHBondContact NE2-OE1 3.2Å
376	E	81.7	Confident	78.6	Confident	91 Å²	91	73 Å²	73	43%	0.425	40%	0.403	S	S	.	.	H	α-helix	trans	-72.7	-35.7	172.8	-60.9	175.1	155.3	0	0	110.9	C371 S372 N373 Q379 T380	C371-E376 HydrophobicContact CB-CB 3.97Å; S372-E376 WeakPolarHBondContact CA-OE2 3.4Å; S372-E376 PolarHBondContact N-OE2 3.05Å; N373-E376 HydrophobicContact CB-CG 4.29Å; N373-E376 PolarHBondContact N-OE2 2.92Å; N373-E376 WeakPolarHBondContact O-CB 3.41Å; N373-E376 PolarHBondContact O-N 2.91Å; E376-Q379 PolarHBondContact O-N 3.47Å; E376-T380 WeakPolarHBondContact O-CB 3.1Å; E376-T380 WeakPolarHBondContact O-CG2 3.48Å; E376-T380 PolarHBondContact O-N 3.03Å; E376-T380 PolarHBondContact O-OG1 3.28Å
377	I	83	Confident	78.2	Confident	57 Å²	57	73.2 Å²	73.2	29%	0.292	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-47.3	172.3	-63.3	175.6	0	0	0	110	L368 C371 N373 I374 T380 L381	L368-I377 HydrophobicContact CD2-CG2 4.06Å; C371-I377 HydrophobicContact CB-CD1 4.39Å; C371-I377 HydrophobicContact CB-CG1 3.52Å; N373-I377 PolarHBondContact O-N 2.94Å; I374-I377 WeakPolarHBondContact O-CB 3.23Å; I374-I377 PolarHBondContact O-N 2.85Å; I377-T380 PolarHBondContact O-N 3.04Å; I377-T380 PolarHBondContact O-OG1 3.35Å; I377-L381 HydrophobicContact CG2-CD1 3.92Å; I377-L381 WeakPolarHBondContact O-CB 3.02Å; I377-L381 WeakPolarHBondContact O-CG 3.38Å; I377-L381 PolarHBondContact O-N 3Å
378	F	81	Confident	78.2	Confident	18 Å²	18	72.8 Å²	72.8	8%	0.079	42%	0.416	C	S	.	.	H	α-helix	trans	-67.7	-39	176	-67.1	-52.4	0	0	0	113.1	I374 T380 L381 Y382 I388 I393 F396	I374-F378 HydrophobicContact CD1-CE2 3.86Å; I374-F378 HydrophobicContact CD1-CZ 4.18Å; I374-F378 HydrophobicContact CG1-CD2 4.21Å; I374-F378 HydrophobicContact CG1-CE2 3.6Å; I374-F378 HydrophobicContact CG1-CZ 4.12Å; I374-F378 HydrophobicContact CG2-CE2 4.46Å; I374-F378 WeakPolarHBondContact O-CD2 3.37Å; I374-F378 PolarHBondContact O-N 3.38Å; F378-T380 VanDerWaalsContact C-N 3.34Å; F378-T380 PolarHBondContact O-N 3.41Å; F378-L381 HydrophobicContact CD1-CD1 4.33Å; F378-L381 PolarHBondContact O-N 3.48Å; F378-Y382 VanDerWaalsContact O-CD2 3.31Å; F378-Y382 WeakPolarHBondContact O-CD2 3.28Å; F378-Y382 PolarHBondContact O-N 3.33Å; F378-I388 HydrophobicContact CD1-CD1 4.19Å; F378-I388 HydrophobicContact CE1-CD1 4.36Å; F378-I393 HydrophobicContact CB-CD1 4.01Å; F378-I393 HydrophobicContact CD1-CD1 3.96Å; F378-I393 HydrophobicContact CD1-CG1 3.79Å; F378-I393 HydrophobicContact CD2-CB 4.43Å; F378-I393 HydrophobicContact CD2-CD1 4.39Å; F378-I393 HydrophobicContact CD2-CG1 4.2Å; F378-I393 HydrophobicContact CD2-CG2 3.67Å; F378-I393 HydrophobicContact CE1-CG1 3.94Å; F378-I393 HydrophobicContact CE2-CB 4.34Å; F378-I393 HydrophobicContact CE2-CG1 4.3Å; F378-I393 HydrophobicContact CE2-CG2 3.78Å; F378-I393 HydrophobicContact CG-CD1 3.87Å; F378-I393 HydrophobicContact CG-CG1 3.96Å; F378-I393 HydrophobicContact CG-CG2 4.22Å; F378-I393 HydrophobicContact CZ-CG1 4.21Å; F378-I393 HydrophobicContact CZ-CG2 4.43Å; F378-F396 HydrophobicContact CE1-CD2 4.08Å; F378-F396 HydrophobicContact CE2-CB 4.37Å; F378-F396 HydrophobicContact CZ-CB 3.8Å; F378-F396 AromaticContact CZ-CD2 3.74Å; F378-F396 HydrophobicContact CZ-CD2 3.74Å; F378-F396 HydrophobicContact CZ-CG 4.16Å
379	Q	82.1	Confident	78.2	Confident	130 Å²	130	74 Å²	74	61%	0.607	43%	0.428	S	S	*	.	H	α-helix	trans	-63.6	-38.5	177.4	-174.1	59.9	55.5	0	0	112.4	Q375 E376 S383	Q375-Q379 VanDerWaalsContact O-CB 3.25Å; Q375-Q379 WeakPolarHBondContact O-CB 3.44Å; Q375-Q379 PolarHBondContact O-N 3.47Å; E376-Q379 PolarHBondContact O-N 3.47Å; Q379-S383 PolarHBondContact O-N 3.49Å
380	T	81.3	Confident	78.2	Confident	32 Å²	32	75.6 Å²	75.6	20%	0.196	44%	0.435	C	S	.	.	H	α-helix	trans	-71.4	-44.1	174.8	47.5	0	0	0	0	111.5	L368 E376 I377 F378 Y382 S383 H384	L368-T380 VanDerWaalsContact CD2-OG1 3.31Å; L368-T380 WeakPolarHBondContact CD2-OG1 3.48Å; E376-T380 WeakPolarHBondContact O-CB 3.1Å; E376-T380 WeakPolarHBondContact O-CG2 3.48Å; E376-T380 PolarHBondContact O-N 3.03Å; E376-T380 PolarHBondContact O-OG1 3.28Å; I377-T380 PolarHBondContact O-N 3.04Å; I377-T380 PolarHBondContact O-OG1 3.35Å; F378-T380 VanDerWaalsContact C-N 3.34Å; F378-T380 PolarHBondContact O-N 3.41Å; T380-Y382 VanDerWaalsContact C-N 3.3Å; T380-Y382 PolarHBondContact O-N 2.91Å; T380-S383 WeakPolarHBondContact CA-OG 3.34Å; T380-S383 PolarHBondContact O-N 2.89Å; T380-S383 VanDerWaalsContact O-N 3.12Å; T380-S383 PolarHBondContact O-OG 3.38Å; T380-H384 PolarHBondContact O-CD2 3.47Å; T380-H384 PolarHBondContact O-N 3.45Å
381	L	79.3	Confident	78.1	Confident	39 Å²	39	72.9 Å²	72.9	20%	0.204	43%	0.425	C	S	.	.	H	α-helix	trans	-57.2	-40.2	173.6	-71.6	169.2	0	0	0	112.5	L368 I377 F378 H384 G385 S386 I388	L368-L381 HydrophobicContact CD1-CD2 4.15Å; L368-L381 HydrophobicContact CD2-CD2 4.01Å; L368-L381 HydrophobicContact CD2-CG 3.86Å; I377-L381 HydrophobicContact CG2-CD1 3.92Å; I377-L381 WeakPolarHBondContact O-CB 3.02Å; I377-L381 WeakPolarHBondContact O-CG 3.38Å; I377-L381 PolarHBondContact O-N 3Å; F378-L381 HydrophobicContact CD1-CD1 4.33Å; F378-L381 PolarHBondContact O-N 3.48Å; L381-H384 PolarHBondContact O-N 3.06Å; L381-G385 PolarHBondContact O-N 2.9Å; L381-S386 WeakPolarHBondContact O-CB 3.41Å; L381-S386 PolarHBondContact O-N 3.11Å; L381-I388 HydrophobicContact CB-CD1 4.29Å; L381-I388 HydrophobicContact CD1-CD1 3.86Å
382	Y	80	Confident	78.3	Confident	94 Å²	94	76.8 Å²	76.8	37%	0.369	44%	0.439	S	S	.	.	H	α-helix	trans	-66.9	-42.5	173.1	-81.5	-50.4	0	0	0	113.1	F378 T380 H384 G385 S386 I388 I393	F378-Y382 VanDerWaalsContact O-CD2 3.31Å; F378-Y382 WeakPolarHBondContact O-CD2 3.28Å; F378-Y382 PolarHBondContact O-N 3.33Å; T380-Y382 VanDerWaalsContact C-N 3.3Å; T380-Y382 PolarHBondContact O-N 2.91Å; Y382-H384 PolarHBondContact O-N 3.13Å; Y382-G385 PolarHBondContact O-N 3.5Å; Y382-S386 WeakPolarHBondContact CD1-O 3.49Å; Y382-I388 WeakPolarHBondContact CE1-O 3.35Å; Y382-I388 PolarHBondContact OH-O 2.87Å; Y382-I393 HydrophobicContact CD2-CD1 4.49Å; Y382-I393 HydrophobicContact CE2-CD1 3.4Å; Y382-I393 WeakPolarHBondContact OH-CD1 3.25Å
383	S	78.6	Confident	78.6	Confident	83 Å²	83	72 Å²	72	58%	0.58	40%	0.404	S	S	*	.	H	α-helix	trans	-63.1	-24.7	177.3	70.1	0	0	0	0	113.6	Q379 T380	Q379-S383 PolarHBondContact O-N 3.49Å; T380-S383 WeakPolarHBondContact CA-OG 3.34Å; T380-S383 PolarHBondContact O-N 2.89Å; T380-S383 VanDerWaalsContact O-N 3.12Å; T380-S383 PolarHBondContact O-OG 3.38Å
384	H	75.1	Confident	79	Confident	109 Å²	109	74 Å²	74	51%	0.505	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	11	173.6	-75.2	-79.7	0	0	0	113.8	L364 T380 L381 Y382	L364-H384 HydrophobicContact CD1-CB 3.89Å; L364-H384 WeakPolarHBondContact CD1-CD2 3.27Å; L364-H384 VanDerWaalsContact CD1-CG 3.49Å; T380-H384 PolarHBondContact O-CD2 3.47Å; T380-H384 PolarHBondContact O-N 3.45Å; L381-H384 PolarHBondContact O-N 3.06Å; Y382-H384 PolarHBondContact O-N 3.13Å
385	G	64.8	Low	79.4	Confident	66 Å²	66	74.8 Å²	74.8	68%	0.68	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	15	169.4	0	0	0	0	0	115.9	L381 Y382 A387	L381-G385 PolarHBondContact O-N 2.9Å; Y382-G385 PolarHBondContact O-N 3.5Å; G385-A387 PolarHBondContact O-N 3.28Å
386	S	73	Confident	79.7	Confident	49 Å²	49	74.1 Å²	74.1	34%	0.343	40%	0.404	S	S	.	.			trans	-72.8	120.1	178.6	-164.6	0	0	0	0	111.8	L381 Y382 I388	L381-S386 WeakPolarHBondContact O-CB 3.41Å; L381-S386 PolarHBondContact O-N 3.11Å; Y382-S386 WeakPolarHBondContact CD1-O 3.49Å; S386-I388 PolarHBondContact O-N 3.4Å; S386-I388 WeakPolarHBondContact OG-CG1 3.47Å
387	A	70.6	Confident	80	Confident	105 Å²	105	72.6 Å²	72.6	87%	0.868	40%	0.397	S	S	*	.			trans	-82.6	50.5	-177.5	0	0	0	0	0	113.1	G385	G385-A387 PolarHBondContact O-N 3.28Å
388	I	76.9	Confident	80.4	Confident	40 Å²	40	71.5 Å²	71.5	21%	0.205	39%	0.392	C	S	.	.			trans	-70.7	132.1	175.8	-52.8	178.9	0	0	0	108.7	F378 L381 Y382 S386 K392 I393	F378-I388 HydrophobicContact CD1-CD1 4.19Å; F378-I388 HydrophobicContact CE1-CD1 4.36Å; L381-I388 HydrophobicContact CB-CD1 4.29Å; L381-I388 HydrophobicContact CD1-CD1 3.86Å; Y382-I388 WeakPolarHBondContact CE1-O 3.35Å; Y382-I388 PolarHBondContact OH-O 2.87Å; S386-I388 PolarHBondContact O-N 3.4Å; S386-I388 WeakPolarHBondContact OG-CG1 3.47Å; I388-K392 HydrophobicContact CG2-CB 4.36Å; I388-I393 HydrophobicContact CG2-CD1 4.34Å; I388-I393 HydrophobicContact CG2-CG1 3.78Å
389	S	78.7	Confident	80.8	Confident	69 Å²	69	74 Å²	74	48%	0.483	41%	0.405	S	S	.	.			trans	-77.4	143.4	176	63.2	0	0	0	0	111.4	S391 K392 I393	S389-S391 PolarHBondContact O-N 2.86Å; S389-K392 PolarHBondContact O-N 3.48Å; S389-I393 PolarHBondContact O-N 3.3Å; S389-I393 VanDerWaalsContact O-N 3.17Å
390	E	80.6	Confident	81.1	Confident	121 Å²	121	71.1 Å²	71.1	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-58.5	-33.8	-178.7	-159.7	-166.9	136.9	0	0	112.6	K392 I393 R394	E390-K392 VanDerWaalsContact C-N 3.3Å; E390-K392 PolarHBondContact O-N 3.13Å; E390-I393 PolarHBondContact O-N 3.11Å; E390-R394 WeakPolarHBondContact O-CG 3.3Å; E390-R394 PolarHBondContact O-N 3.01Å; E390-R394 IonicContact OE1-CZ 3.3Å; E390-R394 IonicContact OE1-NE 2.74Å; E390-R394 PolarHBondContact OE1-NE 3.42Å; E390-R394 IonicContact OE1-NH2 3.82Å; E390-R394 PolarHBondContact OE1-NH2 3.01Å
391	S	81.4	Confident	81.5	Confident	53 Å²	53	73.2 Å²	73.2	37%	0.371	40%	0.403	S	S	.	.	H	α-helix	trans	-56.4	-43.6	171.4	-169.4	0	0	0	0	112	S389 R394 E395 Y637	S389-S391 PolarHBondContact O-N 2.86Å; S391-R394 PolarHBondContact O-N 2.91Å; S391-E395 WeakPolarHBondContact O-CG 3.17Å; S391-E395 PolarHBondContact O-N 2.73Å; S391-E395 PolarHBondContact OG-OE1 3.48Å; S391-Y637 PolarHBondContact O-OH 3.26Å; S391-Y637 VanDerWaalsContact O-OH 3.11Å; S391-Y637 PolarHBondContact OG-OH 3.34Å
392	K	84.5	Confident	82.3	Confident	107 Å²	107	74 Å²	74	47%	0.465	40%	0.404	S	S	.	.	H	α-helix	trans	-75.5	-26.9	-177	-160.4	166.4	-172.8	173.1	0	112.4	I388 S389 E390 F396	I388-K392 HydrophobicContact CG2-CB 4.36Å; S389-K392 PolarHBondContact O-N 3.48Å; E390-K392 VanDerWaalsContact C-N 3.3Å; E390-K392 PolarHBondContact O-N 3.13Å; K392-F396 HydrophobicContact CD-CE2 4.39Å; K392-F396 HydrophobicContact CG-CD2 4.3Å; K392-F396 HydrophobicContact CG-CE2 3.86Å; K392-F396 HydrophobicContact CG-CZ 4.42Å; K392-F396 WeakPolarHBondContact O-CD2 3.46Å; K392-F396 WeakPolarHBondContact O-CG 3.3Å; K392-F396 PolarHBondContact O-N 2.87Å; K392-F396 VanDerWaalsContact O-N 3.14Å
393	I	84	Confident	82.9	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.087	41%	0.406	C	S	.	.	H	α-helix	trans	-64.1	-50.6	168.3	-69.8	-178	0	0	0	110.4	F378 Y382 I388 S389 E390 E395 F396 E397	F378-I393 HydrophobicContact CB-CD1 4.01Å; F378-I393 HydrophobicContact CD1-CD1 3.96Å; F378-I393 HydrophobicContact CD1-CG1 3.79Å; F378-I393 HydrophobicContact CD2-CB 4.43Å; F378-I393 HydrophobicContact CD2-CD1 4.39Å; F378-I393 HydrophobicContact CD2-CG1 4.2Å; F378-I393 HydrophobicContact CD2-CG2 3.67Å; F378-I393 HydrophobicContact CE1-CG1 3.94Å; F378-I393 HydrophobicContact CE2-CB 4.34Å; F378-I393 HydrophobicContact CE2-CG1 4.3Å; F378-I393 HydrophobicContact CE2-CG2 3.78Å; F378-I393 HydrophobicContact CG-CD1 3.87Å; F378-I393 HydrophobicContact CG-CG1 3.96Å; F378-I393 HydrophobicContact CG-CG2 4.22Å; F378-I393 HydrophobicContact CZ-CG1 4.21Å; F378-I393 HydrophobicContact CZ-CG2 4.43Å; Y382-I393 HydrophobicContact CD2-CD1 4.49Å; Y382-I393 HydrophobicContact CE2-CD1 3.4Å; Y382-I393 WeakPolarHBondContact OH-CD1 3.25Å; I388-I393 HydrophobicContact CG2-CD1 4.34Å; I388-I393 HydrophobicContact CG2-CG1 3.78Å; S389-I393 PolarHBondContact O-N 3.3Å; S389-I393 VanDerWaalsContact O-N 3.17Å; E390-I393 PolarHBondContact O-N 3.11Å; I393-E395 VanDerWaalsContact C-N 3.28Å; I393-E395 PolarHBondContact O-N 3.07Å; I393-F396 PolarHBondContact O-N 2.94Å; I393-E397 HydrophobicContact CG2-CG 4.32Å; I393-E397 PolarHBondContact O-N 3.42Å
394	R	84.8	Confident	83.5	Confident	121 Å²	121	72.9 Å²	72.9	46%	0.457	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-37.2	177.7	-62.7	-177.6	-161.1	-170.5	7	112.3	E390 S391 E397 V398 Y637	E390-R394 WeakPolarHBondContact O-CG 3.3Å; E390-R394 PolarHBondContact O-N 3.01Å; E390-R394 IonicContact OE1-CZ 3.3Å; E390-R394 IonicContact OE1-NE 2.74Å; E390-R394 PolarHBondContact OE1-NE 3.42Å; E390-R394 IonicContact OE1-NH2 3.82Å; E390-R394 PolarHBondContact OE1-NH2 3.01Å; S391-R394 PolarHBondContact O-N 2.91Å; R394-E397 PolarHBondContact O-N 2.71Å; R394-V398 WeakPolarHBondContact O-CB 3.36Å; R394-V398 VanDerWaalsContact O-CG2 3.26Å; R394-V398 WeakPolarHBondContact O-CG2 3.44Å; R394-V398 PolarHBondContact O-N 3.2Å; R394-Y637 HydrophobicContact CB-CE2 3.8Å
395	E	86.9	Confident	84.5	Confident	57 Å²	57	68.1 Å²	68.1	27%	0.266	38%	0.376	S	S	.	.	H	α-helix	trans	-58.1	-45.5	172.4	-75.3	157.3	-142.9	0	0	111.9	S391 I393 E399 Y637 K641	S391-E395 WeakPolarHBondContact O-CG 3.17Å; S391-E395 PolarHBondContact O-N 2.73Å; S391-E395 PolarHBondContact OG-OE1 3.48Å; I393-E395 VanDerWaalsContact C-N 3.28Å; I393-E395 PolarHBondContact O-N 3.07Å; E395-E399 WeakPolarHBondContact O-CB 3.34Å; E395-E399 PolarHBondContact O-N 2.77Å; E395-Y637 HydrophobicContact CG-CE1 3.51Å; E395-K641 IonicContact OE1-NZ 3.41Å; E395-K641 PolarHBondContact OE1-NZ 3.47Å; E395-K641 IonicContact OE2-NZ 3.64Å; E395-K641 PolarHBondContact OE2-NZ 3.21Å
396	F	86	Confident	86	Confident	98 Å²	98	69.9 Å²	69.9	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-70.2	-38.3	175.9	-70.3	-52.5	0	0	0	113.3	I374 F378 K392 I393 T400	I374-F396 HydrophobicContact CD1-CB 4.28Å; F378-F396 HydrophobicContact CE1-CD2 4.08Å; F378-F396 HydrophobicContact CE2-CB 4.37Å; F378-F396 HydrophobicContact CZ-CB 3.8Å; F378-F396 AromaticContact CZ-CD2 3.74Å; F378-F396 HydrophobicContact CZ-CD2 3.74Å; F378-F396 HydrophobicContact CZ-CG 4.16Å; K392-F396 HydrophobicContact CD-CE2 4.39Å; K392-F396 HydrophobicContact CG-CD2 4.3Å; K392-F396 HydrophobicContact CG-CE2 3.86Å; K392-F396 HydrophobicContact CG-CZ 4.42Å; K392-F396 WeakPolarHBondContact O-CD2 3.46Å; K392-F396 WeakPolarHBondContact O-CG 3.3Å; K392-F396 PolarHBondContact O-N 2.87Å; K392-F396 VanDerWaalsContact O-N 3.14Å; I393-F396 PolarHBondContact O-N 2.94Å; F396-T400 WeakPolarHBondContact O-CB 3.48Å; F396-T400 PolarHBondContact O-N 3.16Å; F396-T400 PolarHBondContact O-OG1 3.29Å
397	E	88.2	Confident	87.1	Confident	60 Å²	60	71.3 Å²	71.3	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-46.2	176	-72.4	-179.8	131.3	0	0	111.3	I374 Q375 I393 R394 T400 E401	I374-E397 HydrophobicContact CG2-CG 4.2Å; Q375-E397 WeakPolarHBondContact CG-OE1 3.37Å; Q375-E397 PolarHBondContact NE2-OE1 3.2Å; I393-E397 HydrophobicContact CG2-CG 4.32Å; I393-E397 PolarHBondContact O-N 3.42Å; R394-E397 PolarHBondContact O-N 2.71Å; E397-T400 PolarHBondContact O-N 2.99Å; E397-E401 PolarHBondContact O-N 3.1Å
398	V	90.6	Very high	88.3	Confident	33 Å²	33	69 Å²	69	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-64.9	-47.5	178.5	167.8	0	0	0	0	111.8	R394 T400 E401 R402 A634 Y637	R394-V398 WeakPolarHBondContact O-CB 3.36Å; R394-V398 VanDerWaalsContact O-CG2 3.26Å; R394-V398 WeakPolarHBondContact O-CG2 3.44Å; R394-V398 PolarHBondContact O-N 3.2Å; V398-T400 VanDerWaalsContact C-N 3.29Å; V398-T400 PolarHBondContact O-N 2.96Å; V398-E401 PolarHBondContact O-N 3.44Å; V398-R402 WeakPolarHBondContact O-CB 3.47Å; V398-R402 PolarHBondContact O-N 3.04Å; V398-A634 HydrophobicContact CG1-CB 3.72Å; V398-Y637 HydrophobicContact CG2-CD2 4.27Å; V398-Y637 HydrophobicContact CG2-CG 4.29Å
399	E	89.9	Confident	89.2	Confident	72 Å²	72	68.1 Å²	68.1	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-32.3	178	-176.8	59	-164.9	0	0	111.8	E395 R402 L403	E395-E399 WeakPolarHBondContact O-CB 3.34Å; E395-E399 PolarHBondContact O-N 2.77Å; E399-R402 PolarHBondContact O-N 3.38Å; E399-R402 IonicContact OE1-CZ 2.74Å; E399-R402 IonicContact OE1-NE 3.37Å; E399-R402 PolarHBondContact OE1-NE 3.39Å; E399-R402 IonicContact OE1-NH2 3.97Å; E399-R402 PolarHBondContact OE1-NH2 3.33Å; E399-R402 IonicContact OE2-CZ 2.63Å; E399-R402 IonicContact OE2-NE 3.61Å; E399-R402 PolarHBondContact OE2-NE 3.23Å; E399-R402 IonicContact OE2-NH2 3.74Å; E399-R402 PolarHBondContact OE2-NH2 3.45Å; E399-L403 HydrophobicContact CG-CD1 3.99Å; E399-L403 HydrophobicContact CG-CG 4.4Å; E399-L403 WeakPolarHBondContact O-CB 3.22Å; E399-L403 VanDerWaalsContact O-CG 3.28Å; E399-L403 WeakPolarHBondContact O-CG 3.41Å; E399-L403 PolarHBondContact O-N 3.3Å
400	T	87.1	Confident	90.1	Very high	68 Å²	68	68.5 Å²	68.5	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-70.1	-39.6	174.3	-56.9	0	0	0	0	111.8	I374 F396 E397 V398 N404	I374-T400 HydrophobicContact CD1-CG2 4.48Å; I374-T400 WeakPolarHBondContact CD1-OG1 3.45Å; F396-T400 WeakPolarHBondContact O-CB 3.48Å; F396-T400 PolarHBondContact O-N 3.16Å; F396-T400 PolarHBondContact O-OG1 3.29Å; E397-T400 PolarHBondContact O-N 2.99Å; V398-T400 VanDerWaalsContact C-N 3.29Å; V398-T400 PolarHBondContact O-N 2.96Å; T400-N404 VanDerWaalsContact O-CB 3.23Å; T400-N404 WeakPolarHBondContact O-CB 3.42Å; T400-N404 PolarHBondContact O-N 2.94Å
401	E	91.2	Very high	90.8	Very high	77 Å²	77	68.4 Å²	68.4	36%	0.36	33%	0.325	S	S	.	.	H	α-helix	trans	-60.8	-48	172.7	-172.1	177	-173.7	0	0	110.4	E397 V398 N404 S405 A630 K633	E397-E401 PolarHBondContact O-N 3.1Å; V398-E401 PolarHBondContact O-N 3.44Å; E401-N404 PolarHBondContact O-N 3.19Å; E401-S405 WeakPolarHBondContact O-CB 3.45Å; E401-S405 PolarHBondContact O-N 3.29Å; E401-S405 PolarHBondContact O-OG 3.48Å; E401-S405 VanDerWaalsContact O-OG 3.07Å; E401-A630 HydrophobicContact CG-CB 4.39Å; E401-K633 IonicContact OE1-NZ 2.69Å; E401-K633 PolarHBondContact OE1-NZ 3.39Å; E401-K633 WeakPolarHBondContact OE2-CD 3.39Å; E401-K633 IonicContact OE2-NZ 2.67Å; E401-K633 PolarHBondContact OE2-NZ 3.28Å
402	R	94.5	Very high	91.5	Very high	55 Å²	55	66.3 Å²	66.3	21%	0.208	31%	0.31	C	S	.	.	H	α-helix	trans	-57.9	-51.9	178.7	-161	-172.8	75.6	78.8	2.9	112.5	V398 E399 S405 R406 E631 A634	V398-R402 WeakPolarHBondContact O-CB 3.47Å; V398-R402 PolarHBondContact O-N 3.04Å; E399-R402 PolarHBondContact O-N 3.38Å; E399-R402 IonicContact OE1-CZ 2.74Å; E399-R402 IonicContact OE1-NE 3.37Å; E399-R402 PolarHBondContact OE1-NE 3.39Å; E399-R402 IonicContact OE1-NH2 3.97Å; E399-R402 PolarHBondContact OE1-NH2 3.33Å; E399-R402 IonicContact OE2-CZ 2.63Å; E399-R402 IonicContact OE2-NE 3.61Å; E399-R402 PolarHBondContact OE2-NE 3.23Å; E399-R402 IonicContact OE2-NH2 3.74Å; E399-R402 PolarHBondContact OE2-NH2 3.45Å; R402-S405 PolarHBondContact O-N 2.99Å; R402-R406 PolarHBondContact O-N 3.39Å; R402-E631 WeakPolarHBondContact CD-OE2 3.32Å; R402-E631 WeakPolarHBondContact CG-OE2 3.42Å; R402-E631 IonicContact CZ-OE2 3.67Å; R402-E631 IonicContact NE-OE2 2.66Å; R402-E631 IonicContact NH1-OE1 3.54Å; R402-E631 PolarHBondContact NH1-OE1 2.82Å; R402-E631 IonicContact NH1-OE2 3.45Å; R402-E631 PolarHBondContact NH1-OE2 2.89Å; R402-A634 HydrophobicContact CG-CB 4.43Å
403	L	92.9	Very high	92	Very high	82 Å²	82	64.9 Å²	64.9	43%	0.429	31%	0.305	S	S	.	.	H	α-helix	trans	-64.7	-39.3	177.9	-71.2	172.2	0	0	0	112.3	E399 R406 I407	E399-L403 HydrophobicContact CG-CD1 3.99Å; E399-L403 HydrophobicContact CG-CG 4.4Å; E399-L403 WeakPolarHBondContact O-CB 3.22Å; E399-L403 VanDerWaalsContact O-CG 3.28Å; E399-L403 WeakPolarHBondContact O-CG 3.41Å; E399-L403 PolarHBondContact O-N 3.3Å; L403-R406 PolarHBondContact O-N 3.13Å; L403-I407 WeakPolarHBondContact O-CB 3.46Å; L403-I407 WeakPolarHBondContact O-CD1 3.43Å; L403-I407 VanDerWaalsContact O-CG1 3.25Å; L403-I407 WeakPolarHBondContact O-CG1 3.34Å; L403-I407 PolarHBondContact O-N 2.74Å
404	N	92.8	Very high	92.5	Very high	72 Å²	72	68.9 Å²	68.9	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	-40.9	176.9	-176.8	73.8	0	0	0	111.9	T400 E401 R406 I407 E408	T400-N404 VanDerWaalsContact O-CB 3.23Å; T400-N404 WeakPolarHBondContact O-CB 3.42Å; T400-N404 PolarHBondContact O-N 2.94Å; E401-N404 PolarHBondContact O-N 3.19Å; N404-R406 VanDerWaalsContact C-N 3.34Å; N404-R406 PolarHBondContact O-N 3.48Å; N404-I407 WeakPolarHBondContact O-CB 3.43Å; N404-I407 PolarHBondContact O-N 3.34Å; N404-I407 VanDerWaalsContact O-N 3.16Å; N404-E408 PolarHBondContact ND2-OE1 3.15Å; N404-E408 PolarHBondContact O-N 2.84Å
405	S	94.9	Very high	93	Very high	8 Å²	8	67.6 Å²	67.6	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-41.3	174	-61.4	0	0	0	0	112	E401 R402 I407 E408 H409	E401-S405 WeakPolarHBondContact O-CB 3.45Å; E401-S405 PolarHBondContact O-N 3.29Å; E401-S405 PolarHBondContact O-OG 3.48Å; E401-S405 VanDerWaalsContact O-OG 3.07Å; R402-S405 PolarHBondContact O-N 2.99Å; S405-I407 VanDerWaalsContact C-N 3.32Å; S405-I407 PolarHBondContact O-N 2.94Å; S405-E408 PolarHBondContact O-N 3.02Å; S405-H409 PolarHBondContact O-N 2.84Å
406	R	95.6	Very high	93.4	Very high	103 Å²	103	66 Å²	66	39%	0.389	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-40.6	172.3	-177.2	60.2	178.5	178.4	-2.2	112.4	R402 L403 N404 L410 E627	R402-R406 PolarHBondContact O-N 3.39Å; L403-R406 PolarHBondContact O-N 3.13Å; N404-R406 VanDerWaalsContact C-N 3.34Å; N404-R406 PolarHBondContact O-N 3.48Å; R406-L410 HydrophobicContact CG-CD1 4.05Å; R406-L410 WeakPolarHBondContact O-CB 3.35Å; R406-L410 VanDerWaalsContact O-CG 3.28Å; R406-L410 WeakPolarHBondContact O-CG 3.43Å; R406-L410 PolarHBondContact O-N 3.48Å; R406-E627 HydrophobicContact CB-CG 4.47Å; R406-E627 VanDerWaalsContact CD-OE1 3.23Å; R406-E627 WeakPolarHBondContact CD-OE1 3.4Å; R406-E627 WeakPolarHBondContact CD-OE2 3.49Å; R406-E627 IonicContact CZ-OE1 2.61Å; R406-E627 IonicContact CZ-OE2 2.78Å; R406-E627 IonicContact NE-OE1 2.76Å; R406-E627 IonicContact NE-OE2 3.49Å; R406-E627 IonicContact NH1-OE1 3.56Å; R406-E627 PolarHBondContact NH1-OE1 3.03Å; R406-E627 IonicContact NH1-OE2 3.76Å; R406-E627 PolarHBondContact NH1-OE2 3.32Å
407	I	96.2	Very high	93.9	Very high	80 Å²	80	66.2 Å²	66.2	41%	0.41	33%	0.328	S	S	.	.	H	α-helix	trans	-67.1	-38.6	176.4	-72.5	164.5	0	0	0	111.5	L403 N404 S405 K411	L403-I407 WeakPolarHBondContact O-CB 3.46Å; L403-I407 WeakPolarHBondContact O-CD1 3.43Å; L403-I407 VanDerWaalsContact O-CG1 3.25Å; L403-I407 WeakPolarHBondContact O-CG1 3.34Å; L403-I407 PolarHBondContact O-N 2.74Å; N404-I407 WeakPolarHBondContact O-CB 3.43Å; N404-I407 PolarHBondContact O-N 3.34Å; N404-I407 VanDerWaalsContact O-N 3.16Å; S405-I407 VanDerWaalsContact C-N 3.32Å; S405-I407 PolarHBondContact O-N 2.94Å; I407-K411 HydrophobicContact CG2-CD 4.18Å; I407-K411 VanDerWaalsContact CG2-CE 3.49Å; I407-K411 WeakPolarHBondContact O-CD 3.35Å; I407-K411 VanDerWaalsContact O-CG 3.24Å; I407-K411 WeakPolarHBondContact O-CG 3.49Å; I407-K411 PolarHBondContact O-N 3.34Å
408	E	96.1	Very high	94.2	Very high	55 Å²	55	67.3 Å²	67.3	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-43.2	175.3	-75.6	178.8	-160	0	0	112	N404 S405 K411 S412 M623 K626	N404-E408 PolarHBondContact ND2-OE1 3.15Å; N404-E408 PolarHBondContact O-N 2.84Å; S405-E408 PolarHBondContact O-N 3.02Å; E408-K411 PolarHBondContact O-N 3.37Å; E408-S412 PolarHBondContact O-N 2.66Å; E408-S412 PolarHBondContact O-OG 3.47Å; E408-M623 HydrophobicContact CB-CG 4.43Å; E408-M623 HydrophobicContact CB-SD 3.98Å; E408-K626 IonicContact OE2-NZ 2.66Å; E408-K626 PolarHBondContact OE2-NZ 3.28Å
409	H	96.9	Very high	94.3	Very high	23 Å²	23	68.4 Å²	68.4	11%	0.106	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-48.4	175	-179.6	-155.5	0	0	0	112	S405 K411 S412 Q413 Q620 M623 E627	S405-H409 PolarHBondContact O-N 2.84Å; H409-K411 PolarHBondContact O-N 2.69Å; H409-S412 WeakPolarHBondContact CA-OG 3.49Å; H409-S412 PolarHBondContact O-N 3.2Å; H409-S412 VanDerWaalsContact O-N 3.11Å; H409-S412 PolarHBondContact O-OG 3.28Å; H409-Q413 PolarHBondContact O-N 3.14Å; H409-Q620 PolarHBondContact NE2-NE2 2.91Å; H409-M623 HydrophobicContact CB-CB 3.92Å; H409-E627 HydrophobicContact CB-CB 4.47Å; H409-E627 WeakPolarHBondContact CB-OE2 3.5Å; H409-E627 IonicContact CE1-OE2 2.62Å; H409-E627 IonicContact CG-OE2 2.66Å; H409-E627 IonicContact ND1-OE2 2.6Å; H409-E627 PolarHBondContact ND1-OE2 3.34Å
410	L	96.5	Very high	94.4	Very high	77 Å²	77	67.1 Å²	67.1	40%	0.403	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-32	177.4	-72.5	171.7	0	0	0	113.1	R406 N414	R406-L410 HydrophobicContact CG-CD1 4.05Å; R406-L410 WeakPolarHBondContact O-CB 3.35Å; R406-L410 VanDerWaalsContact O-CG 3.28Å; R406-L410 WeakPolarHBondContact O-CG 3.43Å; R406-L410 PolarHBondContact O-N 3.48Å; L410-N414 WeakPolarHBondContact O-CB 3.22Å; L410-N414 PolarHBondContact O-N 2.94Å; L410-N414 VanDerWaalsContact O-N 3.15Å
411	K	96.7	Very high	94.7	Very high	119 Å²	119	69.3 Å²	69.3	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-54.9	170.2	-74.4	164.1	-177.4	168.6	0	111.2	I407 E408 H409 Q413 N414 D415	I407-K411 HydrophobicContact CG2-CD 4.18Å; I407-K411 VanDerWaalsContact CG2-CE 3.49Å; I407-K411 WeakPolarHBondContact O-CD 3.35Å; I407-K411 VanDerWaalsContact O-CG 3.24Å; I407-K411 WeakPolarHBondContact O-CG 3.49Å; I407-K411 PolarHBondContact O-N 3.34Å; E408-K411 PolarHBondContact O-N 3.37Å; H409-K411 PolarHBondContact O-N 2.69Å; K411-Q413 PolarHBondContact O-N 3.45Å; K411-N414 CarbonylContact O-C 3.56Å; K411-N414 WeakPolarHBondContact O-CA 3.32Å; K411-N414 WeakPolarHBondContact O-CB 3.43Å; K411-N414 PolarHBondContact O-N 2.78Å; K411-D415 PolarHBondContact O-N 2.98Å
412	S	94.6	Very high	94.7	Very high	8 Å²	8	70 Å²	70	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-58.6	-34.5	-179.6	63.8	0	0	0	0	113.4	E408 H409 D415 L416	E408-S412 PolarHBondContact O-N 2.66Å; E408-S412 PolarHBondContact O-OG 3.47Å; H409-S412 WeakPolarHBondContact CA-OG 3.49Å; H409-S412 PolarHBondContact O-N 3.2Å; H409-S412 VanDerWaalsContact O-N 3.11Å; H409-S412 PolarHBondContact O-OG 3.28Å; S412-D415 PolarHBondContact O-N 3.04Å; S412-L416 PolarHBondContact O-N 3.16Å
413	Q	95.3	Very high	94.4	Very high	78 Å²	78	71 Å²	71	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-67.1	-38.6	172.6	-170.3	-178.9	33.2	0	0	111.9	H409 K411 L417 Q620	H409-Q413 PolarHBondContact O-N 3.14Å; K411-Q413 PolarHBondContact O-N 3.45Å; Q413-L417 HydrophobicContact CG-CD1 4.23Å; Q413-L417 WeakPolarHBondContact O-CB 3.39Å; Q413-L417 WeakPolarHBondContact O-CG 3.27Å; Q413-L417 PolarHBondContact O-N 2.86Å; Q413-Q620 HydrophobicContact CB-CG 4.47Å
414	N	95.1	Very high	94.2	Very high	101 Å²	101	71.3 Å²	71.3	54%	0.54	37%	0.366	S	S	.	.	H	α-helix	trans	-68.7	-37.7	175.9	-156	-101.8	0	0	0	112.2	L410 K411 L417 T418	L410-N414 WeakPolarHBondContact O-CB 3.22Å; L410-N414 PolarHBondContact O-N 2.94Å; L410-N414 VanDerWaalsContact O-N 3.15Å; K411-N414 CarbonylContact O-C 3.56Å; K411-N414 WeakPolarHBondContact O-CA 3.32Å; K411-N414 WeakPolarHBondContact O-CB 3.43Å; K411-N414 PolarHBondContact O-N 2.78Å; N414-L417 PolarHBondContact O-N 3.19Å; N414-T418 WeakPolarHBondContact O-CB 3.34Å; N414-T418 PolarHBondContact O-N 3.34Å; N414-T418 PolarHBondContact O-OG1 3.13Å
415	D	95.6	Very high	94.2	Very high	94 Å²	94	71.7 Å²	71.7	50%	0.503	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-47.5	174.9	-63.1	-39.3	0	0	0	110.8	K411 S412 L417 T418 I419	K411-D415 PolarHBondContact O-N 2.98Å; S412-D415 PolarHBondContact O-N 3.04Å; D415-L417 PolarHBondContact O-N 3.14Å; D415-T418 WeakPolarHBondContact O-CB 3.32Å; D415-T418 PolarHBondContact O-N 3.46Å; D415-T418 VanDerWaalsContact O-N 3.15Å; D415-I419 WeakPolarHBondContact O-CG1 3.33Å; D415-I419 PolarHBondContact O-N 3.38Å
416	L	95.8	Very high	93.9	Very high	23 Å²	23	73.6 Å²	73.6	12%	0.12	38%	0.378	C	S	.	.	H	α-helix	trans	-62.1	-43.4	175.2	-178.4	66.3	0	0	0	112.4	S412 T418 I419 T420 L613 A616 V617	S412-L416 PolarHBondContact O-N 3.16Å; L416-T418 PolarHBondContact O-N 3.13Å; L416-I419 PolarHBondContact O-N 2.94Å; L416-T420 HydrophobicContact CD1-CG2 4.2Å; L416-T420 HydrophobicContact CG-CG2 4.4Å; L416-T420 WeakPolarHBondContact O-CB 3.42Å; L416-T420 WeakPolarHBondContact O-CG2 3.38Å; L416-T420 PolarHBondContact O-N 3.08Å; L416-T420 PolarHBondContact O-OG1 2.9Å; L416-L613 HydrophobicContact CD1-CD1 3.61Å; L416-A616 HydrophobicContact CB-CB 4.38Å; L416-A616 HydrophobicContact CD1-CB 3.76Å; L416-V617 HydrophobicContact CD1-CG2 3.7Å; L416-V617 HydrophobicContact CD2-CG2 4.06Å
417	L	95.4	Very high	93.4	Very high	103 Å²	103	71.9 Å²	71.9	54%	0.539	38%	0.376	S	S	.	.	H	α-helix	trans	-62.7	-31.1	175.2	-75.1	170.3	0	0	0	112.3	Q413 N414 D415 T420 L421	Q413-L417 HydrophobicContact CG-CD1 4.23Å; Q413-L417 WeakPolarHBondContact O-CB 3.39Å; Q413-L417 WeakPolarHBondContact O-CG 3.27Å; Q413-L417 PolarHBondContact O-N 2.86Å; N414-L417 PolarHBondContact O-N 3.19Å; D415-L417 PolarHBondContact O-N 3.14Å; L417-T420 WeakPolarHBondContact CA-OG1 3.4Å; L417-T420 PolarHBondContact O-OG1 3.42Å; L417-L421 WeakPolarHBondContact O-CB 3.43Å; L417-L421 PolarHBondContact O-N 3.38Å; L417-L421 VanDerWaalsContact O-N 3.17Å
418	T	94.9	Very high	93.1	Very high	82 Å²	82	70.9 Å²	70.9	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-73.4	-44.4	175.9	-61.1	0	0	0	0	111.5	N414 D415 L416 L421 E422	N414-T418 WeakPolarHBondContact O-CB 3.34Å; N414-T418 PolarHBondContact O-N 3.34Å; N414-T418 PolarHBondContact O-OG1 3.13Å; D415-T418 WeakPolarHBondContact O-CB 3.32Å; D415-T418 PolarHBondContact O-N 3.46Å; D415-T418 VanDerWaalsContact O-N 3.15Å; L416-T418 PolarHBondContact O-N 3.13Å; T418-L421 PolarHBondContact O-N 3.12Å; T418-E422 PolarHBondContact O-N 2.94Å; T418-E422 VanDerWaalsContact O-N 3.08Å
419	I	92.7	Very high	92.9	Very high	56 Å²	56	73.6 Å²	73.6	29%	0.287	39%	0.392	S	S	.	.	H	α-helix	trans	-65	-49.2	178.8	-67.9	163.9	0	0	0	110.8	D415 L416 L421 E422 E423 L613 A616	D415-I419 WeakPolarHBondContact O-CG1 3.33Å; D415-I419 PolarHBondContact O-N 3.38Å; L416-I419 PolarHBondContact O-N 2.94Å; I419-L421 VanDerWaalsContact C-N 3.32Å; I419-L421 PolarHBondContact O-N 3.4Å; I419-E422 PolarHBondContact O-N 2.8Å; I419-E423 PolarHBondContact O-N 3.42Å; I419-L613 HydrophobicContact CG2-CB 4.24Å; I419-L613 HydrophobicContact CG2-CD1 4.04Å; I419-A616 HydrophobicContact CD1-CB 3.66Å
420	T	91.4	Very high	92.5	Very high	45 Å²	45	76.2 Å²	76.2	28%	0.276	40%	0.402	S	S	.	.	H	α-helix	trans	-61.4	-36.4	177	48.7	0	0	0	0	113.1	L416 L417 C424 L613	L416-T420 HydrophobicContact CD1-CG2 4.2Å; L416-T420 HydrophobicContact CG-CG2 4.4Å; L416-T420 WeakPolarHBondContact O-CB 3.42Å; L416-T420 WeakPolarHBondContact O-CG2 3.38Å; L416-T420 PolarHBondContact O-N 3.08Å; L416-T420 PolarHBondContact O-OG1 2.9Å; L417-T420 WeakPolarHBondContact CA-OG1 3.4Å; L417-T420 PolarHBondContact O-OG1 3.42Å; T420-C424 WeakPolarHBondContact O-CB 3.39Å; T420-C424 PolarHBondContact O-N 3.29Å; T420-C424 PolarHBondContact O-SG 2.85Å; T420-L613 HydrophobicContact CG2-CD1 3.38Å
421	L	94.4	Very high	92.1	Very high	115 Å²	115	76.7 Å²	76.7	60%	0.602	40%	0.403	S	S	*	.	H	α-helix	trans	-69.5	-40.1	177.1	-174.9	148	0	0	0	112	L417 T418 I419 C424 K425	L417-L421 WeakPolarHBondContact O-CB 3.43Å; L417-L421 PolarHBondContact O-N 3.38Å; L417-L421 VanDerWaalsContact O-N 3.17Å; T418-L421 PolarHBondContact O-N 3.12Å; I419-L421 VanDerWaalsContact C-N 3.32Å; I419-L421 PolarHBondContact O-N 3.4Å; L421-C424 PolarHBondContact O-N 3.42Å; L421-K425 VanDerWaalsContact O-CB 3.28Å; L421-K425 WeakPolarHBondContact O-CB 3.4Å; L421-K425 PolarHBondContact O-N 3.44Å
422	E	89.8	Confident	91.9	Very high	90 Å²	90	75.2 Å²	75.2	42%	0.421	41%	0.407	S	S	.	.	H	α-helix	trans	-71	-33.4	176.5	-173.2	61.4	-163.3	0	0	112	T418 I419 K425 S426	T418-E422 PolarHBondContact O-N 2.94Å; T418-E422 VanDerWaalsContact O-N 3.08Å; I419-E422 PolarHBondContact O-N 2.8Å; E422-K425 IonicContact OE1-NZ 3.85Å; E422-K425 PolarHBondContact OE1-NZ 2.94Å; E422-K425 IonicContact OE2-NZ 2.72Å; E422-K425 PolarHBondContact OE2-NZ 3.33Å; E422-S426 VanDerWaalsContact O-CB 3.3Å; E422-S426 WeakPolarHBondContact O-CB 3.44Å; E422-S426 PolarHBondContact O-N 2.78Å
423	E	88.6	Confident	91.8	Very high	78 Å²	78	80.8 Å²	80.8	36%	0.364	43%	0.434	S	S	.	.	H	α-helix	trans	-65.5	-49.2	169.9	-174.3	180	-165.4	0	0	111.8	I419 K425 S426 N427	I419-E423 PolarHBondContact O-N 3.42Å; E423-K425 VanDerWaalsContact C-N 3.27Å; E423-K425 PolarHBondContact O-N 3.17Å; E423-S426 WeakPolarHBondContact O-CB 3.22Å; E423-S426 PolarHBondContact O-N 3.26Å; E423-N427 WeakPolarHBondContact O-CB 3.49Å; E423-N427 PolarHBondContact O-N 2.91Å
424	C	88.2	Confident	91.6	Very high	87 Å²	87	77.3 Å²	77.3	59%	0.588	42%	0.418	S	S	*	.	H	α-helix	trans	-56	-42.3	174.8	-79.4	0	0	0	0	111.8	T420 L421 N427 A428	T420-C424 WeakPolarHBondContact O-CB 3.39Å; T420-C424 PolarHBondContact O-N 3.29Å; T420-C424 PolarHBondContact O-SG 2.85Å; L421-C424 PolarHBondContact O-N 3.42Å; C424-N427 PolarHBondContact O-N 3Å; C424-A428 WeakPolarHBondContact O-CB 3.47Å; C424-A428 PolarHBondContact O-N 3.28Å
425	K	93.3	Very high	91.4	Very high	81 Å²	81	76 Å²	76	35%	0.352	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-48.9	174.8	169.1	171.2	152.5	-76	0	112	L421 E422 E423 N427 A428 E429	L421-K425 VanDerWaalsContact O-CB 3.28Å; L421-K425 WeakPolarHBondContact O-CB 3.4Å; L421-K425 PolarHBondContact O-N 3.44Å; E422-K425 IonicContact OE1-NZ 3.85Å; E422-K425 PolarHBondContact OE1-NZ 2.94Å; E422-K425 IonicContact OE2-NZ 2.72Å; E422-K425 PolarHBondContact OE2-NZ 3.33Å; E423-K425 VanDerWaalsContact C-N 3.27Å; E423-K425 PolarHBondContact O-N 3.17Å; K425-N427 VanDerWaalsContact C-N 3.31Å; K425-N427 PolarHBondContact O-N 3.08Å; K425-A428 PolarHBondContact O-N 2.92Å; K425-A428 VanDerWaalsContact O-N 3.16Å; K425-E429 VanDerWaalsContact CE-OE1 3.23Å; K425-E429 WeakPolarHBondContact CE-OE1 3.49Å; K425-E429 WeakPolarHBondContact CG-OE1 3.32Å; K425-E429 IonicContact NZ-OE1 2.62Å; K425-E429 WeakPolarHBondContact O-CG 3.12Å; K425-E429 PolarHBondContact O-N 2.94Å
426	S	87.9	Confident	91.3	Very high	48 Å²	48	73.2 Å²	73.2	34%	0.336	41%	0.406	S	S	.	.	H	α-helix	trans	-55.9	-44.1	175.4	179.5	0	0	0	0	111.9	E422 E423 E429 R430	E422-S426 VanDerWaalsContact O-CB 3.3Å; E422-S426 WeakPolarHBondContact O-CB 3.44Å; E422-S426 PolarHBondContact O-N 2.78Å; E423-S426 WeakPolarHBondContact O-CB 3.22Å; E423-S426 PolarHBondContact O-N 3.26Å; S426-E429 PolarHBondContact O-N 2.91Å; S426-R430 WeakPolarHBondContact O-CB 3.44Å; S426-R430 PolarHBondContact O-N 2.99Å
427	N	86.7	Confident	91.2	Very high	67 Å²	67	73.8 Å²	73.8	36%	0.358	41%	0.408	S	S	.	.	H	α-helix	trans	-68.6	-37.8	176.8	-174.3	45.7	0	0	0	112.6	E423 C424 K425 R430 M431	E423-N427 WeakPolarHBondContact O-CB 3.49Å; E423-N427 PolarHBondContact O-N 2.91Å; C424-N427 PolarHBondContact O-N 3Å; K425-N427 VanDerWaalsContact C-N 3.31Å; K425-N427 PolarHBondContact O-N 3.08Å; N427-R430 WeakPolarHBondContact O-CB 3.36Å; N427-R430 PolarHBondContact O-N 3.3Å; N427-R430 PolarHBondContact OD1-NE 3.01Å; N427-R430 VanDerWaalsContact OD1-NE 3.13Å; N427-R430 PolarHBondContact OD1-NH2 3.31Å; N427-M431 WeakPolarHBondContact O-CB 3.32Å; N427-M431 WeakPolarHBondContact O-CG 3.21Å; N427-M431 PolarHBondContact O-N 2.78Å
428	A	89.8	Confident	91.1	Very high	58 Å²	58	73.3 Å²	73.3	48%	0.479	40%	0.399	S	S	.	.	H	α-helix	trans	-66.1	-41.2	174.7	0	0	0	0	0	112.3	C424 K425 M431 S432	C424-A428 WeakPolarHBondContact O-CB 3.47Å; C424-A428 PolarHBondContact O-N 3.28Å; K425-A428 PolarHBondContact O-N 2.92Å; K425-A428 VanDerWaalsContact O-N 3.16Å; A428-M431 PolarHBondContact O-N 3.33Å; A428-S432 WeakPolarHBondContact O-CB 3.28Å; A428-S432 PolarHBondContact O-N 2.99Å
429	E	90.8	Very high	91.1	Very high	112 Å²	112	75.3 Å²	75.3	52%	0.523	40%	0.403	S	S	.	.	H	α-helix	trans	-61.5	-44	172.9	-72.8	175.1	-161.9	0	0	111	K425 S426 S432 M433	K425-E429 VanDerWaalsContact CE-OE1 3.23Å; K425-E429 WeakPolarHBondContact CE-OE1 3.49Å; K425-E429 WeakPolarHBondContact CG-OE1 3.32Å; K425-E429 IonicContact NZ-OE1 2.62Å; K425-E429 WeakPolarHBondContact O-CG 3.12Å; K425-E429 PolarHBondContact O-N 2.94Å; S426-E429 PolarHBondContact O-N 2.91Å; E429-S432 PolarHBondContact O-N 2.86Å; E429-M433 PolarHBondContact O-N 3.06Å
430	R	88.9	Confident	91.2	Very high	79 Å²	79	75.4 Å²	75.4	30%	0.298	41%	0.409	S	S	.	.	H	α-helix	trans	-58.8	-49.8	172.6	-176.7	-170.3	70.5	101.7	-2.2	111.8	S426 N427 S432 M433 L434	S426-R430 WeakPolarHBondContact O-CB 3.44Å; S426-R430 PolarHBondContact O-N 2.99Å; N427-R430 WeakPolarHBondContact O-CB 3.36Å; N427-R430 PolarHBondContact O-N 3.3Å; N427-R430 PolarHBondContact OD1-NE 3.01Å; N427-R430 VanDerWaalsContact OD1-NE 3.13Å; N427-R430 PolarHBondContact OD1-NH2 3.31Å; R430-S432 PolarHBondContact O-N 3.11Å; R430-M433 PolarHBondContact O-N 2.77Å; R430-L434 HydrophobicContact CG-CD1 4.38Å; R430-L434 WeakPolarHBondContact O-CG 3.4Å; R430-L434 PolarHBondContact O-N 2.83Å
431	M	87.6	Confident	91.4	Very high	87 Å²	87	73.4 Å²	73.4	43%	0.429	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-40.2	179.5	-74.8	-179.7	66.7	0	0	112	N427 A428 L434 V435	N427-M431 WeakPolarHBondContact O-CB 3.32Å; N427-M431 WeakPolarHBondContact O-CG 3.21Å; N427-M431 PolarHBondContact O-N 2.78Å; A428-M431 PolarHBondContact O-N 3.33Å; M431-L434 PolarHBondContact O-N 3.48Å; M431-V435 WeakPolarHBondContact O-CG2 3.34Å; M431-V435 PolarHBondContact O-N 2.97Å
432	S	93.4	Very high	91.5	Very high	87 Å²	87	70.3 Å²	70.3	61%	0.608	39%	0.387	S	S	*	.	H	α-helix	trans	-62.1	-42.4	174.7	-177.7	0	0	0	0	111.8	A428 E429 R430 V435 G436	A428-S432 WeakPolarHBondContact O-CB 3.28Å; A428-S432 PolarHBondContact O-N 2.99Å; E429-S432 PolarHBondContact O-N 2.86Å; R430-S432 PolarHBondContact O-N 3.11Å; S432-V435 PolarHBondContact O-N 3.28Å; S432-G436 PolarHBondContact O-N 3.1Å
433	M	91.4	Very high	91.7	Very high	126 Å²	126	69.5 Å²	69.5	62%	0.621	39%	0.388	S	S	*	.	H	α-helix	trans	-63.5	-41.8	174.4	-170.1	-172.2	-60.4	0	0	112.2	E429 R430 G436 K437	E429-M433 PolarHBondContact O-N 3.06Å; R430-M433 PolarHBondContact O-N 2.77Å; M433-G436 PolarHBondContact O-N 3.42Å; M433-K437 WeakPolarHBondContact O-CG 3.49Å; M433-K437 PolarHBondContact O-N 3.39Å
434	L	91.1	Very high	92.1	Very high	5 Å²	5	66 Å²	66	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-61.1	-49.4	175.3	-70.7	173.7	0	0	0	111.1	R430 M431 G436 K437 Y438 E591 I593	R430-L434 HydrophobicContact CG-CD1 4.38Å; R430-L434 WeakPolarHBondContact O-CG 3.4Å; R430-L434 PolarHBondContact O-N 2.83Å; M431-L434 PolarHBondContact O-N 3.48Å; L434-G436 VanDerWaalsContact C-N 3.28Å; L434-G436 PolarHBondContact O-N 3.48Å; L434-K437 HydrophobicContact CD2-CD 4.47Å; L434-K437 WeakPolarHBondContact O-CA 3.49Å; L434-K437 WeakPolarHBondContact O-CB 3.44Å; L434-K437 PolarHBondContact O-N 3.01Å; L434-Y438 VanDerWaalsContact O-CD2 3.23Å; L434-Y438 WeakPolarHBondContact O-CD2 3.39Å; L434-Y438 PolarHBondContact O-N 2.82Å; L434-E591 HydrophobicContact CD2-CB 3.69Å; L434-E591 WeakPolarHBondContact CD2-OE2 3.43Å; L434-I593 HydrophobicContact CD1-CG1 4.38Å
435	V	92.4	Very high	92.4	Very high	74 Å²	74	66.5 Å²	66.5	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-55.3	-44.8	176.3	170.4	0	0	0	0	110.7	M431 S432 K437 Y438 E439	M431-V435 WeakPolarHBondContact O-CG2 3.34Å; M431-V435 PolarHBondContact O-N 2.97Å; S432-V435 PolarHBondContact O-N 3.28Å; V435-K437 PolarHBondContact O-N 3.05Å; V435-Y438 PolarHBondContact O-N 2.94Å; V435-Y438 VanDerWaalsContact O-N 3.12Å; V435-E439 HydrophobicContact CG1-CG 4.1Å; V435-E439 WeakPolarHBondContact O-CB 3.33Å; V435-E439 WeakPolarHBondContact O-CG 3.34Å; V435-E439 PolarHBondContact O-N 3.12Å
436	G	93.8	Very high	92.5	Very high	34 Å²	34	70.8 Å²	70.8	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-59.1	-39.5	174.4	0	0	0	0	0	114.3	S432 M433 L434 S440	S432-G436 PolarHBondContact O-N 3.1Å; M433-G436 PolarHBondContact O-N 3.42Å; L434-G436 VanDerWaalsContact C-N 3.28Å; L434-G436 PolarHBondContact O-N 3.48Å; G436-S440 VanDerWaalsContact O-CB 3.27Å; G436-S440 WeakPolarHBondContact O-CB 3.45Å; G436-S440 PolarHBondContact O-N 3.33Å
437	K	93.4	Very high	92.9	Very high	35 Å²	35	71.9 Å²	71.9	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-45.9	172.1	-65.8	174.7	-174.1	173.3	0	111.2	M433 L434 V435 N441 L588 L590 E591	M433-K437 WeakPolarHBondContact O-CG 3.49Å; M433-K437 PolarHBondContact O-N 3.39Å; L434-K437 HydrophobicContact CD2-CD 4.47Å; L434-K437 WeakPolarHBondContact O-CA 3.49Å; L434-K437 WeakPolarHBondContact O-CB 3.44Å; L434-K437 PolarHBondContact O-N 3.01Å; V435-K437 PolarHBondContact O-N 3.05Å; K437-N441 WeakPolarHBondContact O-CB 3.15Å; K437-N441 PolarHBondContact O-N 3.2Å; K437-L588 HydrophobicContact CB-CD1 4.41Å; K437-L588 HydrophobicContact CG-CD1 4.05Å; K437-L590 HydrophobicContact CB-CD2 4.07Å; K437-E591 IonicContact NZ-OE1 3.93Å; K437-E591 PolarHBondContact NZ-OE1 2.9Å; K437-E591 IonicContact NZ-OE2 2.82Å; K437-E591 PolarHBondContact NZ-OE2 3.1Å
438	Y	93.5	Very high	93.3	Very high	93 Å²	93	69.4 Å²	69.4	37%	0.365	37%	0.374	S	S	.	.	H	α-helix	trans	-65.2	-43.5	179.3	-81.4	-76.4	0	0	0	112.6	L434 V435 N441 A442 L590 E591	L434-Y438 VanDerWaalsContact O-CD2 3.23Å; L434-Y438 WeakPolarHBondContact O-CD2 3.39Å; L434-Y438 PolarHBondContact O-N 2.82Å; V435-Y438 PolarHBondContact O-N 2.94Å; V435-Y438 VanDerWaalsContact O-N 3.12Å; Y438-N441 PolarHBondContact O-N 2.88Å; Y438-A442 WeakPolarHBondContact O-CB 3.5Å; Y438-A442 PolarHBondContact O-N 2.86Å; Y438-L590 HydrophobicContact CD1-CD1 3.9Å; Y438-L590 HydrophobicContact CD1-CD2 3.74Å; Y438-L590 HydrophobicContact CD1-CG 4.37Å; Y438-L590 HydrophobicContact CD2-CD2 4.23Å; Y438-L590 HydrophobicContact CE1-CB 4.22Å; Y438-L590 HydrophobicContact CE1-CD1 3.71Å; Y438-L590 HydrophobicContact CE1-CD2 3.89Å; Y438-L590 HydrophobicContact CE1-CG 4.15Å; Y438-L590 HydrophobicContact CE2-CD2 4.34Å; Y438-L590 HydrophobicContact CG-CD2 3.91Å; Y438-E591 PolarHBondContact OH-O 3.1Å
439	E	94.8	Very high	93.6	Very high	124 Å²	124	71.3 Å²	71.3	58%	0.579	38%	0.375	S	S	*	.	H	α-helix	trans	-65.9	-42.1	177.9	-72.7	179.6	163.3	0	0	112.4	V435 A442 T443	V435-E439 HydrophobicContact CG1-CG 4.1Å; V435-E439 WeakPolarHBondContact O-CB 3.33Å; V435-E439 WeakPolarHBondContact O-CG 3.34Å; V435-E439 PolarHBondContact O-N 3.12Å; E439-A442 PolarHBondContact O-N 3.45Å; E439-T443 WeakPolarHBondContact O-CB 3.5Å; E439-T443 PolarHBondContact O-N 3.06Å; E439-T443 PolarHBondContact O-OG1 3.16Å
440	S	95.1	Very high	93.8	Very high	58 Å²	58	70.3 Å²	70.3	41%	0.406	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-47.8	173.5	-175	0	0	0	0	110.9	G436 T443 A444	G436-S440 VanDerWaalsContact O-CB 3.27Å; G436-S440 WeakPolarHBondContact O-CB 3.45Å; G436-S440 PolarHBondContact O-N 3.33Å; S440-T443 PolarHBondContact O-N 3.38Å; S440-A444 PolarHBondContact O-N 3.42Å
441	N	95.2	Very high	94.1	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-37.9	177.6	-81.9	3.4	0	0	0	113.3	K437 Y438 T443 A444 L445 M587 L588 L590	K437-N441 WeakPolarHBondContact O-CB 3.15Å; K437-N441 PolarHBondContact O-N 3.2Å; Y438-N441 PolarHBondContact O-N 2.88Å; N441-T443 VanDerWaalsContact C-N 3.28Å; N441-T443 PolarHBondContact O-N 2.87Å; N441-A444 PolarHBondContact O-N 2.77Å; N441-L445 WeakPolarHBondContact O-CB 3.48Å; N441-L445 VanDerWaalsContact O-CG 3.3Å; N441-L445 WeakPolarHBondContact O-CG 3.32Å; N441-L445 PolarHBondContact O-N 2.91Å; N441-M587 WeakPolarHBondContact OD1-CA 3.49Å; N441-L588 PolarHBondContact ND2-O 3.48Å; N441-L588 PolarHBondContact OD1-N 2.97Å; N441-L590 WeakPolarHBondContact ND2-CD2 3.37Å; N441-L590 VanDerWaalsContact ND2-CG 3.34Å; N441-L590 WeakPolarHBondContact ND2-CG 3.45Å
442	A	95	Very high	94.5	Very high	49 Å²	49	66.3 Å²	66.3	41%	0.405	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-36.6	174.7	0	0	0	0	0	111.6	Y438 E439 R446	Y438-A442 WeakPolarHBondContact O-CB 3.5Å; Y438-A442 PolarHBondContact O-N 2.86Å; E439-A442 PolarHBondContact O-N 3.45Å; A442-R446 WeakPolarHBondContact O-CB 3.36Å; A442-R446 PolarHBondContact O-N 3.11Å
443	T	95.4	Very high	94.6	Very high	73 Å²	73	67.3 Å²	67.3	45%	0.448	35%	0.349	S	S	.	.	H	α-helix	trans	-69.1	-45.2	175	-55.7	0	0	0	0	111.4	E439 S440 N441 R446 L447	E439-T443 WeakPolarHBondContact O-CB 3.5Å; E439-T443 PolarHBondContact O-N 3.06Å; E439-T443 PolarHBondContact O-OG1 3.16Å; S440-T443 PolarHBondContact O-N 3.38Å; N441-T443 VanDerWaalsContact C-N 3.28Å; N441-T443 PolarHBondContact O-N 2.87Å; T443-R446 PolarHBondContact O-N 3.39Å; T443-L447 WeakPolarHBondContact O-CG 3.27Å; T443-L447 PolarHBondContact O-N 2.91Å
444	A	95.8	Very high	94.7	Very high	5 Å²	5	63.8 Å²	63.8	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-61	-44.1	174.4	0	0	0	0	0	112	S440 N441 R446 L447 A448 V583 M587	S440-A444 PolarHBondContact O-N 3.42Å; N441-A444 PolarHBondContact O-N 2.77Å; A444-R446 VanDerWaalsContact C-N 3.34Å; A444-R446 PolarHBondContact O-N 2.85Å; A444-L447 PolarHBondContact O-N 2.79Å; A444-A448 WeakPolarHBondContact O-CB 3.32Å; A444-A448 PolarHBondContact O-N 2.98Å; A444-V583 HydrophobicContact CB-CG1 3.89Å; A444-V583 WeakPolarHBondContact O-CG1 3.32Å; A444-M587 HydrophobicContact CB-CG 3.95Å
445	L	94.8	Very high	94.9	Very high	97 Å²	97	64.2 Å²	64.2	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-38.8	175.6	-76.6	169.5	0	0	0	112.4	N441 A448 L449 M587	N441-L445 WeakPolarHBondContact O-CB 3.48Å; N441-L445 VanDerWaalsContact O-CG 3.3Å; N441-L445 WeakPolarHBondContact O-CG 3.32Å; N441-L445 PolarHBondContact O-N 2.91Å; L445-A448 PolarHBondContact O-N 3.27Å; L445-L449 WeakPolarHBondContact O-CB 3.23Å; L445-L449 PolarHBondContact O-N 2.8Å; L445-M587 HydrophobicContact CD1-CE 4.07Å; L445-M587 HydrophobicContact CD2-CE 3.74Å; L445-M587 HydrophobicContact CD2-SD 4.02Å; L445-M587 HydrophobicContact CG-CE 3.73Å; L445-M587 HydrophobicContact CG-SD 4.3Å
446	R	96.4	Very high	95.1	Very high	172 Å²	172	65 Å²	65	65%	0.649	33%	0.334	S	S	*	.	H	α-helix	trans	-64.2	-43.4	175.6	-171.5	179.4	-65.4	143	1.8	112.1	A442 T443 A444 L449 Q450	A442-R446 WeakPolarHBondContact O-CB 3.36Å; A442-R446 PolarHBondContact O-N 3.11Å; T443-R446 PolarHBondContact O-N 3.39Å; A444-R446 VanDerWaalsContact C-N 3.34Å; A444-R446 PolarHBondContact O-N 2.85Å; R446-L449 PolarHBondContact O-N 3.37Å; R446-Q450 PolarHBondContact O-N 2.87Å
447	L	95.7	Very high	95.1	Very high	71 Å²	71	66.9 Å²	66.9	37%	0.372	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-42.6	174.8	-69.6	169.4	0	0	0	111.8	T443 A444 L449 Q450 Y451 V583	T443-L447 WeakPolarHBondContact O-CG 3.27Å; T443-L447 PolarHBondContact O-N 2.91Å; A444-L447 PolarHBondContact O-N 2.79Å; L447-L449 VanDerWaalsContact C-N 3.27Å; L447-L449 PolarHBondContact O-N 3.49Å; L447-Q450 PolarHBondContact O-N 3.45Å; L447-Y451 WeakPolarHBondContact O-CD2 3.43Å; L447-Y451 PolarHBondContact O-N 2.86Å; L447-V583 HydrophobicContact CB-CG1 4.07Å; L447-V583 HydrophobicContact CB-CG2 4.36Å
448	A	95.4	Very high	95.2	Very high	14 Å²	14	65.2 Å²	65.2	12%	0.116	33%	0.327	C	S	.	.	H	α-helix	trans	-65.7	-29	176.4	0	0	0	0	0	113	A444 L445 S452 R580 V583	A444-A448 WeakPolarHBondContact O-CB 3.32Å; A444-A448 PolarHBondContact O-N 2.98Å; L445-A448 PolarHBondContact O-N 3.27Å; A448-S452 PolarHBondContact O-N 3.3Å; A448-S452 PolarHBondContact O-OG 2.83Å; A448-R580 HydrophobicContact CB-CG 4.22Å; A448-V583 HydrophobicContact CB-CG1 4.11Å
449	L	95.1	Very high	95.4	Very high	99 Å²	99	66.1 Å²	66.1	52%	0.518	33%	0.331	S	S	.	.	H	α-helix	trans	-70.4	-49.5	170.3	-178.6	64.6	0	0	0	110.9	L445 R446 L447 Y451 S452 E453	L445-L449 WeakPolarHBondContact O-CB 3.23Å; L445-L449 PolarHBondContact O-N 2.8Å; R446-L449 PolarHBondContact O-N 3.37Å; L447-L449 VanDerWaalsContact C-N 3.27Å; L447-L449 PolarHBondContact O-N 3.49Å; L449-Y451 VanDerWaalsContact C-N 3.34Å; L449-Y451 PolarHBondContact O-N 2.7Å; L449-S452 CarbonylContact O-C 3.52Å; L449-S452 VanDerWaalsContact O-CA 3.29Å; L449-S452 WeakPolarHBondContact O-CA 3.37Å; L449-S452 WeakPolarHBondContact O-CB 3.46Å; L449-S452 PolarHBondContact O-N 2.94Å; L449-E453 HydrophobicContact CG-CG 4.5Å; L449-E453 WeakPolarHBondContact O-CG 3.45Å; L449-E453 PolarHBondContact O-N 2.87Å
450	Q	95.4	Very high	95.5	Very high	90 Å²	90	66 Å²	66	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-57.1	-43.8	178	-174.7	179.7	-1.3	0	0	112.5	R446 L447 S452 E453 Q454	R446-Q450 PolarHBondContact O-N 2.87Å; L447-Q450 PolarHBondContact O-N 3.45Å; Q450-S452 PolarHBondContact O-N 2.86Å; Q450-E453 PolarHBondContact O-N 2.85Å; Q450-Q454 WeakPolarHBondContact O-CG 3.28Å; Q450-Q454 PolarHBondContact O-N 2.84Å
451	Y	94.9	Very high	95.5	Very high	66 Å²	66	64.4 Å²	64.4	26%	0.259	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-25.3	172.5	-68.5	-49.6	0	0	0	113.2	L447 L449 C455 L576 D579 R580 V583	L447-Y451 WeakPolarHBondContact O-CD2 3.43Å; L447-Y451 PolarHBondContact O-N 2.86Å; L449-Y451 VanDerWaalsContact C-N 3.34Å; L449-Y451 PolarHBondContact O-N 2.7Å; Y451-C455 WeakPolarHBondContact O-CB 3.46Å; Y451-C455 PolarHBondContact O-N 2.86Å; Y451-L576 HydrophobicContact CD1-CD2 3.77Å; Y451-L576 HydrophobicContact CE1-CD2 4.47Å; Y451-D579 HydrophobicContact CD1-CB 4.48Å; Y451-D579 HydrophobicContact CD2-CB 4.37Å; Y451-D579 HydrophobicContact CE1-CB 4.15Å; Y451-D579 HydrophobicContact CE2-CB 4.03Å; Y451-R580 HydrophobicContact CD2-CB 4.47Å; Y451-V583 HydrophobicContact CD2-CG2 4.36Å; Y451-V583 HydrophobicContact CE2-CG2 3.82Å
452	S	95.4	Very high	95.5	Very high	16 Å²	16	66 Å²	66	11%	0.112	33%	0.325	C	S	.	.	H	α-helix	trans	-74.9	-42	173	-55.8	0	0	0	0	111.7	A448 L449 Q450 C455 I456 R580	A448-S452 PolarHBondContact O-N 3.3Å; A448-S452 PolarHBondContact O-OG 2.83Å; L449-S452 CarbonylContact O-C 3.52Å; L449-S452 VanDerWaalsContact O-CA 3.29Å; L449-S452 WeakPolarHBondContact O-CA 3.37Å; L449-S452 WeakPolarHBondContact O-CB 3.46Å; L449-S452 PolarHBondContact O-N 2.94Å; Q450-S452 PolarHBondContact O-N 2.86Å; S452-C455 WeakPolarHBondContact O-CB 3.49Å; S452-C455 PolarHBondContact O-N 3.36Å; S452-I456 VanDerWaalsContact O-CG1 3.3Å; S452-I456 WeakPolarHBondContact O-CG1 3.45Å; S452-I456 PolarHBondContact O-N 2.99Å; S452-R580 WeakPolarHBondContact OG-CD 3.2Å; S452-R580 PolarHBondContact OG-NE 3.35Å; S452-R580 PolarHBondContact OG-NH1 2.93Å; S452-R580 PolarHBondContact OG-NH2 3.25Å
453	E	95.8	Very high	95.6	Very high	109 Å²	109	68.3 Å²	68.3	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-48.2	176.6	-67.9	166.2	169.3	0	0	111.1	L449 Q450 C455 I456 E457	L449-E453 HydrophobicContact CG-CG 4.5Å; L449-E453 WeakPolarHBondContact O-CG 3.45Å; L449-E453 PolarHBondContact O-N 2.87Å; Q450-E453 PolarHBondContact O-N 2.85Å; E453-C455 VanDerWaalsContact C-N 3.26Å; E453-C455 PolarHBondContact O-N 3.09Å; E453-I456 WeakPolarHBondContact O-CB 3.33Å; E453-I456 PolarHBondContact O-N 3.37Å; E453-I456 VanDerWaalsContact O-N 3.07Å; E453-E457 PolarHBondContact O-N 2.91Å
454	Q	93.9	Very high	95.6	Very high	52 Å²	52	66.6 Å²	66.6	24%	0.243	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-33.7	174.5	-69.7	173	-16	0	0	112.5	Q450 I456 A458 L576	Q450-Q454 WeakPolarHBondContact O-CG 3.28Å; Q450-Q454 PolarHBondContact O-N 2.84Å; Q454-I456 VanDerWaalsContact C-N 3.34Å; Q454-A458 WeakPolarHBondContact O-CB 3.4Å; Q454-A458 PolarHBondContact O-N 3.34Å; Q454-A458 VanDerWaalsContact O-N 3.15Å; Q454-L576 HydrophobicContact CB-CD1 3.85Å; Q454-L576 HydrophobicContact CB-CD2 4.05Å
455	C	95.6	Very high	95.5	Very high	13 Å²	13	67 Å²	67	9%	0.088	33%	0.325	C	S	.	.	H	α-helix	trans	-72.4	-30.2	176.1	-170.1	0	0	0	0	111.6	Y451 S452 E453 Y459 L576	Y451-C455 WeakPolarHBondContact O-CB 3.46Å; Y451-C455 PolarHBondContact O-N 2.86Å; S452-C455 WeakPolarHBondContact O-CB 3.49Å; S452-C455 PolarHBondContact O-N 3.36Å; E453-C455 VanDerWaalsContact C-N 3.26Å; E453-C455 PolarHBondContact O-N 3.09Å; C455-Y459 WeakPolarHBondContact O-CB 3.38Å; C455-Y459 WeakPolarHBondContact O-CD2 3.47Å; C455-Y459 PolarHBondContact O-N 2.87Å; C455-Y459 WeakPolarHBondContact SG-CE2 3.39Å; C455-L576 HydrophobicContact CB-CB 4.33Å; C455-L576 HydrophobicContact CB-CD1 4.08Å
456	I	96.1	Very high	95.5	Very high	90 Å²	90	64.2 Å²	64.2	46%	0.462	32%	0.316	S	S	.	.	H	α-helix	trans	-70.9	-49.5	172.8	-69	161	0	0	0	110.1	S452 E453 Q454 A458 Y459 E460	S452-I456 VanDerWaalsContact O-CG1 3.3Å; S452-I456 WeakPolarHBondContact O-CG1 3.45Å; S452-I456 PolarHBondContact O-N 2.99Å; E453-I456 WeakPolarHBondContact O-CB 3.33Å; E453-I456 PolarHBondContact O-N 3.37Å; E453-I456 VanDerWaalsContact O-N 3.07Å; Q454-I456 VanDerWaalsContact C-N 3.34Å; I456-A458 PolarHBondContact O-N 3.44Å; I456-Y459 PolarHBondContact O-N 2.91Å; I456-E460 HydrophobicContact CG2-CG 4.12Å; I456-E460 WeakPolarHBondContact CG2-OE1 3.36Å; I456-E460 WeakPolarHBondContact O-CG 3.33Å; I456-E460 PolarHBondContact O-N 3.1Å
457	E	95.4	Very high	95.4	Very high	75 Å²	75	61 Å²	61	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-51.3	-45.2	175.3	-172.9	-173.4	178.1	0	0	110.7	E453 L461 L516 K519	E453-E457 PolarHBondContact O-N 2.91Å; E457-L461 VanDerWaalsContact O-CG 3.3Å; E457-L461 WeakPolarHBondContact O-CG 3.46Å; E457-L461 PolarHBondContact O-N 2.85Å; E457-L516 HydrophobicContact CB-CD1 4.36Å; E457-L516 HydrophobicContact CG-CD1 3.73Å; E457-K519 IonicContact OE1-NZ 3Å; E457-K519 PolarHBondContact OE1-NZ 3.16Å
458	A	95.3	Very high	95.3	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.2	-37.4	177.8	0	0	0	0	0	113.8	Q454 I456 L462 L569 Y572 I573	Q454-A458 WeakPolarHBondContact O-CB 3.4Å; Q454-A458 PolarHBondContact O-N 3.34Å; Q454-A458 VanDerWaalsContact O-N 3.15Å; I456-A458 PolarHBondContact O-N 3.44Å; A458-L462 WeakPolarHBondContact O-CB 3.49Å; A458-L462 PolarHBondContact O-N 3.17Å; A458-L569 HydrophobicContact CB-CD1 3.92Å; A458-Y572 HydrophobicContact CB-CD1 4.28Å; A458-Y572 HydrophobicContact CB-CE1 4.4Å; A458-I573 HydrophobicContact CB-CD1 3.92Å; A458-I573 HydrophobicContact CB-CG1 3.51Å
459	Y	97.1	Very high	95	Very high	112 Å²	112	61.3 Å²	61.3	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-69.3	-38.7	174.9	-85.9	-53.4	0	0	0	112.6	C455 I456 L462 L463 I573	C455-Y459 WeakPolarHBondContact O-CB 3.38Å; C455-Y459 WeakPolarHBondContact O-CD2 3.47Å; C455-Y459 PolarHBondContact O-N 2.87Å; C455-Y459 WeakPolarHBondContact SG-CE2 3.39Å; I456-Y459 PolarHBondContact O-N 2.91Å; Y459-L462 PolarHBondContact O-N 3.35Å; Y459-L463 WeakPolarHBondContact O-CB 3.29Å; Y459-L463 PolarHBondContact O-N 2.97Å; Y459-I573 HydrophobicContact CD1-CD1 3.9Å; Y459-I573 HydrophobicContact CD1-CG2 4.47Å; Y459-I573 HydrophobicContact CE1-CD1 4.1Å; Y459-I573 HydrophobicContact CE1-CG2 3.76Å; Y459-I573 HydrophobicContact CE2-CG2 3.89Å; Y459-I573 HydrophobicContact CG-CD1 4.33Å; Y459-I573 VanDerWaalsContact CZ-CG2 3.42Å; Y459-I573 WeakPolarHBondContact OH-CG2 3.39Å
460	E	97.1	Very high	94.9	Very high	121 Å²	121	62.4 Å²	62.4	57%	0.565	31%	0.309	S	S	*	.	H	α-helix	trans	-62.8	-42.6	177.5	-73.8	176.8	169.3	0	0	111.5	I456 L462 L463 A464	I456-E460 HydrophobicContact CG2-CG 4.12Å; I456-E460 WeakPolarHBondContact CG2-OE1 3.36Å; I456-E460 WeakPolarHBondContact O-CG 3.33Å; I456-E460 PolarHBondContact O-N 3.1Å; E460-L462 PolarHBondContact O-N 3.44Å; E460-L463 PolarHBondContact O-N 3.34Å; E460-A464 WeakPolarHBondContact O-CB 3.44Å; E460-A464 PolarHBondContact O-N 3.31Å
461	L	95.6	Very high	94.6	Very high	25 Å²	25	61 Å²	61	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-39.3	174.6	-67.8	171.9	0	0	0	112.3	E457 A464 L465 A512 L516 L569	E457-L461 VanDerWaalsContact O-CG 3.3Å; E457-L461 WeakPolarHBondContact O-CG 3.46Å; E457-L461 PolarHBondContact O-N 2.85Å; L461-A464 PolarHBondContact O-N 2.82Å; L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 VanDerWaalsContact O-CG 3.28Å; L461-L465 WeakPolarHBondContact O-CG 3.3Å; L461-L465 PolarHBondContact O-N 3.18Å; L461-A512 HydrophobicContact CD2-CB 3.49Å; L461-A512 VanDerWaalsContact CD2-CB 3.49Å; L461-L516 HydrophobicContact CD1-CB 4.01Å; L461-L516 HydrophobicContact CD1-CD1 3.92Å; L461-L516 HydrophobicContact CD1-CG 4.45Å; L461-L569 HydrophobicContact CB-CD2 4.5Å
462	L	95.3	Very high	94.4	Very high	37 Å²	37	59.2 Å²	59.2	19%	0.194	30%	0.303	C	S	.	.	H	α-helix	trans	-68.6	-37.6	177.9	-148.7	163	0	0	0	111.4	A458 Y459 E460 A466 L569 K570 I573	A458-L462 WeakPolarHBondContact O-CB 3.49Å; A458-L462 PolarHBondContact O-N 3.17Å; Y459-L462 PolarHBondContact O-N 3.35Å; E460-L462 PolarHBondContact O-N 3.44Å; L462-A466 PolarHBondContact O-N 3.41Å; L462-A466 VanDerWaalsContact O-N 3.13Å; L462-L569 HydrophobicContact CB-CD2 4.04Å; L462-L569 HydrophobicContact CD1-CD2 4.26Å; L462-L569 HydrophobicContact CD1-CG 4.35Å; L462-L569 HydrophobicContact CG-CD2 4.14Å; L462-K570 HydrophobicContact CD1-CG 3.69Å; L462-I573 HydrophobicContact CD1-CD1 3.78Å
463	L	96.3	Very high	94.1	Very high	97 Å²	97	61.8 Å²	61.8	51%	0.508	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-49.5	171.3	179.5	62.2	0	0	0	111.4	Y459 E460 L465 A466 E467	Y459-L463 WeakPolarHBondContact O-CB 3.29Å; Y459-L463 PolarHBondContact O-N 2.97Å; E460-L463 PolarHBondContact O-N 3.34Å; L463-L465 VanDerWaalsContact C-N 3.29Å; L463-L465 PolarHBondContact O-N 2.97Å; L463-A466 PolarHBondContact O-N 3.06Å; L463-E467 HydrophobicContact CD1-CG 4.02Å; L463-E467 HydrophobicContact CG-CG 4.28Å; L463-E467 WeakPolarHBondContact O-CG 3.5Å; L463-E467 PolarHBondContact O-N 2.88Å
464	A	95.6	Very high	93.7	Very high	38 Å²	38	62.2 Å²	62.2	31%	0.314	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-37.9	179.2	0	0	0	0	0	112.5	E460 L461 S468 A509	E460-A464 WeakPolarHBondContact O-CB 3.44Å; E460-A464 PolarHBondContact O-N 3.31Å; L461-A464 PolarHBondContact O-N 2.82Å; A464-S468 VanDerWaalsContact O-CB 3.25Å; A464-S468 WeakPolarHBondContact O-CB 3.3Å; A464-S468 PolarHBondContact O-N 3.42Å; A464-S468 PolarHBondContact O-OG 2.86Å; A464-A509 HydrophobicContact CB-CB 4.12Å
465	L	93.8	Very high	93.3	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-51.1	171	-75.3	166.2	0	0	0	111.1	L461 L463 E467 S468 E469 A509 E510 A513 F561 L569	L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 VanDerWaalsContact O-CG 3.28Å; L461-L465 WeakPolarHBondContact O-CG 3.3Å; L461-L465 PolarHBondContact O-N 3.18Å; L463-L465 VanDerWaalsContact C-N 3.29Å; L463-L465 PolarHBondContact O-N 2.97Å; L465-E467 PolarHBondContact O-N 2.85Å; L465-S468 PolarHBondContact O-N 3.45Å; L465-S468 PolarHBondContact O-OG 2.97Å; L465-E469 PolarHBondContact O-N 3.34Å; L465-A509 HydrophobicContact CD2-CB 3.94Å; L465-A509 HydrophobicContact CG-CB 4.13Å; L465-E510 HydrophobicContact CD2-CB 4.44Å; L465-E510 HydrophobicContact CD2-CG 3.65Å; L465-A513 HydrophobicContact CD1-CB 4.08Å; L465-F561 HydrophobicContact CD1-CD1 4.48Å; L465-F561 HydrophobicContact CD1-CE1 3.61Å; L465-F561 HydrophobicContact CD1-CE2 4.5Å; L465-F561 HydrophobicContact CD1-CZ 3.62Å; L465-F561 HydrophobicContact CD2-CD1 4.25Å; L465-F561 HydrophobicContact CD2-CE1 4.16Å; L465-L569 HydrophobicContact CD1-CD2 4.45Å
466	A	93.9	Very high	92.9	Very high	37 Å²	37	64.2 Å²	64.2	31%	0.306	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-38.7	-179.7	0	0	0	0	0	113.6	L462 L463 E469 Q470	L462-A466 PolarHBondContact O-N 3.41Å; L462-A466 VanDerWaalsContact O-N 3.13Å; L463-A466 PolarHBondContact O-N 3.06Å; A466-E469 PolarHBondContact O-N 3.36Å; A466-Q470 WeakPolarHBondContact O-CG 3.24Å; A466-Q470 PolarHBondContact O-N 3.23Å
467	E	94.6	Very high	92.4	Very high	105 Å²	105	65.6 Å²	65.6	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-68.4	-38.4	175.2	-71.5	-177.3	166.3	0	0	111.9	L463 L465 S471	L463-E467 HydrophobicContact CD1-CG 4.02Å; L463-E467 HydrophobicContact CG-CG 4.28Å; L463-E467 WeakPolarHBondContact O-CG 3.5Å; L463-E467 PolarHBondContact O-N 2.88Å; L465-E467 PolarHBondContact O-N 2.85Å; E467-S471 VanDerWaalsContact O-CB 3.31Å; E467-S471 WeakPolarHBondContact O-CB 3.46Å; E467-S471 PolarHBondContact O-N 2.97Å; E467-S471 PolarHBondContact O-OG 3.42Å
468	S	92.9	Very high	91.9	Very high	8 Å²	8	67.7 Å²	67.7	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-67.6	-36.1	174.7	78.8	0	0	0	0	112.2	A464 L465 S471 L472 R506	A464-S468 VanDerWaalsContact O-CB 3.25Å; A464-S468 WeakPolarHBondContact O-CB 3.3Å; A464-S468 PolarHBondContact O-N 3.42Å; A464-S468 PolarHBondContact O-OG 2.86Å; L465-S468 PolarHBondContact O-N 3.45Å; L465-S468 PolarHBondContact O-OG 2.97Å; S468-S471 PolarHBondContact O-N 3.27Å; S468-L472 VanDerWaalsContact O-CB 3.27Å; S468-L472 WeakPolarHBondContact O-CB 3.44Å; S468-L472 PolarHBondContact O-N 3.47Å; S468-R506 WeakPolarHBondContact OG-CB 3.37Å; S468-R506 WeakPolarHBondContact OG-CG 3.07Å
469	E	91.1	Very high	91.2	Very high	84 Å²	84	70.5 Å²	70.5	39%	0.393	36%	0.359	S	S	.	.	H	α-helix	trans	-66.1	-47.3	174.1	-177.8	156.4	-90.5	0	0	111.7	L465 A466 S471 L472 I473 R506	L465-E469 PolarHBondContact O-N 3.34Å; A466-E469 PolarHBondContact O-N 3.36Å; E469-S471 VanDerWaalsContact C-N 3.32Å; E469-S471 PolarHBondContact O-N 3.33Å; E469-L472 PolarHBondContact O-N 3.45Å; E469-I473 HydrophobicContact CG-CD1 3.79Å; E469-I473 WeakPolarHBondContact O-CB 3.43Å; E469-I473 VanDerWaalsContact O-CG1 3.27Å; E469-I473 WeakPolarHBondContact O-CG1 3.26Å; E469-I473 PolarHBondContact O-N 3.14Å; E469-R506 IonicContact OE1-CZ 3.83Å; E469-R506 IonicContact OE1-NH1 2.77Å; E469-R506 PolarHBondContact OE1-NH1 2.92Å; E469-R506 IonicContact OE1-NH2 3.03Å
470	Q	92	Very high	90.6	Very high	122 Å²	122	68.8 Å²	68.8	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-58.7	-43.8	173.4	-72.7	174.6	55	0	0	111.7	A466 L472 I473 L474	A466-Q470 WeakPolarHBondContact O-CG 3.24Å; A466-Q470 PolarHBondContact O-N 3.23Å; Q470-L472 VanDerWaalsContact C-N 3.34Å; Q470-L472 PolarHBondContact O-N 2.89Å; Q470-I473 PolarHBondContact O-N 3.32Å; Q470-L474 WeakPolarHBondContact O-CB 3.32Å; Q470-L474 VanDerWaalsContact O-CG 3.25Å; Q470-L474 WeakPolarHBondContact O-CG 3.36Å; Q470-L474 PolarHBondContact O-N 2.9Å
471	S	89.9	Confident	89.5	Confident	59 Å²	59	65.3 Å²	65.3	41%	0.413	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-40.6	177.9	-61.3	0	0	0	0	112.4	E467 S468 E469 G475	E467-S471 VanDerWaalsContact O-CB 3.31Å; E467-S471 WeakPolarHBondContact O-CB 3.46Å; E467-S471 PolarHBondContact O-N 2.97Å; E467-S471 PolarHBondContact O-OG 3.42Å; S468-S471 PolarHBondContact O-N 3.27Å; E469-S471 VanDerWaalsContact C-N 3.32Å; E469-S471 PolarHBondContact O-N 3.33Å; S471-G475 PolarHBondContact O-N 2.84Å
472	L	89.2	Confident	88.2	Confident	30 Å²	30	68.5 Å²	68.5	16%	0.157	39%	0.385	C	S	.	.	H	α-helix	trans	-69.2	-42.9	178	-177.6	142.8	0	0	0	111.5	S468 E469 Q470 G475 Q476 A502	S468-L472 VanDerWaalsContact O-CB 3.27Å; S468-L472 WeakPolarHBondContact O-CB 3.44Å; S468-L472 PolarHBondContact O-N 3.47Å; E469-L472 PolarHBondContact O-N 3.45Å; Q470-L472 VanDerWaalsContact C-N 3.34Å; Q470-L472 PolarHBondContact O-N 2.89Å; L472-G475 PolarHBondContact O-N 3.16Å; L472-Q476 VanDerWaalsContact O-CG 3.32Å; L472-Q476 WeakPolarHBondContact O-CG 3.49Å; L472-Q476 PolarHBondContact O-N 3.03Å; L472-A502 HydrophobicContact CB-CB 4.24Å
473	I	90.3	Very high	86.7	Confident	69 Å²	69	70.7 Å²	70.7	35%	0.354	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-44.5	174.6	-70.6	166.9	0	0	0	111.3	E469 Q470 Q476 F477	E469-I473 HydrophobicContact CG-CD1 3.79Å; E469-I473 WeakPolarHBondContact O-CB 3.43Å; E469-I473 VanDerWaalsContact O-CG1 3.27Å; E469-I473 WeakPolarHBondContact O-CG1 3.26Å; E469-I473 PolarHBondContact O-N 3.14Å; Q470-I473 PolarHBondContact O-N 3.32Å; I473-Q476 PolarHBondContact O-N 2.94Å; I473-F477 HydrophobicContact CG2-CD2 3.7Å; I473-F477 HydrophobicContact CG2-CE2 3.46Å; I473-F477 VanDerWaalsContact CG2-CE2 3.46Å; I473-F477 VanDerWaalsContact O-CD2 3.27Å; I473-F477 WeakPolarHBondContact O-CD2 3.47Å; I473-F477 PolarHBondContact O-N 3.07Å
474	L	87.1	Confident	84.9	Confident	118 Å²	118	69.2 Å²	69.2	62%	0.618	41%	0.414	S	S	*	.	H	α-helix	trans	-64.5	-39.4	176.6	-72.7	169.6	0	0	0	112.2	Q470 R478	Q470-L474 WeakPolarHBondContact O-CB 3.32Å; Q470-L474 VanDerWaalsContact O-CG 3.25Å; Q470-L474 WeakPolarHBondContact O-CG 3.36Å; Q470-L474 PolarHBondContact O-N 2.9Å; L474-R478 PolarHBondContact O-N 3.29Å; L474-R478 VanDerWaalsContact O-N 3.09Å
475	G	85.9	Confident	83.1	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.01	43%	0.434	C	S	.	.	H	α-helix	trans	-61.3	-42.2	172	0	0	0	0	0	112.5	S471 L472 R478 A479	S471-G475 PolarHBondContact O-N 2.84Å; L472-G475 PolarHBondContact O-N 3.16Å; G475-R478 PolarHBondContact O-N 2.85Å; G475-A479 WeakPolarHBondContact O-CB 3.3Å; G475-A479 PolarHBondContact O-N 3.11Å
476	Q	87.1	Confident	81.2	Confident	107 Å²	107	78.5 Å²	78.5	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-44.9	177.3	-75.3	174.4	-8.9	0	0	112.3	L472 I473 R478 A479 A480 L499	L472-Q476 VanDerWaalsContact O-CG 3.32Å; L472-Q476 WeakPolarHBondContact O-CG 3.49Å; L472-Q476 PolarHBondContact O-N 3.03Å; I473-Q476 PolarHBondContact O-N 2.94Å; Q476-R478 VanDerWaalsContact C-N 3.32Å; Q476-R478 PolarHBondContact O-N 2.9Å; Q476-A479 PolarHBondContact O-N 2.99Å; Q476-A480 WeakPolarHBondContact O-CB 3.48Å; Q476-A480 PolarHBondContact O-N 3.35Å; Q476-L499 HydrophobicContact CG-CD2 4.08Å
477	F	85.5	Confident	79.4	Confident	118 Å²	118	80.1 Å²	80.1	52%	0.518	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-41.5	175.3	-80.6	-59.6	0	0	0	112.2	I473 A480 G481 V482	I473-F477 HydrophobicContact CG2-CD2 3.7Å; I473-F477 HydrophobicContact CG2-CE2 3.46Å; I473-F477 VanDerWaalsContact CG2-CE2 3.46Å; I473-F477 VanDerWaalsContact O-CD2 3.27Å; I473-F477 WeakPolarHBondContact O-CD2 3.47Å; I473-F477 PolarHBondContact O-N 3.07Å; F477-A480 CarbonylContact O-C 3.59Å; F477-A480 PolarHBondContact O-N 2.9Å; F477-G481 PolarHBondContact O-N 2.84Å; F477-V482 HydrophobicContact CB-CB 4.41Å; F477-V482 HydrophobicContact CD1-CG2 4.45Å; F477-V482 WeakPolarHBondContact O-CB 3.47Å; F477-V482 PolarHBondContact O-N 2.9Å
478	R	83.8	Confident	77.5	Confident	120 Å²	120	81 Å²	81	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-66.8	-39.4	177.1	-165.9	177.1	-68.9	-175.3	-0.9	112.2	L474 G475 Q476 A480 G481 I495	L474-R478 PolarHBondContact O-N 3.29Å; L474-R478 VanDerWaalsContact O-N 3.09Å; G475-R478 PolarHBondContact O-N 2.85Å; Q476-R478 VanDerWaalsContact C-N 3.32Å; Q476-R478 PolarHBondContact O-N 2.9Å; R478-A480 VanDerWaalsContact C-N 3.29Å; R478-A480 PolarHBondContact O-N 3.14Å; R478-G481 PolarHBondContact O-N 3.4Å; R478-I495 HydrophobicContact CG-CD1 3.87Å; R478-I495 HydrophobicContact CG-CG1 3.87Å
479	A	82.1	Confident	75.7	Confident	59 Å²	59	89.7 Å²	89.7	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-27.7	173.2	0	0	0	0	0	113.3	G475 Q476 G481 I495 L499	G475-A479 WeakPolarHBondContact O-CB 3.3Å; G475-A479 PolarHBondContact O-N 3.11Å; Q476-A479 PolarHBondContact O-N 2.99Å; A479-G481 PolarHBondContact O-N 3.15Å; A479-I495 HydrophobicContact CB-CG2 3.71Å; A479-L499 HydrophobicContact CB-CD1 3.8Å
480	A	84	Confident	74	Confident	75 Å²	75	90 Å²	90	62%	0.62	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	8.2	169.7	0	0	0	0	0	113.6	Q476 F477 R478 V482	Q476-A480 WeakPolarHBondContact O-CB 3.48Å; Q476-A480 PolarHBondContact O-N 3.35Å; F477-A480 CarbonylContact O-C 3.59Å; F477-A480 PolarHBondContact O-N 2.9Å; R478-A480 VanDerWaalsContact C-N 3.29Å; R478-A480 PolarHBondContact O-N 3.14Å; A480-V482 VanDerWaalsContact C-N 3.26Å; A480-V482 HydrophobicContact CB-CG2 4.33Å; A480-V482 PolarHBondContact O-N 3.1Å
481	G	73.8	Confident	72.5	Confident	48 Å²	48	85.1 Å²	85.1	50%	0.495	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.8	-179.7	0	0	0	0	0	115	F477 R478 A479 G483	F477-G481 PolarHBondContact O-N 2.84Å; R478-G481 PolarHBondContact O-N 3.4Å; A479-G481 PolarHBondContact O-N 3.15Å; G481-G483 PolarHBondContact O-N 3.49Å
482	V	68.4	Low	71.2	Confident	93 Å²	93	87.8 Å²	87.8	56%	0.564	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	108.9	-176.7	-174.5	0	0	0	0	109.7	F477 A480	F477-V482 HydrophobicContact CB-CB 4.41Å; F477-V482 HydrophobicContact CD1-CG2 4.45Å; F477-V482 WeakPolarHBondContact O-CB 3.47Å; F477-V482 PolarHBondContact O-N 2.9Å; A480-V482 VanDerWaalsContact C-N 3.26Å; A480-V482 HydrophobicContact CB-CG2 4.33Å; A480-V482 PolarHBondContact O-N 3.1Å
483	G	64	Low	69.9	Low	82 Å²	82	94.6 Å²	94.6	85%	0.845	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.6	2.8	178	0	0	0	0	0	115.6	G481	G481-G483 PolarHBondContact O-N 3.49Å
484	S	59.2	Low	69.4	Low	66 Å²	66	95.6 Å²	95.6	46%	0.462	58%	0.583	S	S	.	*			trans	-88.7	127.5	175.6	-62.9	0	0	0	0	111.7
485	S	57.8	Low	69.1	Low	105 Å²	105	90.8 Å²	90.8	73%	0.734	56%	0.558	S	S	*	*			trans	-67.5	136.2	171	-64.1	0	0	0	0	110.8	G487	S485-G487 PolarHBondContact O-N 3.17Å
486	P	53.2	Low	69	Low	143 Å²	143	95.3 Å²	95.3	93%	0.929	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	97.6	-175.8	28.8	-34.7	0	0	0	111.6
487	G	56.3	Low	68.9	Low	71 Å²	71	95.3 Å²	95.3	73%	0.732	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	168	-22.8	172.4	0	0	0	0	0	116.7	S485 Q489	S485-G487 PolarHBondContact O-N 3.17Å; G487-Q489 PolarHBondContact O-N 3.18Å
488	D	54.8	Low	68.8	Low	122 Å²	122	92.8 Å²	92.8	65%	0.652	58%	0.576	S	S	*	*			trans	-93.7	92	-169.4	-165.2	-4.2	0	0	0	113.7	S490 G491	D488-S490 PolarHBondContact O-N 3.48Å; D488-S490 WeakPolarHBondContact OD1-CB 3.47Å; D488-S490 PolarHBondContact OD1-N 2.98Å; D488-G491 PolarHBondContact O-N 3.41Å
489	Q	54.8	Low	68.9	Low	191 Å²	191	89.3 Å²	89.3	89%	0.893	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-0.3	177.3	-62.4	-179.7	19.6	0	0	113.6	G487 G491	G487-Q489 PolarHBondContact O-N 3.18Å; Q489-G491 VanDerWaalsContact C-N 3.26Å
490	S	54	Low	69.2	Low	91 Å²	91	93 Å²	93	64%	0.636	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-10.6	170.2	-157.7	0	0	0	0	112.7	D488	D488-S490 PolarHBondContact O-N 3.48Å; D488-S490 WeakPolarHBondContact OD1-CB 3.47Å; D488-S490 PolarHBondContact OD1-N 2.98Å
491	G	60.5	Low	69.4	Low	19 Å²	19	95.8 Å²	95.8	20%	0.196	57%	0.566	C	S	.	*	H	α-helix	trans	-67.1	-42.7	-171	0	0	0	0	0	115.6	D488 Q489 E493 N494 I495	D488-G491 PolarHBondContact O-N 3.41Å; Q489-G491 VanDerWaalsContact C-N 3.26Å; G491-E493 PolarHBondContact O-N 2.83Å; G491-N494 WeakPolarHBondContact O-CB 3.15Å; G491-N494 PolarHBondContact O-N 2.96Å; G491-N494 VanDerWaalsContact O-N 3.13Å; G491-I495 VanDerWaalsContact O-CG1 3.27Å; G491-I495 WeakPolarHBondContact O-CG1 3.34Å; G491-I495 PolarHBondContact O-N 3.26Å
492	D	62.7	Low	70.2	Confident	116 Å²	116	93.9 Å²	93.9	62%	0.62	55%	0.545	S	S	*	.	H	α-helix	trans	-71.6	-36.9	-159.8	-69.1	-12.8	0	0	0	114.4	N494 I495 T496	D492-N494 VanDerWaalsContact C-N 3.33Å; D492-I495 PolarHBondContact O-N 3.37Å; D492-T496 WeakPolarHBondContact O-CB 3.43Å; D492-T496 PolarHBondContact O-N 3.13Å; D492-T496 PolarHBondContact O-OG1 2.68Å
493	E	62.5	Low	71.2	Confident	173 Å²	173	94.5 Å²	94.5	81%	0.808	54%	0.542	S	S	*	.	H	α-helix	trans	-65.1	-39.7	172.1	-68.2	-163.2	151	0	0	111.2	G491 T496 Q497	G491-E493 PolarHBondContact O-N 2.83Å; E493-T496 PolarHBondContact O-N 2.88Å; E493-Q497 VanDerWaalsContact O-CB 3.29Å; E493-Q497 WeakPolarHBondContact O-CB 3.47Å; E493-Q497 PolarHBondContact O-N 2.93Å
494	N	79.6	Confident	72.5	Confident	90 Å²	90	94.5 Å²	94.5	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-41.3	178.5	-168.1	0.3	0	0	0	111.3	G491 D492 Q497 M498	G491-N494 WeakPolarHBondContact O-CB 3.15Å; G491-N494 PolarHBondContact O-N 2.96Å; G491-N494 VanDerWaalsContact O-N 3.13Å; D492-N494 VanDerWaalsContact C-N 3.33Å; N494-Q497 PolarHBondContact O-N 2.93Å; N494-M498 WeakPolarHBondContact O-CB 3.34Å; N494-M498 PolarHBondContact O-N 2.84Å
495	I	81.2	Confident	74	Confident	16 Å²	16	94.8 Å²	94.8	8%	0.082	52%	0.524	C	S	.	.	H	α-helix	trans	-62.6	-45.4	173.3	-68.2	163.7	0	0	0	110.8	R478 A479 G491 D492 Q497 M498 L499	R478-I495 HydrophobicContact CG-CD1 3.87Å; R478-I495 HydrophobicContact CG-CG1 3.87Å; A479-I495 HydrophobicContact CB-CG2 3.71Å; G491-I495 VanDerWaalsContact O-CG1 3.27Å; G491-I495 WeakPolarHBondContact O-CG1 3.34Å; G491-I495 PolarHBondContact O-N 3.26Å; D492-I495 PolarHBondContact O-N 3.37Å; I495-Q497 PolarHBondContact O-N 3.18Å; I495-M498 WeakPolarHBondContact O-CB 3.26Å; I495-M498 PolarHBondContact O-N 2.74Å; I495-L499 HydrophobicContact CG2-CD1 4.4Å; I495-L499 PolarHBondContact O-N 3.48Å
496	T	83.3	Confident	75.7	Confident	96 Å²	96	92.3 Å²	92.3	59%	0.589	50%	0.498	S	S	*	.	H	α-helix	trans	-62.9	-42.6	177.9	-56.9	0	0	0	0	111.2	D492 E493 M498 K500	D492-T496 WeakPolarHBondContact O-CB 3.43Å; D492-T496 PolarHBondContact O-N 3.13Å; D492-T496 PolarHBondContact O-OG1 2.68Å; E493-T496 PolarHBondContact O-N 2.88Å; T496-M498 VanDerWaalsContact C-N 3.35Å; T496-K500 WeakPolarHBondContact O-CB 3.26Å; T496-K500 PolarHBondContact O-N 3.18Å
497	Q	84.6	Confident	77.5	Confident	107 Å²	107	89.5 Å²	89.5	50%	0.5	47%	0.471	S	S	.	.	H	α-helix	trans	-69.8	-30.9	176.8	-156.5	-171.5	68	0	0	112.4	E493 N494 I495 R501	E493-Q497 VanDerWaalsContact O-CB 3.29Å; E493-Q497 WeakPolarHBondContact O-CB 3.47Å; E493-Q497 PolarHBondContact O-N 2.93Å; N494-Q497 PolarHBondContact O-N 2.93Å; I495-Q497 PolarHBondContact O-N 3.18Å; Q497-R501 WeakPolarHBondContact O-CG 3.35Å; Q497-R501 PolarHBondContact O-N 3.19Å
498	M	84	Confident	79.2	Confident	65 Å²	65	90.6 Å²	90.6	32%	0.32	46%	0.464	S	S	.	.	H	α-helix	trans	-69.5	-47.5	173.8	-179.9	173.3	-67.2	0	0	111.8	N494 I495 T496 K500 R501 A502	N494-M498 WeakPolarHBondContact O-CB 3.34Å; N494-M498 PolarHBondContact O-N 2.84Å; I495-M498 WeakPolarHBondContact O-CB 3.26Å; I495-M498 PolarHBondContact O-N 2.74Å; T496-M498 VanDerWaalsContact C-N 3.35Å; M498-K500 VanDerWaalsContact C-N 3.32Å; M498-K500 PolarHBondContact O-N 2.9Å; M498-R501 PolarHBondContact O-N 2.86Å; M498-A502 PolarHBondContact O-N 3.41Å
499	L	86.2	Confident	81.1	Confident	47 Å²	47	85.2 Å²	85.2	25%	0.246	44%	0.437	C	S	.	.	H	α-helix	trans	-59.3	-43	173.7	-87.4	170.5	0	0	0	111.8	Q476 A479 I495 A502 H503	Q476-L499 HydrophobicContact CG-CD2 4.08Å; A479-L499 HydrophobicContact CB-CD1 3.8Å; I495-L499 HydrophobicContact CG2-CD1 4.4Å; I495-L499 PolarHBondContact O-N 3.48Å; L499-A502 PolarHBondContact O-N 3.42Å; L499-H503 WeakPolarHBondContact O-CB 3.44Å; L499-H503 PolarHBondContact O-N 2.77Å
500	K	89	Confident	82.9	Confident	137 Å²	137	77.4 Å²	77.4	60%	0.596	40%	0.4	S	S	*	.	H	α-helix	trans	-60.1	-49.1	175.3	-177.6	169.6	-179.3	178.3	0	111.8	T496 M498 A502 H503 D504	T496-K500 WeakPolarHBondContact O-CB 3.26Å; T496-K500 PolarHBondContact O-N 3.18Å; M498-K500 VanDerWaalsContact C-N 3.32Å; M498-K500 PolarHBondContact O-N 2.9Å; K500-A502 VanDerWaalsContact C-N 3.34Å; K500-A502 PolarHBondContact O-N 3.12Å; K500-H503 PolarHBondContact O-N 3.39Å; K500-D504 WeakPolarHBondContact CE-OD2 3.45Å; K500-D504 WeakPolarHBondContact CG-OD2 3.16Å; K500-D504 WeakPolarHBondContact O-CB 3.45Å; K500-D504 VanDerWaalsContact O-CG 3.26Å; K500-D504 PolarHBondContact O-N 3.44Å
501	R	88.5	Confident	84.7	Confident	133 Å²	133	76.9 Å²	76.9	50%	0.502	39%	0.39	S	S	.	.	H	α-helix	trans	-57.1	-44.8	175	-74.8	-179	-172.2	99.3	-3.4	112.2	Q497 M498 H503 D504 C505	Q497-R501 WeakPolarHBondContact O-CG 3.35Å; Q497-R501 PolarHBondContact O-N 3.19Å; M498-R501 PolarHBondContact O-N 2.86Å; R501-H503 VanDerWaalsContact C-N 3.35Å; R501-H503 PolarHBondContact O-N 2.93Å; R501-D504 PolarHBondContact O-N 3.26Å; R501-C505 WeakPolarHBondContact O-CB 3.47Å; R501-C505 PolarHBondContact O-N 2.84Å; R501-C505 PolarHBondContact O-SG 2.83Å
502	A	89.6	Confident	86.3	Confident	8 Å²	8	77.9 Å²	77.9	7%	0.066	40%	0.397	C	S	.	.	H	α-helix	trans	-62.1	-41.7	179.3	0	0	0	0	0	112.2	L472 M498 L499 K500 R506	L472-A502 HydrophobicContact CB-CB 4.24Å; M498-A502 PolarHBondContact O-N 3.41Å; L499-A502 PolarHBondContact O-N 3.42Å; K500-A502 VanDerWaalsContact C-N 3.34Å; K500-A502 PolarHBondContact O-N 3.12Å; A502-R506 WeakPolarHBondContact O-CB 3.45Å; A502-R506 PolarHBondContact O-N 2.66Å
503	H	90.1	Very high	87.7	Confident	107 Å²	107	72.4 Å²	72.4	50%	0.495	37%	0.367	S	S	.	.	H	α-helix	trans	-67	-43.7	175.4	-175.7	-75.9	0	0	0	112.6	L499 K500 R501 R506 K507	L499-H503 WeakPolarHBondContact O-CB 3.44Å; L499-H503 PolarHBondContact O-N 2.77Å; K500-H503 PolarHBondContact O-N 3.39Å; R501-H503 VanDerWaalsContact C-N 3.35Å; R501-H503 PolarHBondContact O-N 2.93Å; H503-R506 PolarHBondContact O-N 3.06Å; H503-K507 PolarHBondContact O-N 3.23Å
504	D	90.6	Very high	89.1	Confident	81 Å²	81	66.1 Å²	66.1	43%	0.433	34%	0.338	S	S	.	.	H	α-helix	trans	-63.6	-44.6	177.7	-68.5	-22.5	0	0	0	110.7	K500 R501 K507 T508	K500-D504 WeakPolarHBondContact CE-OD2 3.45Å; K500-D504 WeakPolarHBondContact CG-OD2 3.16Å; K500-D504 WeakPolarHBondContact O-CB 3.45Å; K500-D504 VanDerWaalsContact O-CG 3.26Å; K500-D504 PolarHBondContact O-N 3.44Å; R501-D504 PolarHBondContact O-N 3.26Å; D504-K507 PolarHBondContact O-N 3.39Å; D504-T508 PolarHBondContact O-N 2.86Å; D504-T508 PolarHBondContact O-OG1 2.83Å
505	C	90.7	Very high	89.6	Confident	72 Å²	72	64.3 Å²	64.3	49%	0.486	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-45.3	173	-70.1	0	0	0	0	112.2	R501 K507 T508 A509	R501-C505 WeakPolarHBondContact O-CB 3.47Å; R501-C505 PolarHBondContact O-N 2.84Å; R501-C505 PolarHBondContact O-SG 2.83Å; C505-K507 PolarHBondContact O-N 3.4Å; C505-T508 WeakPolarHBondContact CA-OG1 3.38Å; C505-T508 PolarHBondContact O-N 3.31Å; C505-T508 PolarHBondContact O-OG1 2.8Å; C505-A509 PolarHBondContact O-N 2.72Å
506	R	92.8	Very high	90.1	Very high	53 Å²	53	63.8 Å²	63.8	20%	0.2	33%	0.332	C	S	.	.	H	α-helix	trans	-59.1	-47.7	175.8	-176.8	168.3	175.7	132.4	5.8	111.3	S468 E469 A502 H503 T508 A509 E510	S468-R506 WeakPolarHBondContact OG-CB 3.37Å; S468-R506 WeakPolarHBondContact OG-CG 3.07Å; E469-R506 IonicContact OE1-CZ 3.83Å; E469-R506 IonicContact OE1-NH1 2.77Å; E469-R506 PolarHBondContact OE1-NH1 2.92Å; E469-R506 IonicContact OE1-NH2 3.03Å; A502-R506 WeakPolarHBondContact O-CB 3.45Å; A502-R506 PolarHBondContact O-N 2.66Å; H503-R506 PolarHBondContact O-N 3.06Å; R506-T508 VanDerWaalsContact C-N 3.27Å; R506-T508 PolarHBondContact O-N 3.44Å; R506-A509 PolarHBondContact O-N 2.87Å; R506-A509 VanDerWaalsContact O-N 3.13Å; R506-E510 HydrophobicContact CG-CG 4.2Å; R506-E510 WeakPolarHBondContact CG-OE1 3.32Å; R506-E510 IonicContact CZ-OE1 3.9Å; R506-E510 IonicContact NE-OE1 2.77Å; R506-E510 PolarHBondContact NE-OE1 3.37Å; R506-E510 IonicContact NH2-OE1 2.88Å; R506-E510 PolarHBondContact NH2-OE1 2.97Å; R506-E510 WeakPolarHBondContact O-CB 3.46Å; R506-E510 WeakPolarHBondContact O-CG 3.42Å; R506-E510 PolarHBondContact O-N 2.91Å
507	K	91.4	Very high	90.4	Very high	84 Å²	84	59.5 Å²	59.5	37%	0.365	31%	0.306	S	S	.	.	H	α-helix	trans	-61.8	-32.8	177.5	-169.6	153.6	-171.3	152.1	0	112.2	H503 D504 C505 N511 D558	H503-K507 PolarHBondContact O-N 3.23Å; D504-K507 PolarHBondContact O-N 3.39Å; C505-K507 PolarHBondContact O-N 3.4Å; K507-N511 VanDerWaalsContact O-CB 3.31Å; K507-N511 WeakPolarHBondContact O-CB 3.34Å; K507-N511 PolarHBondContact O-N 3.04Å; K507-N511 PolarHBondContact O-ND2 3.25Å; K507-D558 IonicContact NZ-OD1 2.87Å; K507-D558 PolarHBondContact NZ-OD1 2.85Å; K507-D558 IonicContact NZ-OD2 3.77Å
508	T	92.8	Very high	90.5	Very high	94 Å²	94	60.3 Å²	60.3	58%	0.577	31%	0.311	S	S	*	.	H	α-helix	trans	-68.2	-42.6	171.8	51.6	0	0	0	0	113.5	D504 C505 R506 N511 A512	D504-T508 PolarHBondContact O-N 2.86Å; D504-T508 PolarHBondContact O-OG1 2.83Å; C505-T508 WeakPolarHBondContact CA-OG1 3.38Å; C505-T508 PolarHBondContact O-N 3.31Å; C505-T508 PolarHBondContact O-OG1 2.8Å; R506-T508 VanDerWaalsContact C-N 3.27Å; R506-T508 PolarHBondContact O-N 3.44Å; T508-N511 PolarHBondContact O-N 3.27Å; T508-A512 WeakPolarHBondContact O-CB 3.43Å; T508-A512 PolarHBondContact O-N 2.99Å
509	A	93.8	Very high	90.6	Very high	9 Å²	9	63.2 Å²	63.2	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-43.8	177.1	0	0	0	0	0	111.9	A464 L465 C505 R506 N511 A512 A513	A464-A509 HydrophobicContact CB-CB 4.12Å; L465-A509 HydrophobicContact CD2-CB 3.94Å; L465-A509 HydrophobicContact CG-CB 4.13Å; C505-A509 PolarHBondContact O-N 2.72Å; R506-A509 PolarHBondContact O-N 2.87Å; R506-A509 VanDerWaalsContact O-N 3.13Å; A509-N511 PolarHBondContact O-N 3.02Å; A509-A512 PolarHBondContact O-N 3.45Å; A509-A513 WeakPolarHBondContact O-CB 3.5Å; A509-A513 PolarHBondContact O-N 3.4Å
510	E	93.3	Very high	90.3	Very high	27 Å²	27	63.3 Å²	63.3	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-42.4	175.1	-72.5	-173.7	-169	0	0	112.6	L465 R506 K514 F561	L465-E510 HydrophobicContact CD2-CB 4.44Å; L465-E510 HydrophobicContact CD2-CG 3.65Å; R506-E510 HydrophobicContact CG-CG 4.2Å; R506-E510 WeakPolarHBondContact CG-OE1 3.32Å; R506-E510 IonicContact CZ-OE1 3.9Å; R506-E510 IonicContact NE-OE1 2.77Å; R506-E510 PolarHBondContact NE-OE1 3.37Å; R506-E510 IonicContact NH2-OE1 2.88Å; R506-E510 PolarHBondContact NH2-OE1 2.97Å; R506-E510 WeakPolarHBondContact O-CB 3.46Å; R506-E510 WeakPolarHBondContact O-CG 3.42Å; R506-E510 PolarHBondContact O-N 2.91Å; E510-K514 WeakPolarHBondContact O-CB 3.3Å; E510-K514 WeakPolarHBondContact O-CD 3.36Å; E510-K514 WeakPolarHBondContact O-CG 3.34Å; E510-K514 PolarHBondContact O-N 3.06Å; E510-K514 IonicContact OE2-NZ 2.69Å; E510-F561 HydrophobicContact CB-CB 3.84Å; E510-F561 HydrophobicContact CB-CG 4.24Å; E510-F561 HydrophobicContact CG-CB 3.43Å; E510-F561 VanDerWaalsContact CG-CB 3.43Å; E510-F561 HydrophobicContact CG-CD1 4.19Å; E510-F561 HydrophobicContact CG-CG 3.85Å; E510-F561 VanDerWaalsContact OE2-CB 3.28Å; E510-F561 WeakPolarHBondContact OE2-CB 3.36Å
511	N	91.8	Very high	89.8	Confident	80 Å²	80	60.8 Å²	60.8	43%	0.428	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-38.6	177.2	-74.1	-14.3	0	0	0	112.1	K507 T508 A509 A515	K507-N511 VanDerWaalsContact O-CB 3.31Å; K507-N511 WeakPolarHBondContact O-CB 3.34Å; K507-N511 PolarHBondContact O-N 3.04Å; K507-N511 PolarHBondContact O-ND2 3.25Å; T508-N511 PolarHBondContact O-N 3.27Å; A509-N511 PolarHBondContact O-N 3.02Å; N511-A515 WeakPolarHBondContact O-CB 3.15Å; N511-A515 PolarHBondContact O-N 3.34Å
512	A	93.6	Very high	88.8	Confident	41 Å²	41	57.2 Å²	57.2	34%	0.339	32%	0.32	S	S	.	.	H	α-helix	trans	-69.7	-40.5	176.8	0	0	0	0	0	112.2	L461 T508 A509 A515 L516	L461-A512 HydrophobicContact CD2-CB 3.49Å; L461-A512 VanDerWaalsContact CD2-CB 3.49Å; T508-A512 WeakPolarHBondContact O-CB 3.43Å; T508-A512 PolarHBondContact O-N 2.99Å; A509-A512 PolarHBondContact O-N 3.45Å; A512-A515 PolarHBondContact O-N 2.95Å; A512-L516 PolarHBondContact O-N 3.47Å
513	A	93.4	Very high	87.4	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.5	-44.3	172.1	0	0	0	0	0	112.1	L465 A509 A515 L516 L517 F561	L465-A513 HydrophobicContact CD1-CB 4.08Å; A509-A513 WeakPolarHBondContact O-CB 3.5Å; A509-A513 PolarHBondContact O-N 3.4Å; A513-A515 PolarHBondContact O-N 2.83Å; A513-L516 PolarHBondContact O-N 3.21Å; A513-L517 WeakPolarHBondContact O-CG 3.39Å; A513-L517 PolarHBondContact O-N 3.17Å; A513-F561 HydrophobicContact CB-CD2 4.45Å; A513-F561 HydrophobicContact CB-CE2 3.66Å; A513-F561 HydrophobicContact CB-CZ 4.06Å
514	K	90.6	Very high	85.4	Confident	42 Å²	42	60.2 Å²	60.2	18%	0.183	35%	0.351	C	S	.	.	H	α-helix	trans	-60.1	-43	172.8	-72.5	166.5	-168.9	171.8	0	111.7	E510 L516 L517 M518 T559 F561	E510-K514 WeakPolarHBondContact O-CB 3.3Å; E510-K514 WeakPolarHBondContact O-CD 3.36Å; E510-K514 WeakPolarHBondContact O-CG 3.34Å; E510-K514 PolarHBondContact O-N 3.06Å; E510-K514 IonicContact OE2-NZ 2.69Å; K514-L516 PolarHBondContact O-N 3.48Å; K514-L517 PolarHBondContact O-N 2.99Å; K514-M518 VanDerWaalsContact O-CG 3.23Å; K514-M518 WeakPolarHBondContact O-CG 3.45Å; K514-M518 PolarHBondContact O-N 3.31Å; K514-T559 PolarHBondContact NZ-O 2.83Å; K514-F561 HydrophobicContact CG-CD2 4.11Å
515	A	90.9	Very high	83	Confident	52 Å²	52	59.8 Å²	59.8	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-40.3	176.9	0	0	0	0	0	112.4	N511 A512 A513 M518 K519	N511-A515 WeakPolarHBondContact O-CB 3.15Å; N511-A515 PolarHBondContact O-N 3.34Å; A512-A515 PolarHBondContact O-N 2.95Å; A513-A515 PolarHBondContact O-N 2.83Å; A515-M518 PolarHBondContact O-N 3.05Å; A515-K519 WeakPolarHBondContact O-CG 3.32Å; A515-K519 PolarHBondContact O-N 3.11Å
516	L	91.2	Very high	80.6	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-68.1	-39.9	175.5	179	139.5	0	0	0	112.5	E457 L461 A512 A513 K514 K519 L520 L569 Y572	E457-L516 HydrophobicContact CB-CD1 4.36Å; E457-L516 HydrophobicContact CG-CD1 3.73Å; L461-L516 HydrophobicContact CD1-CB 4.01Å; L461-L516 HydrophobicContact CD1-CD1 3.92Å; L461-L516 HydrophobicContact CD1-CG 4.45Å; A512-L516 PolarHBondContact O-N 3.47Å; A513-L516 PolarHBondContact O-N 3.21Å; K514-L516 PolarHBondContact O-N 3.48Å; L516-K519 WeakPolarHBondContact O-CB 3.27Å; L516-K519 PolarHBondContact O-N 3.23Å; L516-L520 PolarHBondContact O-N 3.09Å; L516-L520 VanDerWaalsContact O-N 3.1Å; L516-L569 HydrophobicContact CD2-CD1 3.58Å; L516-Y572 HydrophobicContact CD2-CD1 3.88Å; L516-Y572 HydrophobicContact CD2-CE1 3.83Å; L516-Y572 HydrophobicContact CG-CE1 4.47Å
517	L	89.4	Confident	78	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.031	39%	0.392	C	S	.	.	H	α-helix	trans	-64.7	-38.8	173.4	-69.3	172.3	0	0	0	112	A513 K514 K519 L520 D521 D565 R568	A513-L517 WeakPolarHBondContact O-CG 3.39Å; A513-L517 PolarHBondContact O-N 3.17Å; K514-L517 PolarHBondContact O-N 2.99Å; L517-K519 VanDerWaalsContact C-N 3.35Å; L517-K519 PolarHBondContact O-N 3.16Å; L517-L520 HydrophobicContact CD2-CD2 4.48Å; L517-L520 WeakPolarHBondContact O-CB 3.4Å; L517-L520 PolarHBondContact O-N 2.89Å; L517-L520 VanDerWaalsContact O-N 3.1Å; L517-D521 PolarHBondContact O-N 2.76Å; L517-D565 HydrophobicContact CD1-CB 3.97Å; L517-R568 HydrophobicContact CD2-CB 4.11Å
518	M	86.3	Confident	75.3	Confident	124 Å²	124	66.3 Å²	66.3	61%	0.611	42%	0.419	S	S	*	.	H	α-helix	trans	-64.9	-34.3	173.6	-67.6	-72.3	102.2	0	0	112.8	K514 A515 L520 D521 G522	K514-M518 VanDerWaalsContact O-CG 3.23Å; K514-M518 WeakPolarHBondContact O-CG 3.45Å; K514-M518 PolarHBondContact O-N 3.31Å; A515-M518 PolarHBondContact O-N 3.05Å; M518-L520 VanDerWaalsContact C-N 3.33Å; M518-D521 VanDerWaalsContact CE-OD2 3.32Å; M518-D521 WeakPolarHBondContact CE-OD2 3.39Å; M518-G522 PolarHBondContact O-N 2.61Å; M518-G522 VanDerWaalsContact O-N 3.1Å
519	K	86.3	Confident	72.5	Confident	125 Å²	125	65.9 Å²	65.9	54%	0.543	43%	0.425	S	S	.	.	H	α-helix	trans	-61.1	-42.5	169.6	-65.7	172	-168.7	173.3	0	110.9	E457 A515 L516 L517 S523	E457-K519 IonicContact OE1-NZ 3Å; E457-K519 PolarHBondContact OE1-NZ 3.16Å; A515-K519 WeakPolarHBondContact O-CG 3.32Å; A515-K519 PolarHBondContact O-N 3.11Å; L516-K519 WeakPolarHBondContact O-CB 3.27Å; L516-K519 PolarHBondContact O-N 3.23Å; L517-K519 VanDerWaalsContact C-N 3.35Å; L517-K519 PolarHBondContact O-N 3.16Å; K519-S523 WeakPolarHBondContact O-CB 3.35Å; K519-S523 PolarHBondContact O-N 3.14Å
520	L	79.9	Confident	69.5	Low	49 Å²	49	72.2 Å²	72.2	26%	0.257	46%	0.462	S	S	.	.	H	α-helix	trans	-65.3	-49	179.5	175.4	61.6	0	0	0	111.9	L516 L517 M518 G522 S523 C524 Y572	L516-L520 PolarHBondContact O-N 3.09Å; L516-L520 VanDerWaalsContact O-N 3.1Å; L517-L520 HydrophobicContact CD2-CD2 4.48Å; L517-L520 WeakPolarHBondContact O-CB 3.4Å; L517-L520 PolarHBondContact O-N 2.89Å; L517-L520 VanDerWaalsContact O-N 3.1Å; M518-L520 VanDerWaalsContact C-N 3.33Å; L520-G522 VanDerWaalsContact C-N 3.3Å; L520-G522 PolarHBondContact O-N 3.3Å; L520-S523 WeakPolarHBondContact O-CB 3.22Å; L520-S523 PolarHBondContact O-N 3.08Å; L520-S523 VanDerWaalsContact O-N 3.14Å; L520-C524 WeakPolarHBondContact O-CB 3.44Å; L520-C524 PolarHBondContact O-N 2.68Å; L520-Y572 HydrophobicContact CD1-CD2 3.65Å; L520-Y572 HydrophobicContact CD1-CE2 3.61Å; L520-Y572 HydrophobicContact CD2-CD1 4.48Å; L520-Y572 HydrophobicContact CD2-CD2 3.55Å; L520-Y572 HydrophobicContact CD2-CE2 4.23Å; L520-Y572 HydrophobicContact CD2-CG 3.69Å; L520-Y572 HydrophobicContact CG-CD2 4.17Å; L520-Y572 HydrophobicContact CG-CE2 4.41Å
521	D	78.3	Confident	67.1	Low	84 Å²	84	75.8 Å²	75.8	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-60	-41.2	178.5	-69.8	-30.2	0	0	0	111.3	L517 M518 C524 G525	L517-D521 PolarHBondContact O-N 2.76Å; M518-D521 VanDerWaalsContact CE-OD2 3.32Å; M518-D521 WeakPolarHBondContact CE-OD2 3.39Å; D521-C524 PolarHBondContact O-N 2.93Å; D521-G525 PolarHBondContact O-N 2.95Å
522	G	68.9	Low	64.2	Low	58 Å²	58	75.9 Å²	75.9	60%	0.598	52%	0.516	S	S	*	.	H	α-helix	trans	-64.7	-38.6	173.9	0	0	0	0	0	113.8	M518 L520	M518-G522 PolarHBondContact O-N 2.61Å; M518-G522 VanDerWaalsContact O-N 3.1Å; L520-G522 VanDerWaalsContact C-N 3.3Å; L520-G522 PolarHBondContact O-N 3.3Å
523	S	59.8	Low	61.2	Low	87 Å²	87	79.6 Å²	79.6	61%	0.608	54%	0.538	S	S	*	.	H	α-helix	trans	-66.6	-42.7	175.4	-171.4	0	0	0	0	111.9	K519 L520 G525 G526	K519-S523 WeakPolarHBondContact O-CB 3.35Å; K519-S523 PolarHBondContact O-N 3.14Å; L520-S523 WeakPolarHBondContact O-CB 3.22Å; L520-S523 PolarHBondContact O-N 3.08Å; L520-S523 VanDerWaalsContact O-N 3.14Å; S523-G525 PolarHBondContact O-N 3.41Å; S523-G526 PolarHBondContact O-N 3.27Å; S523-G526 VanDerWaalsContact O-N 3.07Å
524	C	47.6	Very low	58.4	Low	91 Å²	91	84.3 Å²	84.3	62%	0.615	57%	0.571	S	S	*	*	H	α-helix	trans	-60.8	-32.4	-179	-160.3	0	0	0	0	112.5	L520 D521 G526 A527	L520-C524 WeakPolarHBondContact O-CB 3.44Å; L520-C524 PolarHBondContact O-N 2.68Å; D521-C524 PolarHBondContact O-N 2.93Å; C524-G526 PolarHBondContact O-N 3.31Å; C524-A527 PolarHBondContact O-N 3.1Å
525	G	41.1	Very low	56	Low	73 Å²	73	88 Å²	88	75%	0.753	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-19.3	175.5	0	0	0	0	0	115.6	D521 S523	D521-G525 PolarHBondContact O-N 2.95Å; S523-G525 PolarHBondContact O-N 3.41Å
526	G	40.4	Very low	53.3	Low	50 Å²	50	90.9 Å²	90.9	52%	0.515	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-16.5	179.7	0	0	0	0	0	115.1	S523 C524 F528 A529	S523-G526 PolarHBondContact O-N 3.27Å; S523-G526 VanDerWaalsContact O-N 3.07Å; C524-G526 PolarHBondContact O-N 3.31Å; G526-F528 PolarHBondContact O-N 2.77Å; G526-A529 PolarHBondContact O-N 3.37Å
527	A	38.4	Very low	50.8	Low	85 Å²	85	95.9 Å²	95.9	70%	0.702	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	3.2	-161.2	0	0	0	0	0	116.7	C524	C524-A527 PolarHBondContact O-N 3.1Å
528	F	34.5	Very low	48.8	Very low	211 Å²	211	104.5 Å²	104.5	93%	0.925	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	4.4	178.9	-127.6	-89.6	0	0	0	114.6	G526	G526-F528 PolarHBondContact O-N 2.77Å
529	A	34	Very low	46.5	Very low	85 Å²	85	104.2 Å²	104.2	70%	0.702	66%	0.663	S	S	*	*	S	Bend	trans	-76.7	132.4	168.2	0	0	0	0	0	110.5	G526 A531	G526-A529 PolarHBondContact O-N 3.37Å; A529-A531 PolarHBondContact O-N 3.3Å
530	V	30.1	Very low	44.3	Very low	141 Å²	141	103 Å²	103	86%	0.855	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-57.6	129.1	-175.3	174.9	0	0	0	0	111.5	G532	V530-G532 PolarHBondContact O-N 3.21Å
531	A	41.8	Very low	42.3	Very low	103 Å²	103	107 Å²	107	85%	0.851	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	122.8	176.8	0	0	0	0	0	111.4	A529	A529-A531 PolarHBondContact O-N 3.3Å
532	G	31.7	Very low	40.5	Very low	81 Å²	81	107.4 Å²	107.4	84%	0.835	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.3	-23.7	178.5	0	0	0	0	0	116.1	V530	V530-G532 PolarHBondContact O-N 3.21Å
533	C	30.1	Very low	39.1	Very low	120 Å²	120	109.6 Å²	109.6	81%	0.811	71%	0.707	S	S	*	*			trans	-107	124.5	178.3	-151.3	0	0	0	0	111.5
534	S	34.4	Very low	38.2	Very low	98 Å²	98	111.2 Å²	111.2	69%	0.685	71%	0.709	S	S	*	*			trans	-77.3	118.6	170.7	-176.7	0	0	0	0	109.2	Q536	S534-Q536 PolarHBondContact O-N 3.37Å; S534-Q536 VanDerWaalsContact O-N 3.1Å
535	V	40.4	Very low	37.6	Very low	119 Å²	119	112 Å²	112	72%	0.721	72%	0.715	S	S	*	*			trans	-64	108	171.9	175.1	0	0	0	0	107.7
536	Q	35.8	Very low	37.5	Very low	114 Å²	114	115.9 Å²	115.9	53%	0.533	71%	0.714	S	S	.	*			trans	-80.8	143.7	-177.6	-70.5	-150.9	-8.6	0	0	111.3	S534 W538 E539	S534-Q536 PolarHBondContact O-N 3.37Å; S534-Q536 VanDerWaalsContact O-N 3.1Å; Q536-W538 PolarHBondContact O-N 3.02Å; Q536-E539 PolarHBondContact O-N 3.17Å
537	P	38.7	Very low	37.1	Very low	110 Å²	110	119.6 Å²	119.6	71%	0.714	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-17.6	-176.6	-28.6	35.9	0	0	0	116.2
538	W	45.5	Very low	37.3	Very low	187 Å²	187	121.1 Å²	121.1	71%	0.708	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-20.4	-175.9	-50.9	106.5	0	0	0	114.3	Q536 S540 L541	Q536-W538 PolarHBondContact O-N 3.02Å; W538-S540 PolarHBondContact O-N 2.7Å; W538-L541 HydrophobicContact CE3-CD1 4.18Å; W538-L541 PolarHBondContact O-N 3.15Å; W538-L541 VanDerWaalsContact O-N 3.14Å
539	E	38.4	Very low	37.4	Very low	117 Å²	117	117.4 Å²	117.4	55%	0.547	73%	0.727	S	S	.	*	G	3₁₀ helix	trans	-62.7	-31.4	-175.3	-65	-173.6	139.3	0	0	112.3	Q536 L541 S542	Q536-E539 PolarHBondContact O-N 3.17Å; E539-L541 PolarHBondContact O-N 2.91Å; E539-S542 WeakPolarHBondContact O-CB 3.42Å; E539-S542 PolarHBondContact O-N 3.45Å; E539-S542 VanDerWaalsContact O-N 3.1Å; E539-S542 PolarHBondContact O-OG 2.9Å
540	S	41.1	Very low	37.7	Very low	100 Å²	100	119.5 Å²	119.5	70%	0.699	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-56.4	-19.8	175.1	-55.7	0	0	0	0	115	W538	W538-S540 PolarHBondContact O-N 2.7Å
541	L	38.3	Very low	38.2	Very low	132 Å²	132	118.3 Å²	118.3	69%	0.691	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-85.1	-11.6	-179.6	-61.6	175.3	0	0	0	113.4	W538 E539	W538-L541 HydrophobicContact CE3-CD1 4.18Å; W538-L541 PolarHBondContact O-N 3.15Å; W538-L541 VanDerWaalsContact O-N 3.14Å; E539-L541 PolarHBondContact O-N 2.91Å
542	S	39.7	Very low	37.8	Very low	93 Å²	93	119.2 Å²	119.2	65%	0.65	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-21.7	-174.5	64.7	0	0	0	0	114.6	E539 N544	E539-S542 WeakPolarHBondContact O-CB 3.42Å; E539-S542 PolarHBondContact O-N 3.45Å; E539-S542 VanDerWaalsContact O-N 3.1Å; E539-S542 PolarHBondContact O-OG 2.9Å; S542-N544 VanDerWaalsContact C-N 3.26Å; S542-N544 PolarHBondContact O-N 2.86Å
543	S	39.4	Very low	38.1	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-6.2	-173.3	-58.6	0	0	0	0	115.3	S545	S543-S545 VanDerWaalsContact C-N 3.29Å; S543-S545 PolarHBondContact O-N 3.42Å
544	N	40.9	Very low	38.4	Very low	121 Å²	121	121.2 Å²	121.2	65%	0.647	73%	0.732	S	S	*	*			trans	-87.1	55.3	-172	-154	98.3	0	0	0	113.7	S542 H546	S542-N544 VanDerWaalsContact C-N 3.26Å; S542-N544 PolarHBondContact O-N 2.86Å; N544-H546 PolarHBondContact ND2-NE2 2.92Å
545	S	36	Very low	38.6	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	74%	0.735	S	S	*	*			trans	-110.7	107.2	171.8	-74.2	0	0	0	0	111.3	S543 T547	S543-S545 VanDerWaalsContact C-N 3.29Å; S543-S545 PolarHBondContact O-N 3.42Å; S545-T547 PolarHBondContact O-N 3.25Å
546	H	37.5	Very low	38.5	Very low	156 Å²	156	120.5 Å²	120.5	72%	0.722	73%	0.733	S	S	*	*			trans	-78.6	118.1	-179.5	-57.5	-81.8	0	0	0	112	N544	N544-H546 PolarHBondContact ND2-NE2 2.92Å
547	T	32.8	Very low	38.8	Very low	127 Å²	127	120.4 Å²	120.4	78%	0.779	74%	0.743	S	S	*	*			trans	-123.4	96.7	157.2	52.2	0	0	0	0	109.6	S545 T549	S545-T547 PolarHBondContact O-N 3.25Å; T547-T549 PolarHBondContact O-N 3.39Å; T547-T549 VanDerWaalsContact O-N 3.08Å
548	S	42	Very low	39	Very low	118 Å²	118	120.3 Å²	120.3	83%	0.825	74%	0.736	S	S	*	*			trans	-73.9	95.4	-178.2	-57.3	0	0	0	0	111.9
549	T	36.1	Very low	39.7	Very low	133 Å²	133	115.8 Å²	115.8	82%	0.816	73%	0.73	S	S	*	*			trans	-104.5	115.5	161.3	42.2	0	0	0	0	109.9	T547	T547-T549 PolarHBondContact O-N 3.39Å; T547-T549 VanDerWaalsContact O-N 3.08Å
550	T	41.5	Very low	41.3	Very low	129 Å²	129	118.1 Å²	118.1	79%	0.791	74%	0.741	S	S	*	*			trans	-74.5	161.5	172.7	44.6	0	0	0	0	111.2
551	S	39.2	Very low	43.4	Very low	116 Å²	116	114.3 Å²	114.3	81%	0.811	71%	0.711	S	S	*	*			trans	73.1	83.6	171.7	-51.7	0	0	0	0	116.6
552	S	35.1	Very low	45.7	Very low	122 Å²	122	110.6 Å²	110.6	85%	0.853	69%	0.694	S	S	*	*			trans	-144.2	137.3	137.1	-81.1	0	0	0	0	109.3	A554	S552-A554 PolarHBondContact O-N 3.44Å
553	T	38.1	Very low	48	Very low	141 Å²	141	113.4 Å²	113.4	87%	0.865	70%	0.695	S	S	*	*			trans	-76.6	92.5	-174.4	47.6	0	0	0	0	110.6	S555	T553-S555 PolarHBondContact O-N 2.77Å
554	A	35.8	Very low	50.5	Low	101 Å²	101	114.3 Å²	114.3	84%	0.835	69%	0.687	S	S	*	*			trans	-65.2	82.6	157.3	0	0	0	0	0	108.4	S552 S556	S552-A554 PolarHBondContact O-N 3.44Å; A554-S556 PolarHBondContact O-N 2.83Å
555	S	37.6	Very low	52.8	Low	107 Å²	107	109.6 Å²	109.6	75%	0.748	66%	0.662	S	S	*	*			trans	-52.4	124.5	167.6	-179.6	0	0	0	0	107.4	T553 C557	T553-S555 PolarHBondContact O-N 2.77Å; S555-C557 PolarHBondContact O-N 3.03Å
556	S	39.1	Very low	55.5	Low	96 Å²	96	107.1 Å²	107.1	67%	0.671	64%	0.639	S	S	*	*			trans	-57.1	116.7	179.5	49.3	0	0	0	0	109.3	A554 D558	A554-S556 PolarHBondContact O-N 2.83Å; S556-D558 PolarHBondContact O-N 3.27Å
557	C	41.6	Very low	58.2	Low	111 Å²	111	103.8 Å²	103.8	75%	0.75	62%	0.624	S	S	*	*			trans	-69.9	64.8	157.5	52.8	0	0	0	0	108.5	S555 T559	S555-C557 PolarHBondContact O-N 3.03Å; C557-T559 PolarHBondContact O-N 3.32Å; C557-T559 PolarHBondContact O-OG1 3.17Å
558	D	42.9	Very low	61.1	Low	108 Å²	108	102.8 Å²	102.8	58%	0.578	61%	0.606	S	S	*	*			trans	-76.2	44.9	165.1	-151.1	29.8	0	0	0	108	K507 S556 E560	K507-D558 IonicContact NZ-OD1 2.87Å; K507-D558 PolarHBondContact NZ-OD1 2.85Å; K507-D558 IonicContact NZ-OD2 3.77Å; S556-D558 PolarHBondContact O-N 3.27Å; D558-E560 PolarHBondContact O-N 2.99Å
559	T	60.2	Low	63.5	Low	92 Å²	92	97.1 Å²	97.1	56%	0.564	57%	0.566	S	S	*	*			trans	-65.6	114	166.3	42.3	0	0	0	0	106.5	K514 C557	K514-T559 PolarHBondContact NZ-O 2.83Å; C557-T559 PolarHBondContact O-N 3.32Å; C557-T559 PolarHBondContact O-OG1 3.17Å
560	E	73.1	Confident	66.4	Low	167 Å²	167	94.4 Å²	94.4	78%	0.78	54%	0.543	S	S	*	.			trans	-49.3	146	172.7	-59.5	-179.6	153.6	0	0	109.9	D558 T562	D558-E560 PolarHBondContact O-N 2.99Å; E560-T562 WeakPolarHBondContact O-CG2 3.24Å; E560-T562 PolarHBondContact O-N 3.37Å; E560-T562 VanDerWaalsContact O-N 3.14Å
561	F	84.2	Confident	68.9	Low	19 Å²	19	92.3 Å²	92.3	8%	0.083	53%	0.527	C	S	.	.			trans	-68.9	115.8	177.8	-176.4	-101.3	0	0	0	109.6	L465 E510 A513 K514 D565 E566	L465-F561 HydrophobicContact CD1-CD1 4.48Å; L465-F561 HydrophobicContact CD1-CE1 3.61Å; L465-F561 HydrophobicContact CD1-CE2 4.5Å; L465-F561 HydrophobicContact CD1-CZ 3.62Å; L465-F561 HydrophobicContact CD2-CD1 4.25Å; L465-F561 HydrophobicContact CD2-CE1 4.16Å; E510-F561 HydrophobicContact CB-CB 3.84Å; E510-F561 HydrophobicContact CB-CG 4.24Å; E510-F561 HydrophobicContact CG-CB 3.43Å; E510-F561 VanDerWaalsContact CG-CB 3.43Å; E510-F561 HydrophobicContact CG-CD1 4.19Å; E510-F561 HydrophobicContact CG-CG 3.85Å; E510-F561 VanDerWaalsContact OE2-CB 3.28Å; E510-F561 WeakPolarHBondContact OE2-CB 3.36Å; A513-F561 HydrophobicContact CB-CD2 4.45Å; A513-F561 HydrophobicContact CB-CE2 3.66Å; A513-F561 HydrophobicContact CB-CZ 4.06Å; K514-F561 HydrophobicContact CG-CD2 4.11Å; F561-D565 HydrophobicContact CD2-CB 3.72Å; F561-D565 HydrophobicContact CE2-CB 3.46Å; F561-D565 VanDerWaalsContact CE2-CB 3.46Å; F561-D565 HydrophobicContact CG-CB 4.38Å; F561-D565 HydrophobicContact CZ-CB 3.92Å; F561-E566 HydrophobicContact CE1-CB 3.77Å; F561-E566 HydrophobicContact CE1-CG 4.19Å; F561-E566 HydrophobicContact CZ-CB 4.14Å
562	T	88.1	Confident	71.5	Confident	54 Å²	54	88.3 Å²	88.3	33%	0.331	49%	0.494	S	S	.	.			trans	-88.1	161.1	-172	66.2	0	0	0	0	111.5	E560 E564 D565 E566	E560-T562 WeakPolarHBondContact O-CG2 3.24Å; E560-T562 PolarHBondContact O-N 3.37Å; E560-T562 VanDerWaalsContact O-N 3.14Å; T562-E564 WeakPolarHBondContact CB-OE2 3.15Å; T562-E564 PolarHBondContact O-N 2.93Å; T562-D565 WeakPolarHBondContact CB-OD2 3.37Å; T562-D565 PolarHBondContact N-OD2 3.26Å; T562-D565 WeakPolarHBondContact O-CB 3.29Å; T562-D565 PolarHBondContact O-N 2.93Å; T562-D565 PolarHBondContact OG1-N 3.5Å; T562-D565 PolarHBondContact OG1-OD2 2.96Å; T562-E566 PolarHBondContact O-N 2.89Å
563	K	88	Confident	74.4	Confident	153 Å²	153	82.8 Å²	82.8	67%	0.665	46%	0.455	S	S	*	.	H	α-helix	trans	-67.6	-21.4	172.9	-66.7	-168.2	173.5	-168.9	0	111.5	E566 Q567	K563-E566 PolarHBondContact O-N 3.22Å; K563-Q567 WeakPolarHBondContact O-CB 3.36Å; K563-Q567 PolarHBondContact O-N 3.16Å
564	E	90.1	Very high	77.2	Confident	123 Å²	123	80 Å²	80	58%	0.575	43%	0.432	S	S	*	.	H	α-helix	trans	-73.9	-27.1	172.4	-64	68.9	-160	0	0	112.2	T562 R568	T562-E564 WeakPolarHBondContact CB-OE2 3.15Å; T562-E564 PolarHBondContact O-N 2.93Å; E564-R568 WeakPolarHBondContact O-CG 3.46Å; E564-R568 PolarHBondContact O-N 3.05Å; E564-R568 PolarHBondContact O-NE 3.07Å; E564-R568 PolarHBondContact O-NH2 3.1Å
565	D	90.6	Very high	80	Confident	22 Å²	22	79.7 Å²	79.7	12%	0.118	41%	0.414	C	S	.	.	H	α-helix	trans	-76	-43.5	167.5	-59.5	-57.2	0	0	0	110.5	L517 F561 T562 Q567 R568 L569	L517-D565 HydrophobicContact CD1-CB 3.97Å; F561-D565 HydrophobicContact CD2-CB 3.72Å; F561-D565 HydrophobicContact CE2-CB 3.46Å; F561-D565 VanDerWaalsContact CE2-CB 3.46Å; F561-D565 HydrophobicContact CG-CB 4.38Å; F561-D565 HydrophobicContact CZ-CB 3.92Å; T562-D565 WeakPolarHBondContact CB-OD2 3.37Å; T562-D565 PolarHBondContact N-OD2 3.26Å; T562-D565 WeakPolarHBondContact O-CB 3.29Å; T562-D565 PolarHBondContact O-N 2.93Å; T562-D565 PolarHBondContact OG1-N 3.5Å; T562-D565 PolarHBondContact OG1-OD2 2.96Å; D565-Q567 VanDerWaalsContact C-N 3.28Å; D565-Q567 PolarHBondContact O-N 3.41Å; D565-R568 PolarHBondContact O-N 2.88Å; D565-R568 IonicContact OD1-CZ 3.5Å; D565-R568 IonicContact OD1-NH1 2.76Å; D565-R568 PolarHBondContact OD1-NH1 3.05Å; D565-R568 VanDerWaalsContact OD1-NH1 3.1Å; D565-R568 IonicContact OD1-NH2 3.26Å; D565-R568 PolarHBondContact OD1-NH2 3.07Å; D565-L569 PolarHBondContact O-N 2.97Å
566	E	92	Very high	82.7	Confident	55 Å²	55	74.8 Å²	74.8	26%	0.257	38%	0.379	S	S	.	.	H	α-helix	trans	-59.4	-38.6	174.7	-160.2	-156	139.3	0	0	111.9	F561 T562 K563 L569 K570	F561-E566 HydrophobicContact CE1-CB 3.77Å; F561-E566 HydrophobicContact CE1-CG 4.19Å; F561-E566 HydrophobicContact CZ-CB 4.14Å; T562-E566 PolarHBondContact O-N 2.89Å; K563-E566 PolarHBondContact O-N 3.22Å; E566-L569 PolarHBondContact O-N 3.38Å; E566-K570 WeakPolarHBondContact O-CG 3.43Å; E566-K570 PolarHBondContact O-N 2.98Å; E566-K570 WeakPolarHBondContact OE1-CE 3.5Å; E566-K570 IonicContact OE1-NZ 2.69Å; E566-K570 PolarHBondContact OE1-NZ 3.25Å
567	Q	93.9	Very high	85.4	Confident	86 Å²	86	74.1 Å²	74.1	40%	0.402	36%	0.364	S	S	.	.	H	α-helix	trans	-69.3	-43.8	174.7	-173.9	56.5	43.1	0	0	111.7	K563 D565 L569 K570 D571	K563-Q567 WeakPolarHBondContact O-CB 3.36Å; K563-Q567 PolarHBondContact O-N 3.16Å; D565-Q567 VanDerWaalsContact C-N 3.28Å; D565-Q567 PolarHBondContact O-N 3.41Å; Q567-L569 PolarHBondContact O-N 3.37Å; Q567-K570 WeakPolarHBondContact O-CA 3.38Å; Q567-K570 WeakPolarHBondContact O-CB 3.48Å; Q567-K570 PolarHBondContact O-N 3.23Å; Q567-D571 PolarHBondContact NE2-OD1 2.99Å; Q567-D571 VanDerWaalsContact O-CG 3.24Å; Q567-D571 PolarHBondContact O-N 3.36Å
568	R	93.8	Very high	88	Confident	105 Å²	105	72.8 Å²	72.8	40%	0.396	35%	0.349	S	S	.	.	H	α-helix	trans	-58.8	-34.5	174.1	-86.5	174.4	-80.2	143.6	0.1	112.6	L517 E564 D565 D571 Y572	L517-R568 HydrophobicContact CD2-CB 4.11Å; E564-R568 WeakPolarHBondContact O-CG 3.46Å; E564-R568 PolarHBondContact O-N 3.05Å; E564-R568 PolarHBondContact O-NE 3.07Å; E564-R568 PolarHBondContact O-NH2 3.1Å; D565-R568 PolarHBondContact O-N 2.88Å; D565-R568 IonicContact OD1-CZ 3.5Å; D565-R568 IonicContact OD1-NH1 2.76Å; D565-R568 PolarHBondContact OD1-NH1 3.05Å; D565-R568 VanDerWaalsContact OD1-NH1 3.1Å; D565-R568 IonicContact OD1-NH2 3.26Å; D565-R568 PolarHBondContact OD1-NH2 3.07Å; R568-D571 PolarHBondContact O-N 2.69Å; R568-Y572 WeakPolarHBondContact O-CB 3.37Å; R568-Y572 PolarHBondContact O-N 3.28Å
569	L	93.8	Very high	90.5	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-39.9	172.6	-174.7	62.1	0	0	0	112.4	A458 L461 L462 L465 L516 D565 E566 Q567 I573	A458-L569 HydrophobicContact CB-CD1 3.92Å; L461-L569 HydrophobicContact CB-CD2 4.5Å; L462-L569 HydrophobicContact CB-CD2 4.04Å; L462-L569 HydrophobicContact CD1-CD2 4.26Å; L462-L569 HydrophobicContact CD1-CG 4.35Å; L462-L569 HydrophobicContact CG-CD2 4.14Å; L465-L569 HydrophobicContact CD1-CD2 4.45Å; L516-L569 HydrophobicContact CD2-CD1 3.58Å; D565-L569 PolarHBondContact O-N 2.97Å; E566-L569 PolarHBondContact O-N 3.38Å; Q567-L569 PolarHBondContact O-N 3.37Å; L569-I573 HydrophobicContact CG-CD1 4.44Å; L569-I573 VanDerWaalsContact O-CG1 3.32Å; L569-I573 WeakPolarHBondContact O-CG1 3.48Å; L569-I573 PolarHBondContact O-N 3.14Å
570	K	95.1	Very high	92.2	Very high	76 Å²	76	71.4 Å²	71.4	33%	0.33	33%	0.329	S	S	.	.	H	α-helix	trans	-67.4	-39.8	174.6	-66.4	165.3	-168	167.3	0	112.3	L462 E566 Q567 I573 Q574	L462-K570 HydrophobicContact CD1-CG 3.69Å; E566-K570 WeakPolarHBondContact O-CG 3.43Å; E566-K570 PolarHBondContact O-N 2.98Å; E566-K570 WeakPolarHBondContact OE1-CE 3.5Å; E566-K570 IonicContact OE1-NZ 2.69Å; E566-K570 PolarHBondContact OE1-NZ 3.25Å; Q567-K570 WeakPolarHBondContact O-CA 3.38Å; Q567-K570 WeakPolarHBondContact O-CB 3.48Å; Q567-K570 PolarHBondContact O-N 3.23Å; K570-I573 WeakPolarHBondContact O-CB 3.49Å; K570-I573 PolarHBondContact O-N 3.45Å; K570-Q574 PolarHBondContact O-N 2.87Å
571	D	94.8	Very high	93.2	Very high	85 Å²	85	65.9 Å²	65.9	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-40.5	177.8	-61.9	-27	0	0	0	110.5	Q567 R568 Q574 Q575	Q567-D571 PolarHBondContact NE2-OD1 2.99Å; Q567-D571 VanDerWaalsContact O-CG 3.24Å; Q567-D571 PolarHBondContact O-N 3.36Å; R568-D571 PolarHBondContact O-N 2.69Å; D571-Q574 CarbonylContact O-C 3.6Å; D571-Q574 PolarHBondContact O-N 2.82Å; D571-Q574 VanDerWaalsContact O-N 3.16Å; D571-Q575 PolarHBondContact O-N 2.98Å
572	Y	94.4	Very high	93.7	Very high	32 Å²	32	67.5 Å²	67.5	13%	0.125	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-43	172.2	176.9	-124.3	0	0	0	113	A458 L516 L520 R568 Q574 Q575 L576	A458-Y572 HydrophobicContact CB-CD1 4.28Å; A458-Y572 HydrophobicContact CB-CE1 4.4Å; L516-Y572 HydrophobicContact CD2-CD1 3.88Å; L516-Y572 HydrophobicContact CD2-CE1 3.83Å; L516-Y572 HydrophobicContact CG-CE1 4.47Å; L520-Y572 HydrophobicContact CD1-CD2 3.65Å; L520-Y572 HydrophobicContact CD1-CE2 3.61Å; L520-Y572 HydrophobicContact CD2-CD1 4.48Å; L520-Y572 HydrophobicContact CD2-CD2 3.55Å; L520-Y572 HydrophobicContact CD2-CE2 4.23Å; L520-Y572 HydrophobicContact CD2-CG 3.69Å; L520-Y572 HydrophobicContact CG-CD2 4.17Å; L520-Y572 HydrophobicContact CG-CE2 4.41Å; R568-Y572 WeakPolarHBondContact O-CB 3.37Å; R568-Y572 PolarHBondContact O-N 3.28Å; Y572-Q574 PolarHBondContact O-N 3.14Å; Y572-Q575 WeakPolarHBondContact O-CB 3.36Å; Y572-Q575 PolarHBondContact O-N 2.89Å; Y572-L576 HydrophobicContact CD1-CD1 4.11Å; Y572-L576 HydrophobicContact CD2-CD1 4.44Å; Y572-L576 HydrophobicContact CD2-CG 4.18Å; Y572-L576 HydrophobicContact CE1-CD1 3.63Å; Y572-L576 HydrophobicContact CE1-CG 4.33Å; Y572-L576 HydrophobicContact CE2-CD1 4Å; Y572-L576 HydrophobicContact CE2-CD2 3.89Å; Y572-L576 HydrophobicContact CE2-CG 3.76Å; Y572-L576 WeakPolarHBondContact O-CG 3.35Å; Y572-L576 PolarHBondContact O-N 2.74Å
573	I	95.6	Very high	94.1	Very high	6 Å²	6	65.9 Å²	65.9	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-56.8	-40.9	172	-75.3	163.8	0	0	0	110.7	A458 Y459 L462 L569 K570 K577	A458-I573 HydrophobicContact CB-CD1 3.92Å; A458-I573 HydrophobicContact CB-CG1 3.51Å; Y459-I573 HydrophobicContact CD1-CD1 3.9Å; Y459-I573 HydrophobicContact CD1-CG2 4.47Å; Y459-I573 HydrophobicContact CE1-CD1 4.1Å; Y459-I573 HydrophobicContact CE1-CG2 3.76Å; Y459-I573 HydrophobicContact CE2-CG2 3.89Å; Y459-I573 HydrophobicContact CG-CD1 4.33Å; Y459-I573 VanDerWaalsContact CZ-CG2 3.42Å; Y459-I573 WeakPolarHBondContact OH-CG2 3.39Å; L462-I573 HydrophobicContact CD1-CD1 3.78Å; L569-I573 HydrophobicContact CG-CD1 4.44Å; L569-I573 VanDerWaalsContact O-CG1 3.32Å; L569-I573 WeakPolarHBondContact O-CG1 3.48Å; L569-I573 PolarHBondContact O-N 3.14Å; K570-I573 WeakPolarHBondContact O-CB 3.49Å; K570-I573 PolarHBondContact O-N 3.45Å; I573-K577 HydrophobicContact CG2-CD 3.9Å; I573-K577 VanDerWaalsContact O-CD 3.26Å; I573-K577 WeakPolarHBondContact O-CD 3.2Å; I573-K577 VanDerWaalsContact O-CG 3.25Å; I573-K577 WeakPolarHBondContact O-CG 3.23Å; I573-K577 PolarHBondContact O-N 3.24Å; I573-K577 VanDerWaalsContact O-N 3.16Å
574	Q	96.2	Very high	94.3	Very high	81 Å²	81	65.9 Å²	65.9	38%	0.379	32%	0.319	S	S	.	.	H	α-helix	trans	-72.8	-34.6	177.5	-169.8	54.4	47.3	0	0	112.9	K570 D571 Y572 K577 N578	K570-Q574 PolarHBondContact O-N 2.87Å; D571-Q574 CarbonylContact O-C 3.6Å; D571-Q574 PolarHBondContact O-N 2.82Å; D571-Q574 VanDerWaalsContact O-N 3.16Å; Y572-Q574 PolarHBondContact O-N 3.14Å; Q574-K577 PolarHBondContact O-N 2.76Å; Q574-N578 PolarHBondContact NE2-OD1 3.02Å; Q574-N578 PolarHBondContact O-N 3.48Å; Q574-N578 PolarHBondContact O-ND2 3.33Å; Q574-N578 PolarHBondContact O-OD1 3.36Å
575	Q	94.9	Very high	94.5	Very high	96 Å²	96	67.3 Å²	67.3	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-57.2	-54.9	170.6	-178.5	63.5	45	0	0	110.7	D571 Y572 K577 N578 D579	D571-Q575 PolarHBondContact O-N 2.98Å; Y572-Q575 WeakPolarHBondContact O-CB 3.36Å; Y572-Q575 PolarHBondContact O-N 2.89Å; Q575-K577 VanDerWaalsContact C-N 3.27Å; Q575-K577 PolarHBondContact O-N 2.92Å; Q575-N578 WeakPolarHBondContact O-CA 3.24Å; Q575-N578 WeakPolarHBondContact O-CB 3.19Å; Q575-N578 PolarHBondContact O-N 2.78Å; Q575-D579 WeakPolarHBondContact CG-OD2 3.4Å; Q575-D579 VanDerWaalsContact NE2-CG 3.29Å; Q575-D579 PolarHBondContact NE2-OD1 3.23Å; Q575-D579 PolarHBondContact NE2-OD2 3.35Å; Q575-D579 PolarHBondContact O-N 2.87Å
576	L	94.8	Very high	94.6	Very high	4 Å²	4	70.4 Å²	70.4	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-56.1	-38.5	177.3	-69.5	172.7	0	0	0	113.1	Y451 Q454 C455 Y572 D579 R580	Y451-L576 HydrophobicContact CD1-CD2 3.77Å; Y451-L576 HydrophobicContact CE1-CD2 4.47Å; Q454-L576 HydrophobicContact CB-CD1 3.85Å; Q454-L576 HydrophobicContact CB-CD2 4.05Å; C455-L576 HydrophobicContact CB-CB 4.33Å; C455-L576 HydrophobicContact CB-CD1 4.08Å; Y572-L576 HydrophobicContact CD1-CD1 4.11Å; Y572-L576 HydrophobicContact CD2-CD1 4.44Å; Y572-L576 HydrophobicContact CD2-CG 4.18Å; Y572-L576 HydrophobicContact CE1-CD1 3.63Å; Y572-L576 HydrophobicContact CE1-CG 4.33Å; Y572-L576 HydrophobicContact CE2-CD1 4Å; Y572-L576 HydrophobicContact CE2-CD2 3.89Å; Y572-L576 HydrophobicContact CE2-CG 3.76Å; Y572-L576 WeakPolarHBondContact O-CG 3.35Å; Y572-L576 PolarHBondContact O-N 2.74Å; L576-D579 PolarHBondContact O-N 3.19Å; L576-R580 VanDerWaalsContact O-CB 3.23Å; L576-R580 WeakPolarHBondContact O-CB 3.49Å; L576-R580 PolarHBondContact O-N 3.29Å
577	K	96.4	Very high	94.5	Very high	82 Å²	82	71 Å²	71	36%	0.357	35%	0.353	S	S	.	.	H	α-helix	trans	-68.6	-34.8	176	-72.6	160.1	63.4	-159.3	0	112.5	I573 Q574 Q575 A581	I573-K577 HydrophobicContact CG2-CD 3.9Å; I573-K577 VanDerWaalsContact O-CD 3.26Å; I573-K577 WeakPolarHBondContact O-CD 3.2Å; I573-K577 VanDerWaalsContact O-CG 3.25Å; I573-K577 WeakPolarHBondContact O-CG 3.23Å; I573-K577 PolarHBondContact O-N 3.24Å; I573-K577 VanDerWaalsContact O-N 3.16Å; Q574-K577 PolarHBondContact O-N 2.76Å; Q575-K577 VanDerWaalsContact C-N 3.27Å; Q575-K577 PolarHBondContact O-N 2.92Å; K577-A581 WeakPolarHBondContact O-CB 3.3Å; K577-A581 PolarHBondContact O-N 2.84Å
578	N	95.9	Very high	94.2	Very high	82 Å²	82	71.1 Å²	71.1	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-69.6	-45.3	173.7	-62.6	-18.7	0	0	0	110.9	Q574 Q575 A581 A582	Q574-N578 PolarHBondContact NE2-OD1 3.02Å; Q574-N578 PolarHBondContact O-N 3.48Å; Q574-N578 PolarHBondContact O-ND2 3.33Å; Q574-N578 PolarHBondContact O-OD1 3.36Å; Q575-N578 WeakPolarHBondContact O-CA 3.24Å; Q575-N578 WeakPolarHBondContact O-CB 3.19Å; Q575-N578 PolarHBondContact O-N 2.78Å; N578-A581 CarbonylContact O-C 3.58Å; N578-A581 WeakPolarHBondContact O-CA 3.42Å; N578-A581 WeakPolarHBondContact O-CB 3.45Å; N578-A581 PolarHBondContact O-N 3.16Å; N578-A582 PolarHBondContact O-N 3.01Å
579	D	94.7	Very high	93.8	Very high	48 Å²	48	74.7 Å²	74.7	26%	0.257	38%	0.377	S	S	.	.	H	α-helix	trans	-67	-40.6	-178.4	-62.8	-30.5	0	0	0	111.5	Y451 Q575 L576 A581 A582 V583	Y451-D579 HydrophobicContact CD1-CB 4.48Å; Y451-D579 HydrophobicContact CD2-CB 4.37Å; Y451-D579 HydrophobicContact CE1-CB 4.15Å; Y451-D579 HydrophobicContact CE2-CB 4.03Å; Q575-D579 WeakPolarHBondContact CG-OD2 3.4Å; Q575-D579 VanDerWaalsContact NE2-CG 3.29Å; Q575-D579 PolarHBondContact NE2-OD1 3.23Å; Q575-D579 PolarHBondContact NE2-OD2 3.35Å; Q575-D579 PolarHBondContact O-N 2.87Å; L576-D579 PolarHBondContact O-N 3.19Å; D579-A581 VanDerWaalsContact C-N 3.29Å; D579-A581 PolarHBondContact O-N 3.33Å; D579-A582 PolarHBondContact O-N 3.48Å; D579-V583 PolarHBondContact O-N 3.06Å
580	R	95.6	Very high	93.2	Very high	124 Å²	124	78.5 Å²	78.5	47%	0.468	40%	0.397	S	S	.	.	H	α-helix	trans	-58.8	-38.2	168.6	-176.7	-177.5	174.1	-169.9	3.6	112.5	A448 Y451 S452 L576 K584	A448-R580 HydrophobicContact CB-CG 4.22Å; Y451-R580 HydrophobicContact CD2-CB 4.47Å; S452-R580 WeakPolarHBondContact OG-CD 3.2Å; S452-R580 PolarHBondContact OG-NE 3.35Å; S452-R580 PolarHBondContact OG-NH1 2.93Å; S452-R580 PolarHBondContact OG-NH2 3.25Å; L576-R580 VanDerWaalsContact O-CB 3.23Å; L576-R580 WeakPolarHBondContact O-CB 3.49Å; L576-R580 PolarHBondContact O-N 3.29Å; R580-K584 PolarHBondContact O-N 3Å
581	A	94.5	Very high	92.2	Very high	51 Å²	51	79.9 Å²	79.9	42%	0.421	41%	0.405	S	S	.	.	H	α-helix	trans	-70.2	-38.3	176.5	0	0	0	0	0	111.8	K577 N578 D579 K584 L585	K577-A581 WeakPolarHBondContact O-CB 3.3Å; K577-A581 PolarHBondContact O-N 2.84Å; N578-A581 CarbonylContact O-C 3.58Å; N578-A581 WeakPolarHBondContact O-CA 3.42Å; N578-A581 WeakPolarHBondContact O-CB 3.45Å; N578-A581 PolarHBondContact O-N 3.16Å; D579-A581 VanDerWaalsContact C-N 3.29Å; D579-A581 PolarHBondContact O-N 3.33Å; A581-K584 WeakPolarHBondContact O-CB 3.44Å; A581-K584 PolarHBondContact O-N 2.88Å; A581-L585 WeakPolarHBondContact O-CG 3.4Å; A581-L585 PolarHBondContact O-N 3.14Å; A581-L585 VanDerWaalsContact O-N 3.16Å
582	A	95.3	Very high	90.9	Very high	52 Å²	52	79.2 Å²	79.2	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-44.1	173.9	0	0	0	0	0	111.9	N578 D579 K584 L585 T586	N578-A582 PolarHBondContact O-N 3.01Å; D579-A582 PolarHBondContact O-N 3.48Å; A582-K584 VanDerWaalsContact C-N 3.3Å; A582-K584 PolarHBondContact O-N 2.73Å; A582-L585 WeakPolarHBondContact O-CB 3.34Å; A582-L585 PolarHBondContact O-N 3.24Å; A582-L585 VanDerWaalsContact O-N 3.1Å; A582-T586 PolarHBondContact O-N 3.1Å
583	V	95.3	Very high	89.1	Confident	20 Å²	20	81.9 Å²	81.9	12%	0.121	42%	0.422	C	S	.	.	H	α-helix	trans	-64.5	-32.9	173.7	172.7	0	0	0	0	112.4	A444 L447 A448 Y451 D579 L585 T586	A444-V583 HydrophobicContact CB-CG1 3.89Å; A444-V583 WeakPolarHBondContact O-CG1 3.32Å; L447-V583 HydrophobicContact CB-CG1 4.07Å; L447-V583 HydrophobicContact CB-CG2 4.36Å; A448-V583 HydrophobicContact CB-CG1 4.11Å; Y451-V583 HydrophobicContact CD2-CG2 4.36Å; Y451-V583 HydrophobicContact CE2-CG2 3.82Å; D579-V583 PolarHBondContact O-N 3.06Å; V583-L585 VanDerWaalsContact C-N 3.26Å; V583-L585 PolarHBondContact O-N 3.2Å; V583-T586 PolarHBondContact O-N 3.1Å; V583-T586 PolarHBondContact O-OG1 2.86Å
584	K	92.4	Very high	87.4	Confident	153 Å²	153	89 Å²	89	67%	0.665	46%	0.455	S	S	*	.	H	α-helix	trans	-65.8	-30	173.4	-167.5	179.7	177.7	-173.6	0	112.3	R580 A581 A582 T586 M587	R580-K584 PolarHBondContact O-N 3Å; A581-K584 WeakPolarHBondContact O-CB 3.44Å; A581-K584 PolarHBondContact O-N 2.88Å; A582-K584 VanDerWaalsContact C-N 3.3Å; A582-K584 PolarHBondContact O-N 2.73Å; K584-T586 VanDerWaalsContact C-N 3.3Å; K584-T586 PolarHBondContact O-N 3.39Å; K584-M587 HydrophobicContact CG-SD 4.42Å; K584-M587 PolarHBondContact O-N 3.4Å
585	L	93.6	Very high	85.5	Confident	153 Å²	153	91.2 Å²	91.2	80%	0.801	47%	0.468	S	S	*	.	H	α-helix	trans	-74.4	-15.4	177.1	-68.3	170	0	0	0	113.8	A581 A582 V583	A581-L585 WeakPolarHBondContact O-CG 3.4Å; A581-L585 PolarHBondContact O-N 3.14Å; A581-L585 VanDerWaalsContact O-N 3.16Å; A582-L585 WeakPolarHBondContact O-CB 3.34Å; A582-L585 PolarHBondContact O-N 3.24Å; A582-L585 VanDerWaalsContact O-N 3.1Å; V583-L585 VanDerWaalsContact C-N 3.26Å; V583-L585 PolarHBondContact O-N 3.2Å
586	T	93	Very high	82.9	Confident	88 Å²	88	90.7 Å²	90.7	54%	0.54	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1	174.4	62.6	0	0	0	0	113.5	A582 V583 K584	A582-T586 PolarHBondContact O-N 3.1Å; V583-T586 PolarHBondContact O-N 3.1Å; V583-T586 PolarHBondContact O-OG1 2.86Å; K584-T586 VanDerWaalsContact C-N 3.3Å; K584-T586 PolarHBondContact O-N 3.39Å
587	M	90.1	Very high	80.7	Confident	66 Å²	66	96.1 Å²	96.1	33%	0.325	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-74.8	131.1	175.2	-66.5	-173.7	65.5	0	0	111.3	N441 A444 L445 K584	N441-M587 WeakPolarHBondContact OD1-CA 3.49Å; A444-M587 HydrophobicContact CB-CG 3.95Å; L445-M587 HydrophobicContact CD1-CE 4.07Å; L445-M587 HydrophobicContact CD2-CE 3.74Å; L445-M587 HydrophobicContact CD2-SD 4.02Å; L445-M587 HydrophobicContact CG-CE 3.73Å; L445-M587 HydrophobicContact CG-SD 4.3Å; K584-M587 HydrophobicContact CG-SD 4.42Å; K584-M587 PolarHBondContact O-N 3.4Å
588	L	88.3	Confident	78.3	Confident	90 Å²	90	98.8 Å²	98.8	47%	0.471	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-89.2	156.3	177.4	-58.9	177.1	0	0	0	111.2	K437 N441	K437-L588 HydrophobicContact CB-CD1 4.41Å; K437-L588 HydrophobicContact CG-CD1 4.05Å; N441-L588 PolarHBondContact ND2-O 3.48Å; N441-L588 PolarHBondContact OD1-N 2.97Å
589	E	85.2	Confident	75.8	Confident	179 Å²	179	98.8 Å²	98.8	84%	0.836	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-71.2	139.7	168.8	-64.7	-176	157.1	0	0	110.2
590	L	80.3	Confident	73.5	Confident	80 Å²	80	106.7 Å²	106.7	42%	0.419	56%	0.556	S	S	.	*			trans	-106.1	109.5	-174.1	-67.4	172.3	0	0	0	110.2	K437 Y438 N441	K437-L590 HydrophobicContact CB-CD2 4.07Å; Y438-L590 HydrophobicContact CD1-CD1 3.9Å; Y438-L590 HydrophobicContact CD1-CD2 3.74Å; Y438-L590 HydrophobicContact CD1-CG 4.37Å; Y438-L590 HydrophobicContact CD2-CD2 4.23Å; Y438-L590 HydrophobicContact CE1-CB 4.22Å; Y438-L590 HydrophobicContact CE1-CD1 3.71Å; Y438-L590 HydrophobicContact CE1-CD2 3.89Å; Y438-L590 HydrophobicContact CE1-CG 4.15Å; Y438-L590 HydrophobicContact CE2-CD2 4.34Å; Y438-L590 HydrophobicContact CG-CD2 3.91Å; N441-L590 WeakPolarHBondContact ND2-CD2 3.37Å; N441-L590 VanDerWaalsContact ND2-CG 3.34Å; N441-L590 WeakPolarHBondContact ND2-CG 3.45Å
591	E	76.1	Confident	70.9	Confident	105 Å²	105	108.4 Å²	108.4	49%	0.491	57%	0.574	S	S	.	*			trans	-72.8	139.8	170.3	-72.4	138	-140.6	0	0	110.7	L434 K437 Y438	L434-E591 HydrophobicContact CD2-CB 3.69Å; L434-E591 WeakPolarHBondContact CD2-OE2 3.43Å; K437-E591 IonicContact NZ-OE1 3.93Å; K437-E591 PolarHBondContact NZ-OE1 2.9Å; K437-E591 IonicContact NZ-OE2 2.82Å; K437-E591 PolarHBondContact NZ-OE2 3.1Å; Y438-E591 PolarHBondContact OH-O 3.1Å
592	S	67.4	Low	68.4	Low	71 Å²	71	111.9 Å²	111.9	50%	0.497	59%	0.59	S	S	.	*			trans	-64.2	137.2	173	173.9	0	0	0	0	111.4	H594	S592-H594 VanDerWaalsContact C-N 3.27Å; S592-H594 WeakPolarHBondContact CB-O 3.26Å; S592-H594 PolarHBondContact O-N 3.1Å; S592-H594 PolarHBondContact OG-N 3.26Å; S592-H594 VanDerWaalsContact OG-N 3.11Å; S592-H594 PolarHBondContact OG-O 3.45Å
593	I	56.7	Low	65.8	Low	88 Å²	88	118.5 Å²	118.5	45%	0.451	61%	0.609	S	S	.	*	S	Bend	trans	-62.6	-39.5	170	-63.7	169.3	0	0	0	110.1	L434 I595	L434-I593 HydrophobicContact CD1-CG1 4.38Å; I593-I595 PolarHBondContact O-N 3.06Å
594	H	59.2	Low	63.5	Low	155 Å²	155	121.8 Å²	121.8	72%	0.718	63%	0.631	S	S	*	*	S	Bend	trans	-74.2	115.1	172.7	-52.4	98	0	0	0	109.4	S592 D596	S592-H594 VanDerWaalsContact C-N 3.27Å; S592-H594 WeakPolarHBondContact CB-O 3.26Å; S592-H594 PolarHBondContact O-N 3.1Å; S592-H594 PolarHBondContact OG-N 3.26Å; S592-H594 VanDerWaalsContact OG-N 3.11Å; S592-H594 PolarHBondContact OG-O 3.45Å; H594-D596 PolarHBondContact O-N 2.82Å
595	I	55.2	Low	61.5	Low	129 Å²	129	124.5 Å²	124.5	66%	0.662	64%	0.637	S	S	*	*			trans	-72	104.7	163.7	-59.8	169.9	0	0	0	105.9	I593 P597	I593-I595 PolarHBondContact O-N 3.06Å; I595-P597 VanDerWaalsContact O-CD 3.32Å; I595-P597 WeakPolarHBondContact O-CD 3.25Å
596	D	41	Very low	59.8	Low	84 Å²	84	119.2 Å²	119.2	45%	0.449	62%	0.619	S	S	.	*			trans	-63.9	120.3	169.8	-177.3	-15.6	0	0	0	108.2	H594 L598 S599	H594-D596 PolarHBondContact O-N 2.82Å; D596-L598 PolarHBondContact O-N 2.74Å; D596-L598 PolarHBondContact OD1-N 2.82Å; D596-S599 VanDerWaalsContact O-CB 3.28Å; D596-S599 WeakPolarHBondContact O-CB 3.38Å; D596-S599 PolarHBondContact O-N 3.14Å
597	P	48.1	Very low	58.3	Low	118 Å²	118	119.6 Å²	119.6	77%	0.766	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-9.5	-179.7	-24.8	35.8	0	0	0	114.8	I595	I595-P597 VanDerWaalsContact O-CD 3.32Å; I595-P597 WeakPolarHBondContact O-CD 3.25Å
598	L	46	Very low	57.2	Low	139 Å²	139	120 Å²	120	73%	0.728	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	2.5	177.4	-56.1	178.9	0	0	0	113.8	D596 Y600	D596-L598 PolarHBondContact O-N 2.74Å; D596-L598 PolarHBondContact OD1-N 2.82Å; L598-Y600 VanDerWaalsContact C-N 3.29Å; L598-Y600 PolarHBondContact O-N 3.37Å
599	S	43.8	Very low	56.4	Low	81 Å²	81	119 Å²	119	57%	0.566	62%	0.62	S	S	*	*			trans	-75	71.2	-178.8	-168.6	0	0	0	0	113.1	D596 D601	D596-S599 VanDerWaalsContact O-CB 3.28Å; D596-S599 WeakPolarHBondContact O-CB 3.38Å; D596-S599 PolarHBondContact O-N 3.14Å; S599-D601 VanDerWaalsContact C-N 3.29Å; S599-D601 PolarHBondContact O-N 3.33Å; S599-D601 VanDerWaalsContact O-N 3.16Å
600	Y	46.4	Very low	56.1	Low	215 Å²	215	118 Å²	118	84%	0.843	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	7.9	-166.2	-117	-88.1	0	0	0	117.1	L598	L598-Y600 VanDerWaalsContact C-N 3.29Å; L598-Y600 PolarHBondContact O-N 3.37Å
601	D	41	Very low	56.1	Low	160 Å²	160	119.3 Å²	119.3	86%	0.856	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	29.3	-168	-151.4	13.2	0	0	0	114.5	S599	S599-D601 VanDerWaalsContact C-N 3.29Å; S599-D601 PolarHBondContact O-N 3.33Å; S599-D601 VanDerWaalsContact O-N 3.16Å
602	V	43.1	Very low	56.5	Low	124 Å²	124	118.5 Å²	118.5	75%	0.752	62%	0.615	S	S	*	*	S	Bend	trans	-126	130.8	166.6	-177.2	0	0	0	0	109.3
603	K	40.2	Very low	57.6	Low	191 Å²	191	116.9 Å²	116.9	83%	0.83	60%	0.6	S	S	*	*			trans	-53.4	134.9	-174.3	-102.5	179.2	174.7	176.8	0	112.3	R605	K603-R605 PolarHBondContact O-N 2.86Å; K603-R605 VanDerWaalsContact O-N 3.1Å
604	P	47.1	Very low	59.1	Low	89 Å²	89	116.6 Å²	116.6	58%	0.578	60%	0.597	S	S	*	*			trans	-68.8	111.5	-175.9	27.9	-35	0	0	0	111	D607	P604-D607 HydrophobicContact CB-CB 4.1Å; P604-D607 VanDerWaalsContact CB-CG 3.48Å; P604-D607 WeakPolarHBondContact CB-OD2 3.18Å
605	R	50.4	Low	60.7	Low	209 Å²	209	113.9 Å²	113.9	79%	0.789	59%	0.588	S	S	*	*	S	Bend	trans	-118	-22.6	168.2	-154.5	175.6	-166.7	-110.7	1.8	112.5	K603	K603-R605 PolarHBondContact O-N 2.86Å; K603-R605 VanDerWaalsContact O-N 3.1Å
606	G	57.3	Low	62.5	Low	43 Å²	43	108.1 Å²	108.1	44%	0.443	56%	0.56	S	S	.	*	H	α-helix	trans	-78.1	-34.8	173.6	0	0	0	0	0	113.2	S608 Q609 R610	G606-S608 VanDerWaalsContact C-N 3.27Å; G606-S608 PolarHBondContact O-N 2.65Å; G606-Q609 PolarHBondContact O-N 2.84Å; G606-R610 PolarHBondContact O-N 3.34Å
607	D	61.3	Low	65	Low	96 Å²	96	106.7 Å²	106.7	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-55.2	-39.8	-175.1	-58	15.2	0	0	0	112.9	P604 L611	P604-D607 HydrophobicContact CB-CB 4.1Å; P604-D607 VanDerWaalsContact CB-CG 3.48Å; P604-D607 WeakPolarHBondContact CB-OD2 3.18Å; D607-L611 WeakPolarHBondContact O-CB 3.29Å; D607-L611 VanDerWaalsContact O-CG 3.23Å; D607-L611 WeakPolarHBondContact O-CG 3.43Å; D607-L611 PolarHBondContact O-N 3.23Å
608	S	66.6	Low	67.2	Low	73 Å²	73	106.2 Å²	106.2	51%	0.51	54%	0.544	S	S	.	.	H	α-helix	trans	-63.7	-48.5	174.2	-56.8	0	0	0	0	111.8	G606 R610 L611 D612	G606-S608 VanDerWaalsContact C-N 3.27Å; G606-S608 PolarHBondContact O-N 2.65Å; S608-R610 VanDerWaalsContact C-N 3.27Å; S608-R610 PolarHBondContact O-N 2.89Å; S608-L611 PolarHBondContact O-N 3.38Å; S608-L611 VanDerWaalsContact O-N 3.15Å; S608-D612 WeakPolarHBondContact O-CB 3.2Å; S608-D612 PolarHBondContact O-N 2.96Å; S608-D612 VanDerWaalsContact O-OD2 3.12Å
609	Q	71.8	Confident	69.5	Low	70 Å²	70	103.5 Å²	103.5	33%	0.327	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-34.1	-179.2	-56.1	-173.2	-92.4	0	0	111.7	G606 L613	G606-Q609 PolarHBondContact O-N 2.84Å; Q609-L613 WeakPolarHBondContact O-CB 3.41Å; Q609-L613 PolarHBondContact O-N 3.44Å
610	R	78.3	Confident	71.9	Confident	157 Å²	157	101.9 Å²	101.9	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-45.3	172.2	179.3	178.8	173.1	136.4	14.3	112.1	G606 S608 D612 L613 E614	G606-R610 PolarHBondContact O-N 3.34Å; S608-R610 VanDerWaalsContact C-N 3.27Å; S608-R610 PolarHBondContact O-N 2.89Å; R610-D612 VanDerWaalsContact C-N 3.33Å; R610-L613 WeakPolarHBondContact O-CB 3.48Å; R610-L613 PolarHBondContact O-N 3.49Å; R610-E614 IonicContact CZ-OE1 3.1Å; R610-E614 VanDerWaalsContact CZ-OE1 3.3Å; R610-E614 IonicContact NE-OE1 3.63Å; R610-E614 PolarHBondContact NE-OE1 3.2Å; R610-E614 IonicContact NH2-OE1 2.66Å; R610-E614 PolarHBondContact NH2-OE1 2.99Å; R610-E614 WeakPolarHBondContact O-CB 3.47Å; R610-E614 WeakPolarHBondContact O-CG 3.3Å; R610-E614 PolarHBondContact O-N 2.85Å
611	L	80.2	Confident	74.3	Confident	108 Å²	108	96.9 Å²	96.9	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-66.1	-36.3	175.8	-72.6	167.1	0	0	0	111.8	D607 S608 L613 N615	D607-L611 WeakPolarHBondContact O-CB 3.29Å; D607-L611 VanDerWaalsContact O-CG 3.23Å; D607-L611 WeakPolarHBondContact O-CG 3.43Å; D607-L611 PolarHBondContact O-N 3.23Å; S608-L611 PolarHBondContact O-N 3.38Å; S608-L611 VanDerWaalsContact O-N 3.15Å; L611-L613 VanDerWaalsContact C-N 3.35Å; L611-N615 WeakPolarHBondContact O-CB 3.41Å; L611-N615 PolarHBondContact O-N 3.27Å
612	D	86.2	Confident	76.9	Confident	88 Å²	88	93.4 Å²	93.4	47%	0.471	48%	0.477	S	S	.	.	H	α-helix	trans	-63	-41.5	173.5	-66.9	-35.7	0	0	0	110.9	S608 R610 A616	S608-D612 WeakPolarHBondContact O-CB 3.2Å; S608-D612 PolarHBondContact O-N 2.96Å; S608-D612 VanDerWaalsContact O-OD2 3.12Å; R610-D612 VanDerWaalsContact C-N 3.33Å; D612-A616 VanDerWaalsContact O-CB 3.31Å; D612-A616 WeakPolarHBondContact O-CB 3.32Å; D612-A616 PolarHBondContact O-N 2.93Å
613	L	88.7	Confident	79.4	Confident	38 Å²	38	88 Å²	88	20%	0.199	44%	0.444	C	S	.	.	H	α-helix	trans	-65.4	-51.2	174	-177.2	75.4	0	0	0	112.2	L416 I419 T420 Q609 R610 L611 N615 A616 V617	L416-L613 HydrophobicContact CD1-CD1 3.61Å; I419-L613 HydrophobicContact CG2-CB 4.24Å; I419-L613 HydrophobicContact CG2-CD1 4.04Å; T420-L613 HydrophobicContact CG2-CD1 3.38Å; Q609-L613 WeakPolarHBondContact O-CB 3.41Å; Q609-L613 PolarHBondContact O-N 3.44Å; R610-L613 WeakPolarHBondContact O-CB 3.48Å; R610-L613 PolarHBondContact O-N 3.49Å; L611-L613 VanDerWaalsContact C-N 3.35Å; L613-N615 VanDerWaalsContact C-N 3.26Å; L613-N615 PolarHBondContact O-N 3.24Å; L613-A616 PolarHBondContact O-N 3.48Å; L613-V617 WeakPolarHBondContact O-CG2 3.45Å; L613-V617 PolarHBondContact O-N 2.95Å
614	E	89.8	Confident	82	Confident	81 Å²	81	80 Å²	80	38%	0.379	41%	0.414	S	S	.	.	H	α-helix	trans	-59.2	-39.4	179	-72.9	173.3	-176.7	0	0	110.8	R610 L618	R610-E614 IonicContact CZ-OE1 3.1Å; R610-E614 VanDerWaalsContact CZ-OE1 3.3Å; R610-E614 IonicContact NE-OE1 3.63Å; R610-E614 PolarHBondContact NE-OE1 3.2Å; R610-E614 IonicContact NH2-OE1 2.66Å; R610-E614 PolarHBondContact NH2-OE1 2.99Å; R610-E614 WeakPolarHBondContact O-CB 3.47Å; R610-E614 WeakPolarHBondContact O-CG 3.3Å; R610-E614 PolarHBondContact O-N 2.85Å; E614-L618 WeakPolarHBondContact O-CG 3.38Å; E614-L618 PolarHBondContact O-N 3.07Å; E614-L618 VanDerWaalsContact O-N 3.14Å
615	N	92.4	Very high	84.3	Confident	98 Å²	98	81.2 Å²	81.2	52%	0.524	41%	0.413	S	S	.	.	H	α-helix	trans	-67.6	-37.9	172.9	-179.8	63.6	0	0	0	113.2	L611 L613 L618 M619	L611-N615 WeakPolarHBondContact O-CB 3.41Å; L611-N615 PolarHBondContact O-N 3.27Å; L613-N615 VanDerWaalsContact C-N 3.26Å; L613-N615 PolarHBondContact O-N 3.24Å; N615-L618 PolarHBondContact O-N 2.62Å; N615-M619 WeakPolarHBondContact O-CB 3.36Å; N615-M619 WeakPolarHBondContact O-CG 3.41Å; N615-M619 PolarHBondContact O-N 3.05Å
616	A	92.3	Very high	86.4	Confident	9 Å²	9	74.7 Å²	74.7	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-67.7	-37.3	176.4	0	0	0	0	0	112.6	L416 I419 D612 L613 M619 Q620	L416-A616 HydrophobicContact CB-CB 4.38Å; L416-A616 HydrophobicContact CD1-CB 3.76Å; I419-A616 HydrophobicContact CD1-CB 3.66Å; D612-A616 VanDerWaalsContact O-CB 3.31Å; D612-A616 WeakPolarHBondContact O-CB 3.32Å; D612-A616 PolarHBondContact O-N 2.93Å; L613-A616 PolarHBondContact O-N 3.48Å; A616-M619 PolarHBondContact O-N 3.21Å; A616-Q620 PolarHBondContact O-N 3.15Å
617	V	94.6	Very high	88.2	Confident	53 Å²	53	74.2 Å²	74.2	32%	0.321	38%	0.377	S	S	.	.	H	α-helix	trans	-62.9	-50.5	172.7	173.7	0	0	0	0	110.5	L416 L613 M619 Q620 E621	L416-V617 HydrophobicContact CD1-CG2 3.7Å; L416-V617 HydrophobicContact CD2-CG2 4.06Å; L613-V617 WeakPolarHBondContact O-CG2 3.45Å; L613-V617 PolarHBondContact O-N 2.95Å; V617-M619 VanDerWaalsContact C-N 3.26Å; V617-M619 PolarHBondContact O-N 3.01Å; V617-Q620 PolarHBondContact O-N 3.22Å; V617-E621 HydrophobicContact CG1-CG 4.47Å; V617-E621 PolarHBondContact O-N 3.33Å
618	L	94.8	Very high	89.8	Confident	108 Å²	108	75.8 Å²	75.8	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-58.8	-37.4	176.9	-71.4	169.5	0	0	0	112.4	E614 N615 L622	E614-L618 WeakPolarHBondContact O-CG 3.38Å; E614-L618 PolarHBondContact O-N 3.07Å; E614-L618 VanDerWaalsContact O-N 3.14Å; N615-L618 PolarHBondContact O-N 2.62Å; L618-L622 VanDerWaalsContact O-CB 3.28Å; L618-L622 WeakPolarHBondContact O-CB 3.21Å; L618-L622 PolarHBondContact O-N 3.46Å
619	M	93.2	Very high	91.1	Very high	83 Å²	83	77 Å²	77	41%	0.409	38%	0.38	S	S	.	.	H	α-helix	trans	-66.6	-40.1	173.4	-79.5	-63.8	-58.6	0	0	112.3	N615 A616 V617 L622 M623	N615-M619 WeakPolarHBondContact O-CB 3.36Å; N615-M619 WeakPolarHBondContact O-CG 3.41Å; N615-M619 PolarHBondContact O-N 3.05Å; A616-M619 PolarHBondContact O-N 3.21Å; V617-M619 VanDerWaalsContact C-N 3.26Å; V617-M619 PolarHBondContact O-N 3.01Å; M619-L622 PolarHBondContact O-N 2.83Å; M619-L622 HydrophobicContact SD-CD2 4.48Å; M619-M623 HydrophobicContact CE-CE 4.22Å; M619-M623 WeakPolarHBondContact O-CG 3.39Å; M619-M623 PolarHBondContact O-N 3.02Å
620	Q	95.2	Very high	92.1	Very high	46 Å²	46	73.8 Å²	73.8	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-47.8	175.5	-164.7	-161.5	-16.6	0	0	111.5	H409 Q413 A616 V617 L622 M623 A624	H409-Q620 PolarHBondContact NE2-NE2 2.91Å; Q413-Q620 HydrophobicContact CB-CG 4.47Å; A616-Q620 PolarHBondContact O-N 3.15Å; V617-Q620 PolarHBondContact O-N 3.22Å; Q620-L622 VanDerWaalsContact C-N 3.29Å; Q620-L622 PolarHBondContact O-N 2.71Å; Q620-M623 PolarHBondContact O-N 3.44Å; Q620-M623 VanDerWaalsContact O-N 3.15Å; Q620-A624 WeakPolarHBondContact O-CB 3.24Å; Q620-A624 PolarHBondContact O-N 2.9Å
621	E	95.5	Very high	92.8	Very high	110 Å²	110	69.3 Å²	69.3	51%	0.514	35%	0.351	S	S	.	.	H	α-helix	trans	-57	-42.9	176.5	-69.7	179.3	167.2	0	0	111.5	V617 A624 M625	V617-E621 HydrophobicContact CG1-CG 4.47Å; V617-E621 PolarHBondContact O-N 3.33Å; E621-A624 PolarHBondContact O-N 3.48Å; E621-M625 WeakPolarHBondContact O-CG 3.5Å; E621-M625 PolarHBondContact O-N 3.45Å
622	L	96.3	Very high	93.5	Very high	87 Å²	87	68.8 Å²	68.8	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.7	-173.7	66.7	0	0	0	112.6	L618 M619 Q620 M625 K626	L618-L622 VanDerWaalsContact O-CB 3.28Å; L618-L622 WeakPolarHBondContact O-CB 3.21Å; L618-L622 PolarHBondContact O-N 3.46Å; M619-L622 PolarHBondContact O-N 2.83Å; M619-L622 HydrophobicContact SD-CD2 4.48Å; Q620-L622 VanDerWaalsContact C-N 3.29Å; Q620-L622 PolarHBondContact O-N 2.71Å; L622-M625 HydrophobicContact CD1-CE 4.4Å; L622-K626 PolarHBondContact O-N 2.79Å; L622-K626 VanDerWaalsContact O-N 3.13Å
623	M	96.1	Very high	93.9	Very high	11 Å²	11	68.6 Å²	68.6	5%	0.054	34%	0.343	C	S	.	.	H	α-helix	trans	-76.1	-31.6	177.4	-61.4	-50.5	87.7	0	0	112.3	E408 H409 M619 Q620 K626 E627	E408-M623 HydrophobicContact CB-CG 4.43Å; E408-M623 HydrophobicContact CB-SD 3.98Å; H409-M623 HydrophobicContact CB-CB 3.92Å; M619-M623 HydrophobicContact CE-CE 4.22Å; M619-M623 WeakPolarHBondContact O-CG 3.39Å; M619-M623 PolarHBondContact O-N 3.02Å; Q620-M623 PolarHBondContact O-N 3.44Å; Q620-M623 VanDerWaalsContact O-N 3.15Å; M623-K626 HydrophobicContact CE-CD 3.8Å; M623-K626 HydrophobicContact CE-CG 4.47Å; M623-K626 WeakPolarHBondContact O-CB 3.43Å; M623-K626 PolarHBondContact O-N 3.38Å; M623-K626 HydrophobicContact SD-CD 3.77Å; M623-K626 PolarHBondContact SD-NZ 2.62Å; M623-E627 PolarHBondContact O-N 2.82Å
624	A	94.7	Very high	94.1	Very high	24 Å²	24	67.2 Å²	67.2	20%	0.198	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-47.7	171.9	0	0	0	0	0	110.9	Q620 E621 K626 E627 E628	Q620-A624 WeakPolarHBondContact O-CB 3.24Å; Q620-A624 PolarHBondContact O-N 2.9Å; E621-A624 PolarHBondContact O-N 3.48Å; A624-K626 VanDerWaalsContact C-N 3.29Å; A624-K626 PolarHBondContact O-N 2.85Å; A624-E627 WeakPolarHBondContact O-CB 3.35Å; A624-E627 PolarHBondContact O-N 3.05Å; A624-E627 VanDerWaalsContact O-N 3.09Å; A624-E628 PolarHBondContact O-N 3.07Å
625	M	95.1	Very high	94.2	Very high	114 Å²	114	67.9 Å²	67.9	56%	0.562	34%	0.341	S	S	*	.	H	α-helix	trans	-61.9	-33.4	173.8	-72.7	-170.7	-68.6	0	0	113	E621 L622 M629	E621-M625 WeakPolarHBondContact O-CG 3.5Å; E621-M625 PolarHBondContact O-N 3.45Å; L622-M625 HydrophobicContact CD1-CE 4.4Å; M625-M629 VanDerWaalsContact O-CB 3.3Å; M625-M629 WeakPolarHBondContact O-CB 3.4Å; M625-M629 PolarHBondContact O-N 2.94Å
626	K	94.2	Very high	94.2	Very high	71 Å²	71	68.5 Å²	68.5	31%	0.309	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-44.8	170.6	-80.4	-176.1	180	172.1	0	111.9	E408 L622 M623 A624 M629 A630	E408-K626 IonicContact OE2-NZ 2.66Å; E408-K626 PolarHBondContact OE2-NZ 3.28Å; L622-K626 PolarHBondContact O-N 2.79Å; L622-K626 VanDerWaalsContact O-N 3.13Å; M623-K626 HydrophobicContact CE-CD 3.8Å; M623-K626 HydrophobicContact CE-CG 4.47Å; M623-K626 WeakPolarHBondContact O-CB 3.43Å; M623-K626 PolarHBondContact O-N 3.38Å; M623-K626 HydrophobicContact SD-CD 3.77Å; M623-K626 PolarHBondContact SD-NZ 2.62Å; A624-K626 VanDerWaalsContact C-N 3.29Å; A624-K626 PolarHBondContact O-N 2.85Å; K626-M629 PolarHBondContact O-N 3.26Å; K626-A630 WeakPolarHBondContact O-CB 3.47Å; K626-A630 PolarHBondContact O-N 2.95Å
627	E	95.8	Very high	94.3	Very high	34 Å²	34	70.1 Å²	70.1	16%	0.159	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-50.1	178.7	-171.7	-172.2	142.6	0	0	110.5	R406 H409 M623 A624 M629 A630 E631	R406-E627 HydrophobicContact CB-CG 4.47Å; R406-E627 VanDerWaalsContact CD-OE1 3.23Å; R406-E627 WeakPolarHBondContact CD-OE1 3.4Å; R406-E627 WeakPolarHBondContact CD-OE2 3.49Å; R406-E627 IonicContact CZ-OE1 2.61Å; R406-E627 IonicContact CZ-OE2 2.78Å; R406-E627 IonicContact NE-OE1 2.76Å; R406-E627 IonicContact NE-OE2 3.49Å; R406-E627 IonicContact NH1-OE1 3.56Å; R406-E627 PolarHBondContact NH1-OE1 3.03Å; R406-E627 IonicContact NH1-OE2 3.76Å; R406-E627 PolarHBondContact NH1-OE2 3.32Å; H409-E627 HydrophobicContact CB-CB 4.47Å; H409-E627 WeakPolarHBondContact CB-OE2 3.5Å; H409-E627 IonicContact CE1-OE2 2.62Å; H409-E627 IonicContact CG-OE2 2.66Å; H409-E627 IonicContact ND1-OE2 2.6Å; H409-E627 PolarHBondContact ND1-OE2 3.34Å; M623-E627 PolarHBondContact O-N 2.82Å; A624-E627 WeakPolarHBondContact O-CB 3.35Å; A624-E627 PolarHBondContact O-N 3.05Å; A624-E627 VanDerWaalsContact O-N 3.09Å; E627-M629 VanDerWaalsContact C-N 3.32Å; E627-M629 PolarHBondContact O-N 2.84Å; E627-A630 PolarHBondContact O-N 3.29Å; E627-A630 VanDerWaalsContact O-N 3.11Å; E627-E631 WeakPolarHBondContact O-CB 3.34Å; E627-E631 PolarHBondContact O-N 3.05Å
628	E	94.3	Very high	94.2	Very high	129 Å²	129	72.2 Å²	72.2	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-58	-43.1	176	-69.4	-178.4	173.3	0	0	112	A624 A630 E631 L632	A624-E628 PolarHBondContact O-N 3.07Å; E628-A630 PolarHBondContact O-N 3.48Å; E628-E631 PolarHBondContact O-N 2.93Å; E628-L632 VanDerWaalsContact O-CB 3.32Å; E628-L632 WeakPolarHBondContact O-CB 3.48Å; E628-L632 VanDerWaalsContact O-CG 3.23Å; E628-L632 WeakPolarHBondContact O-CG 3.46Å; E628-L632 PolarHBondContact O-N 3.21Å
629	M	94.4	Very high	94	Very high	98 Å²	98	72.1 Å²	72.1	48%	0.483	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-40.6	175.3	-178.6	-176	62.4	0	0	112.4	M625 K626 E627 K633	M625-M629 VanDerWaalsContact O-CB 3.3Å; M625-M629 WeakPolarHBondContact O-CB 3.4Å; M625-M629 PolarHBondContact O-N 2.94Å; K626-M629 PolarHBondContact O-N 3.26Å; E627-M629 VanDerWaalsContact C-N 3.32Å; E627-M629 PolarHBondContact O-N 2.84Å; M629-K633 WeakPolarHBondContact O-CG 3.08Å; M629-K633 PolarHBondContact O-N 3.37Å
630	A	91.6	Very high	94	Very high	2 Å²	2	73.1 Å²	73.1	2%	0.017	36%	0.36	C	S	.	.	H	α-helix	trans	-73.3	-37.2	179.5	0	0	0	0	0	112.4	E401 K626 E627 E628 K633 A634	E401-A630 HydrophobicContact CG-CB 4.39Å; K626-A630 WeakPolarHBondContact O-CB 3.47Å; K626-A630 PolarHBondContact O-N 2.95Å; E627-A630 PolarHBondContact O-N 3.29Å; E627-A630 VanDerWaalsContact O-N 3.11Å; E628-A630 PolarHBondContact O-N 3.48Å; A630-K633 WeakPolarHBondContact O-CB 3.19Å; A630-K633 PolarHBondContact O-N 2.97Å; A630-A634 PolarHBondContact O-N 3.25Å
631	E	93.6	Very high	93.9	Very high	63 Å²	63	75 Å²	75	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-43.1	173.4	-160.2	69.7	-155	0	0	110.8	R402 E627 E628 A634 Q635	R402-E631 WeakPolarHBondContact CD-OE2 3.32Å; R402-E631 WeakPolarHBondContact CG-OE2 3.42Å; R402-E631 IonicContact CZ-OE2 3.67Å; R402-E631 IonicContact NE-OE2 2.66Å; R402-E631 IonicContact NH1-OE1 3.54Å; R402-E631 PolarHBondContact NH1-OE1 2.82Å; R402-E631 IonicContact NH1-OE2 3.45Å; R402-E631 PolarHBondContact NH1-OE2 2.89Å; E627-E631 WeakPolarHBondContact O-CB 3.34Å; E627-E631 PolarHBondContact O-N 3.05Å; E628-E631 PolarHBondContact O-N 2.93Å; E631-A634 PolarHBondContact O-N 2.89Å; E631-Q635 WeakPolarHBondContact O-CG 3.44Å; E631-Q635 PolarHBondContact O-N 3.43Å
632	L	94.9	Very high	93.8	Very high	98 Å²	98	75.7 Å²	75.7	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-64.2	-39.7	173.8	-74.2	170.1	0	0	0	112.5	E628 A634 Q635 L636	E628-L632 VanDerWaalsContact O-CB 3.32Å; E628-L632 WeakPolarHBondContact O-CB 3.48Å; E628-L632 VanDerWaalsContact O-CG 3.23Å; E628-L632 WeakPolarHBondContact O-CG 3.46Å; E628-L632 PolarHBondContact O-N 3.21Å; L632-A634 VanDerWaalsContact C-N 3.31Å; L632-A634 PolarHBondContact O-N 3.13Å; L632-Q635 PolarHBondContact O-N 3.5Å; L632-L636 WeakPolarHBondContact O-CB 3.39Å; L632-L636 VanDerWaalsContact O-CG 3.29Å; L632-L636 WeakPolarHBondContact O-CG 3.33Å; L632-L636 PolarHBondContact O-N 3.27Å
633	K	93.9	Very high	93.7	Very high	83 Å²	83	77.5 Å²	77.5	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-58.1	-43.4	171.4	-79.4	172.9	171.2	-169.4	0	111.7	E401 M629 A630 L636 Y637	E401-K633 IonicContact OE1-NZ 2.69Å; E401-K633 PolarHBondContact OE1-NZ 3.39Å; E401-K633 WeakPolarHBondContact OE2-CD 3.39Å; E401-K633 IonicContact OE2-NZ 2.67Å; E401-K633 PolarHBondContact OE2-NZ 3.28Å; M629-K633 WeakPolarHBondContact O-CG 3.08Å; M629-K633 PolarHBondContact O-N 3.37Å; A630-K633 WeakPolarHBondContact O-CB 3.19Å; A630-K633 PolarHBondContact O-N 2.97Å; K633-L636 PolarHBondContact O-N 3.22Å; K633-Y637 WeakPolarHBondContact O-CB 3.23Å; K633-Y637 PolarHBondContact O-N 2.88Å
634	A	93.1	Very high	93.6	Very high	9 Å²	9	81.6 Å²	81.6	7%	0.074	39%	0.392	C	S	.	.	H	α-helix	trans	-65.6	-43.7	178.9	0	0	0	0	0	112.2	V398 R402 A630 E631 L632 Y637 L638	V398-A634 HydrophobicContact CG1-CB 3.72Å; R402-A634 HydrophobicContact CG-CB 4.43Å; A630-A634 PolarHBondContact O-N 3.25Å; E631-A634 PolarHBondContact O-N 2.89Å; L632-A634 VanDerWaalsContact C-N 3.31Å; L632-A634 PolarHBondContact O-N 3.13Å; A634-Y637 PolarHBondContact O-N 3.47Å; A634-L638 WeakPolarHBondContact O-CG 3.47Å; A634-L638 PolarHBondContact O-N 2.97Å
635	Q	93.3	Very high	93.6	Very high	96 Å²	96	82.6 Å²	82.6	45%	0.449	40%	0.4	S	S	.	.	H	α-helix	trans	-62.3	-44.1	174.6	-68.3	173.1	22.7	0	0	112	E631 L632 Y637 L638 L639	E631-Q635 WeakPolarHBondContact O-CG 3.44Å; E631-Q635 PolarHBondContact O-N 3.43Å; L632-Q635 PolarHBondContact O-N 3.5Å; Q635-Y637 PolarHBondContact O-N 3.21Å; Q635-L638 PolarHBondContact O-N 2.75Å; Q635-L639 WeakPolarHBondContact O-CG 3.44Å; Q635-L639 PolarHBondContact O-N 3.14Å
636	L	91.9	Very high	93.5	Very high	110 Å²	110	82.3 Å²	82.3	58%	0.576	40%	0.401	S	S	*	.	H	α-helix	trans	-60.7	-41.9	175	-75.3	169.5	0	0	0	112.2	L632 K633 L639 E640	L632-L636 WeakPolarHBondContact O-CB 3.39Å; L632-L636 VanDerWaalsContact O-CG 3.29Å; L632-L636 WeakPolarHBondContact O-CG 3.33Å; L632-L636 PolarHBondContact O-N 3.27Å; K633-L636 PolarHBondContact O-N 3.22Å; L636-L639 PolarHBondContact O-N 3.45Å; L636-E640 WeakPolarHBondContact O-CB 3.25Å; L636-E640 PolarHBondContact O-N 3.26Å
637	Y	94.1	Very high	93.6	Very high	43 Å²	43	83.5 Å²	83.5	17%	0.169	41%	0.407	C	S	.	.	H	α-helix	trans	-61.8	-43.4	176.6	179.4	-88.4	0	0	0	112.2	S391 R394 E395 V398 K633 A634 Q635 E640 K641	S391-Y637 PolarHBondContact O-OH 3.26Å; S391-Y637 VanDerWaalsContact O-OH 3.11Å; S391-Y637 PolarHBondContact OG-OH 3.34Å; R394-Y637 HydrophobicContact CB-CE2 3.8Å; E395-Y637 HydrophobicContact CG-CE1 3.51Å; V398-Y637 HydrophobicContact CG2-CD2 4.27Å; V398-Y637 HydrophobicContact CG2-CG 4.29Å; K633-Y637 WeakPolarHBondContact O-CB 3.23Å; K633-Y637 PolarHBondContact O-N 2.88Å; A634-Y637 PolarHBondContact O-N 3.47Å; Q635-Y637 PolarHBondContact O-N 3.21Å; Y637-E640 PolarHBondContact O-N 3.14Å; Y637-K641 HydrophobicContact CE1-CD 4.29Å; Y637-K641 WeakPolarHBondContact O-CB 3.41Å; Y637-K641 PolarHBondContact O-N 2.84Å
638	L	91.5	Very high	93.6	Very high	97 Å²	97	87.7 Å²	87.7	51%	0.508	43%	0.43	S	S	.	.	H	α-helix	trans	-64.2	-47.4	176.6	-69.1	172.9	0	0	0	111.7	A634 Q635 E640 K641 E642	A634-L638 WeakPolarHBondContact O-CG 3.47Å; A634-L638 PolarHBondContact O-N 2.97Å; Q635-L638 PolarHBondContact O-N 2.75Å; L638-E640 VanDerWaalsContact C-N 3.33Å; L638-E640 PolarHBondContact O-N 3.06Å; L638-K641 WeakPolarHBondContact O-CB 3.47Å; L638-K641 PolarHBondContact O-N 2.93Å; L638-K641 VanDerWaalsContact O-N 3.09Å; L638-E642 PolarHBondContact O-N 2.84Å
639	L	92.2	Very high	93.8	Very high	107 Å²	107	88 Å²	88	56%	0.56	43%	0.429	S	S	*	.	H	α-helix	trans	-62.2	-38.1	177.2	-70.4	169.8	0	0	0	112.3	Q635 L636 K643	Q635-L639 WeakPolarHBondContact O-CG 3.44Å; Q635-L639 PolarHBondContact O-N 3.14Å; L636-L639 PolarHBondContact O-N 3.45Å; L639-K643 VanDerWaalsContact O-CB 3.24Å; L639-K643 WeakPolarHBondContact O-CB 3.38Å; L639-K643 PolarHBondContact O-N 3.44Å
640	E	93.3	Very high	93.9	Very high	103 Å²	103	88.3 Å²	88.3	48%	0.481	43%	0.433	S	S	.	.	H	α-helix	trans	-64	-38.5	172.2	-89.2	-161.1	-150.9	0	0	112.8	L636 Y637 L638 K644	L636-E640 WeakPolarHBondContact O-CB 3.25Å; L636-E640 PolarHBondContact O-N 3.26Å; Y637-E640 PolarHBondContact O-N 3.14Å; L638-E640 VanDerWaalsContact C-N 3.33Å; L638-E640 PolarHBondContact O-N 3.06Å; E640-K644 WeakPolarHBondContact O-CB 3.45Å; E640-K644 VanDerWaalsContact O-CD 3.26Å; E640-K644 WeakPolarHBondContact O-CD 3.42Å; E640-K644 VanDerWaalsContact O-CG 3.23Å; E640-K644 WeakPolarHBondContact O-CG 3.28Å; E640-K644 PolarHBondContact O-N 2.9Å; E640-K644 IonicContact OE2-NZ 3.43Å; E640-K644 PolarHBondContact OE2-NZ 3Å
641	K	92.3	Very high	94.2	Very high	87 Å²	87	91.4 Å²	91.4	38%	0.378	45%	0.454	S	S	.	.	H	α-helix	trans	-67.9	-43.5	177.8	178.7	175.8	172.8	175.2	0	111.2	E395 Y637 L638 A645	E395-K641 IonicContact OE1-NZ 3.41Å; E395-K641 PolarHBondContact OE1-NZ 3.47Å; E395-K641 IonicContact OE2-NZ 3.64Å; E395-K641 PolarHBondContact OE2-NZ 3.21Å; Y637-K641 HydrophobicContact CE1-CD 4.29Å; Y637-K641 WeakPolarHBondContact O-CB 3.41Å; Y637-K641 PolarHBondContact O-N 2.84Å; L638-K641 WeakPolarHBondContact O-CB 3.47Å; L638-K641 PolarHBondContact O-N 2.93Å; L638-K641 VanDerWaalsContact O-N 3.09Å; K641-A645 WeakPolarHBondContact O-CB 3.38Å; K641-A645 PolarHBondContact O-N 3.3Å
642	E	92.8	Very high	94.3	Very high	123 Å²	123	92.1 Å²	92.1	58%	0.575	46%	0.463	S	S	*	.	H	α-helix	trans	-64.5	-46	174.5	-71.4	-175	170.2	0	0	112	L638 K644 A645 L646	L638-E642 PolarHBondContact O-N 2.84Å; E642-K644 PolarHBondContact O-N 3.05Å; E642-A645 WeakPolarHBondContact O-CB 3.3Å; E642-A645 PolarHBondContact O-N 3.5Å; E642-A645 VanDerWaalsContact O-N 3.15Å; E642-L646 WeakPolarHBondContact O-CG 3.33Å; E642-L646 PolarHBondContact O-N 2.7Å
643	K	94.1	Very high	94.3	Very high	126 Å²	126	95.5 Å²	95.5	55%	0.548	47%	0.469	S	S	.	.	H	α-helix	trans	-53.4	-52.1	174.3	173.8	174.7	169.7	174.8	0	111.5	L639 A645 L646 E647	L639-K643 VanDerWaalsContact O-CB 3.24Å; L639-K643 WeakPolarHBondContact O-CB 3.38Å; L639-K643 PolarHBondContact O-N 3.44Å; K643-A645 VanDerWaalsContact C-N 3.29Å; K643-A645 PolarHBondContact O-N 2.84Å; K643-L646 WeakPolarHBondContact O-CB 3.39Å; K643-L646 PolarHBondContact O-N 2.67Å; K643-E647 WeakPolarHBondContact CE-OE1 3.42Å; K643-E647 HydrophobicContact CG-CG 4.35Å; K643-E647 IonicContact NZ-OE1 2.78Å; K643-E647 WeakPolarHBondContact O-CG 3.41Å; K643-E647 PolarHBondContact O-N 2.92Å
644	K	94.7	Very high	94.5	Very high	96 Å²	96	96.5 Å²	96.5	42%	0.417	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-35.7	179.3	-69.4	159.9	-164.5	161.2	0	112.2	E640 E642 E647 L648	E640-K644 WeakPolarHBondContact O-CB 3.45Å; E640-K644 VanDerWaalsContact O-CD 3.26Å; E640-K644 WeakPolarHBondContact O-CD 3.42Å; E640-K644 VanDerWaalsContact O-CG 3.23Å; E640-K644 WeakPolarHBondContact O-CG 3.28Å; E640-K644 PolarHBondContact O-N 2.9Å; E640-K644 IonicContact OE2-NZ 3.43Å; E640-K644 PolarHBondContact OE2-NZ 3Å; E642-K644 PolarHBondContact O-N 3.05Å; K644-E647 WeakPolarHBondContact CA-OE2 3.41Å; K644-L648 WeakPolarHBondContact O-CG 3.48Å; K644-L648 PolarHBondContact O-N 3.29Å; K644-L648 VanDerWaalsContact O-N 3.08Å
645	A	93.6	Very high	94.6	Very high	45 Å²	45	99.1 Å²	99.1	37%	0.372	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-31.5	174.4	0	0	0	0	0	113.1	K641 E642 K643 K649	K641-A645 WeakPolarHBondContact O-CB 3.38Å; K641-A645 PolarHBondContact O-N 3.3Å; E642-A645 WeakPolarHBondContact O-CB 3.3Å; E642-A645 PolarHBondContact O-N 3.5Å; E642-A645 VanDerWaalsContact O-N 3.15Å; K643-A645 VanDerWaalsContact C-N 3.29Å; K643-A645 PolarHBondContact O-N 2.84Å; A645-K649 WeakPolarHBondContact O-CD 3.49Å; A645-K649 VanDerWaalsContact O-CG 3.26Å; A645-K649 WeakPolarHBondContact O-CG 3.5Å; A645-K649 PolarHBondContact O-N 2.84Å
646	L	94.6	Very high	94.8	Very high	109 Å²	109	98 Å²	98	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-75	-41.2	173	-69.4	170.4	0	0	0	112	E642 K643 L648 K649 L650	E642-L646 WeakPolarHBondContact O-CG 3.33Å; E642-L646 PolarHBondContact O-N 2.7Å; K643-L646 WeakPolarHBondContact O-CB 3.39Å; K643-L646 PolarHBondContact O-N 2.67Å; L646-L648 VanDerWaalsContact C-N 3.34Å; L646-L648 PolarHBondContact O-N 3.47Å; L646-K649 HydrophobicContact CD2-CD 4.38Å; L646-K649 WeakPolarHBondContact O-CB 3.22Å; L646-K649 PolarHBondContact O-N 3.06Å; L646-K649 VanDerWaalsContact O-N 3.15Å; L646-L650 WeakPolarHBondContact O-CB 3.47Å; L646-L650 PolarHBondContact O-N 2.79Å
647	E	96.7	Very high	95	Very high	95 Å²	95	98.7 Å²	98.7	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-58	-44	174.1	-71.9	169.5	155.5	0	0	111.4	K643 K644 L650 S651	K643-E647 WeakPolarHBondContact CE-OE1 3.42Å; K643-E647 HydrophobicContact CG-CG 4.35Å; K643-E647 IonicContact NZ-OE1 2.78Å; K643-E647 WeakPolarHBondContact O-CG 3.41Å; K643-E647 PolarHBondContact O-N 2.92Å; K644-E647 WeakPolarHBondContact CA-OE2 3.41Å; E647-L650 PolarHBondContact O-N 3.31Å; E647-S651 WeakPolarHBondContact O-CB 3.48Å; E647-S651 PolarHBondContact O-N 3.49Å
648	L	95.9	Very high	95.1	Very high	122 Å²	122	102.4 Å²	102.4	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-65.2	-37.9	174.6	-72.4	169.9	0	0	0	112.9	K644 L646 T652	K644-L648 WeakPolarHBondContact O-CG 3.48Å; K644-L648 PolarHBondContact O-N 3.29Å; K644-L648 VanDerWaalsContact O-N 3.08Å; L646-L648 VanDerWaalsContact C-N 3.34Å; L646-L648 PolarHBondContact O-N 3.47Å; L648-T652 WeakPolarHBondContact O-CB 3.28Å; L648-T652 PolarHBondContact O-N 2.88Å; L648-T652 PolarHBondContact O-OG1 2.77Å
649	K	97.3	Very high	95.4	Very high	136 Å²	136	100.7 Å²	100.7	59%	0.591	51%	0.51	S	S	*	.	H	α-helix	trans	-65.4	-42	174.2	-75.5	167.6	-177.5	175.4	0	111.5	A645 L646 T652 R653	A645-K649 WeakPolarHBondContact O-CD 3.49Å; A645-K649 VanDerWaalsContact O-CG 3.26Å; A645-K649 WeakPolarHBondContact O-CG 3.5Å; A645-K649 PolarHBondContact O-N 2.84Å; L646-K649 HydrophobicContact CD2-CD 4.38Å; L646-K649 WeakPolarHBondContact O-CB 3.22Å; L646-K649 PolarHBondContact O-N 3.06Å; L646-K649 VanDerWaalsContact O-N 3.15Å; K649-T652 PolarHBondContact O-N 2.95Å; K649-R653 WeakPolarHBondContact O-CG 3.42Å; K649-R653 PolarHBondContact O-N 2.83Å; K649-R653 VanDerWaalsContact O-N 3.1Å
650	L	96.1	Very high	95.6	Very high	105 Å²	105	102.8 Å²	102.8	55%	0.55	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-52.5	177.2	-177.5	65.3	0	0	0	110.5	L646 E647 T652 R653 E654	L646-L650 WeakPolarHBondContact O-CB 3.47Å; L646-L650 PolarHBondContact O-N 2.79Å; E647-L650 PolarHBondContact O-N 3.31Å; L650-T652 PolarHBondContact O-N 3Å; L650-R653 CarbonylContact O-C 3.59Å; L650-R653 WeakPolarHBondContact O-CA 3.4Å; L650-R653 WeakPolarHBondContact O-CB 3.37Å; L650-R653 PolarHBondContact O-N 3.08Å; L650-E654 WeakPolarHBondContact O-CG 3.28Å; L650-E654 PolarHBondContact O-N 3.03Å
651	S	97.6	Very high	95.8	Very high	66 Å²	66	102 Å²	102	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-33.9	177.5	-172	0	0	0	0	113	E647 R653 E654 A655	E647-S651 WeakPolarHBondContact O-CB 3.48Å; E647-S651 PolarHBondContact O-N 3.49Å; S651-R653 VanDerWaalsContact C-N 3.34Å; S651-R653 PolarHBondContact O-N 2.94Å; S651-E654 WeakPolarHBondContact CA-OE2 3.48Å; S651-E654 PolarHBondContact O-N 3.33Å; S651-A655 WeakPolarHBondContact O-CB 3.25Å; S651-A655 PolarHBondContact O-N 3.28Å
652	T	96.9	Very high	96	Very high	79 Å²	79	101.7 Å²	101.7	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-65.8	-34.4	172.3	-56.6	0	0	0	0	112.3	L648 K649 L650 Q656	L648-T652 WeakPolarHBondContact O-CB 3.28Å; L648-T652 PolarHBondContact O-N 2.88Å; L648-T652 PolarHBondContact O-OG1 2.77Å; K649-T652 PolarHBondContact O-N 2.95Å; L650-T652 PolarHBondContact O-N 3Å; T652-Q656 VanDerWaalsContact O-CG 3.29Å; T652-Q656 WeakPolarHBondContact O-CG 3.42Å; T652-Q656 PolarHBondContact O-N 2.87Å; T652-Q656 VanDerWaalsContact O-N 3.16Å
653	R	95.2	Very high	96.1	Very high	169 Å²	169	100.8 Å²	100.8	64%	0.638	51%	0.511	S	S	*	.	H	α-helix	trans	-74.3	-42.3	174.7	-69.3	-55.7	-163.3	174	8.1	112.3	K649 L650 S651 A655 Q656 E657	K649-R653 WeakPolarHBondContact O-CG 3.42Å; K649-R653 PolarHBondContact O-N 2.83Å; K649-R653 VanDerWaalsContact O-N 3.1Å; L650-R653 CarbonylContact O-C 3.59Å; L650-R653 WeakPolarHBondContact O-CA 3.4Å; L650-R653 WeakPolarHBondContact O-CB 3.37Å; L650-R653 PolarHBondContact O-N 3.08Å; S651-R653 VanDerWaalsContact C-N 3.34Å; S651-R653 PolarHBondContact O-N 2.94Å; R653-A655 VanDerWaalsContact C-N 3.29Å; R653-A655 PolarHBondContact O-N 2.83Å; R653-Q656 WeakPolarHBondContact O-CB 3.44Å; R653-Q656 PolarHBondContact O-N 2.75Å; R653-Q656 VanDerWaalsContact O-N 3.11Å; R653-E657 PolarHBondContact O-N 3.01Å
654	E	96.9	Very high	96.2	Very high	104 Å²	104	98.6 Å²	98.6	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-57.3	-43.4	173.6	-66.3	167.8	167.8	0	0	111	L650 S651 E657 Q658	L650-E654 WeakPolarHBondContact O-CG 3.28Å; L650-E654 PolarHBondContact O-N 3.03Å; S651-E654 WeakPolarHBondContact CA-OE2 3.48Å; S651-E654 PolarHBondContact O-N 3.33Å; E654-E657 PolarHBondContact O-N 3.22Å; E654-Q658 WeakPolarHBondContact O-CB 3.49Å; E654-Q658 PolarHBondContact O-N 3.25Å
655	A	96.4	Very high	96.3	Very high	63 Å²	63	100.1 Å²	100.1	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-66	-35.8	175.3	0	0	0	0	0	113.2	S651 R653 A659	S651-A655 WeakPolarHBondContact O-CB 3.25Å; S651-A655 PolarHBondContact O-N 3.28Å; R653-A655 VanDerWaalsContact C-N 3.29Å; R653-A655 PolarHBondContact O-N 2.83Å; A655-A659 WeakPolarHBondContact O-CB 3.35Å; A655-A659 PolarHBondContact O-N 2.83Å; A655-A659 VanDerWaalsContact O-N 3.1Å
656	Q	96.3	Very high	96.3	Very high	73 Å²	73	103.7 Å²	103.7	34%	0.341	52%	0.522	S	S	.	.	H	α-helix	trans	-66.8	-45.1	172.8	-76.4	171.9	3.5	0	0	111.5	T652 R653 A659 Y660	T652-Q656 VanDerWaalsContact O-CG 3.29Å; T652-Q656 WeakPolarHBondContact O-CG 3.42Å; T652-Q656 PolarHBondContact O-N 2.87Å; T652-Q656 VanDerWaalsContact O-N 3.16Å; R653-Q656 WeakPolarHBondContact O-CB 3.44Å; R653-Q656 PolarHBondContact O-N 2.75Å; R653-Q656 VanDerWaalsContact O-N 3.11Å; Q656-A659 PolarHBondContact O-N 3.36Å; Q656-Y660 HydrophobicContact CB-CE2 4.26Å; Q656-Y660 WeakPolarHBondContact O-CD2 3.45Å; Q656-Y660 PolarHBondContact O-N 3.24Å
657	E	96.4	Very high	96.4	Very high	125 Å²	125	102 Å²	102	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-59.1	-48.7	176.5	-176	174.1	173.1	0	0	111.2	R653 E654 A659 Y660 L661	R653-E657 PolarHBondContact O-N 3.01Å; E654-E657 PolarHBondContact O-N 3.22Å; E657-A659 VanDerWaalsContact C-N 3.29Å; E657-A659 PolarHBondContact O-N 3.05Å; E657-Y660 PolarHBondContact O-N 2.77Å; E657-Y660 VanDerWaalsContact O-N 3.1Å; E657-L661 HydrophobicContact CG-CD1 4.25Å; E657-L661 WeakPolarHBondContact O-CG 3.4Å; E657-L661 PolarHBondContact O-N 3.3Å
658	Q	96.9	Very high	96.3	Very high	120 Å²	120	104.1 Å²	104.1	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-37	177.4	-169.7	63	18.4	0	0	112.4	E654 L661 V662	E654-Q658 WeakPolarHBondContact O-CB 3.49Å; E654-Q658 PolarHBondContact O-N 3.25Å; Q658-L661 PolarHBondContact O-N 3.19Å; Q658-V662 WeakPolarHBondContact O-CG2 3.27Å; Q658-V662 PolarHBondContact O-N 3.45Å; Q658-V662 VanDerWaalsContact O-N 3.09Å
659	A	96.7	Very high	96.2	Very high	61 Å²	61	101.6 Å²	101.6	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-40.4	173.9	0	0	0	0	0	112.3	A655 Q656 E657 H663	A655-A659 WeakPolarHBondContact O-CB 3.35Å; A655-A659 PolarHBondContact O-N 2.83Å; A655-A659 VanDerWaalsContact O-N 3.1Å; Q656-A659 PolarHBondContact O-N 3.36Å; E657-A659 VanDerWaalsContact C-N 3.29Å; E657-A659 PolarHBondContact O-N 3.05Å; A659-H663 WeakPolarHBondContact O-CB 3.31Å; A659-H663 PolarHBondContact O-N 3.04Å
660	Y	96.4	Very high	96	Very high	152 Å²	152	99.3 Å²	99.3	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-66.1	-39.5	173.8	-68.5	-53.8	0	0	0	112.3	Q656 E657 H663 I664	Q656-Y660 HydrophobicContact CB-CE2 4.26Å; Q656-Y660 WeakPolarHBondContact O-CD2 3.45Å; Q656-Y660 PolarHBondContact O-N 3.24Å; E657-Y660 PolarHBondContact O-N 2.77Å; E657-Y660 VanDerWaalsContact O-N 3.1Å; Y660-H663 PolarHBondContact O-N 3.49Å; Y660-I664 WeakPolarHBondContact O-CB 3.41Å; Y660-I664 WeakPolarHBondContact O-CD1 3.38Å; Y660-I664 VanDerWaalsContact O-CG1 3.24Å; Y660-I664 WeakPolarHBondContact O-CG1 3.48Å; Y660-I664 PolarHBondContact O-N 3.32Å
661	L	97.4	Very high	95.8	Very high	85 Å²	85	97.9 Å²	97.9	45%	0.445	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-46.7	176.3	-72.2	172.7	0	0	0	111.8	E657 Q658 H663 I664 E665	E657-L661 HydrophobicContact CG-CD1 4.25Å; E657-L661 WeakPolarHBondContact O-CG 3.4Å; E657-L661 PolarHBondContact O-N 3.3Å; Q658-L661 PolarHBondContact O-N 3.19Å; L661-H663 VanDerWaalsContact C-N 3.33Å; L661-H663 PolarHBondContact O-N 3.33Å; L661-I664 PolarHBondContact O-N 2.95Å; L661-E665 PolarHBondContact O-N 3Å
662	V	97.1	Very high	95.6	Very high	82 Å²	82	99.4 Å²	99.4	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-38.7	175.3	172.2	0	0	0	0	111.5	Q658 E665 H666	Q658-V662 WeakPolarHBondContact O-CG2 3.27Å; Q658-V662 PolarHBondContact O-N 3.45Å; Q658-V662 VanDerWaalsContact O-N 3.09Å; V662-E665 PolarHBondContact O-N 2.7Å; V662-H666 PolarHBondContact O-N 3Å
663	H	95.5	Very high	95.3	Very high	104 Å²	104	101.1 Å²	101.1	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-40.6	175.6	-173.7	54.2	0	0	0	112.3	A659 Y660 L661 H666 L667	A659-H663 WeakPolarHBondContact O-CB 3.31Å; A659-H663 PolarHBondContact O-N 3.04Å; Y660-H663 PolarHBondContact O-N 3.49Å; L661-H663 VanDerWaalsContact C-N 3.33Å; L661-H663 PolarHBondContact O-N 3.33Å; H663-H666 PolarHBondContact O-N 2.9Å; H663-L667 WeakPolarHBondContact O-CG 3.27Å; H663-L667 PolarHBondContact O-N 3.13Å
664	I	95.9	Very high	95	Very high	79 Å²	79	96.7 Å²	96.7	41%	0.405	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-39.2	174.7	-71.2	163.3	0	0	0	111.1	Y660 L661 K668	Y660-I664 WeakPolarHBondContact O-CB 3.41Å; Y660-I664 WeakPolarHBondContact O-CD1 3.38Å; Y660-I664 VanDerWaalsContact O-CG1 3.24Å; Y660-I664 WeakPolarHBondContact O-CG1 3.48Å; Y660-I664 PolarHBondContact O-N 3.32Å; L661-I664 PolarHBondContact O-N 2.95Å; I664-K668 HydrophobicContact CG2-CD 4.08Å; I664-K668 WeakPolarHBondContact O-CB 3.45Å; I664-K668 WeakPolarHBondContact O-CD 3.36Å; I664-K668 VanDerWaalsContact O-CG 3.23Å; I664-K668 WeakPolarHBondContact O-CG 3.38Å; I664-K668 PolarHBondContact O-N 3.38Å
665	E	95.7	Very high	94.6	Very high	128 Å²	128	96.4 Å²	96.4	60%	0.598	49%	0.486	S	S	*	.	H	α-helix	trans	-66.2	-40.8	175.3	-174.1	170.4	-147.2	0	0	112.3	L661 V662 K668 S669	L661-E665 PolarHBondContact O-N 3Å; V662-E665 PolarHBondContact O-N 2.7Å; E665-K668 PolarHBondContact O-N 2.91Å; E665-S669 WeakPolarHBondContact O-CB 3.25Å; E665-S669 PolarHBondContact O-N 3.41Å; E665-S669 PolarHBondContact O-OG 2.89Å
666	H	95.2	Very high	94.2	Very high	120 Å²	120	97.5 Å²	97.5	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-61.8	-48.6	173.7	-177.6	57.5	0	0	0	112	V662 H663 K668 S669 E670	V662-H666 PolarHBondContact O-N 3Å; H663-H666 PolarHBondContact O-N 2.9Å; H666-K668 PolarHBondContact O-N 3.45Å; H666-S669 WeakPolarHBondContact O-CB 3.31Å; H666-S669 PolarHBondContact O-N 2.93Å; H666-S669 VanDerWaalsContact O-N 3.11Å; H666-E670 PolarHBondContact O-N 3.44Å
667	L	95.5	Very high	93.6	Very high	74 Å²	74	98.9 Å²	98.9	39%	0.387	49%	0.487	S	S	.	.	H	α-helix	trans	-62.9	-38.4	177.5	-71.3	172.9	0	0	0	112.7	H663 S669 E670 V671	H663-L667 WeakPolarHBondContact O-CG 3.27Å; H663-L667 PolarHBondContact O-N 3.13Å; L667-S669 VanDerWaalsContact C-N 3.32Å; L667-S669 PolarHBondContact O-N 3.26Å; L667-E670 PolarHBondContact O-N 2.74Å; L667-V671 WeakPolarHBondContact O-CB 3.47Å; L667-V671 VanDerWaalsContact O-CG2 3.29Å; L667-V671 WeakPolarHBondContact O-CG2 3.45Å; L667-V671 PolarHBondContact O-N 3.35Å
668	K	95.2	Very high	92.9	Very high	139 Å²	139	101 Å²	101	60%	0.604	49%	0.49	S	S	*	.	H	α-helix	trans	-60.2	-43.1	172	-76.9	166.5	-179.8	171.8	0	111.5	I664 E665 H666 V671 E672	I664-K668 HydrophobicContact CG2-CD 4.08Å; I664-K668 WeakPolarHBondContact O-CB 3.45Å; I664-K668 WeakPolarHBondContact O-CD 3.36Å; I664-K668 VanDerWaalsContact O-CG 3.23Å; I664-K668 WeakPolarHBondContact O-CG 3.38Å; I664-K668 PolarHBondContact O-N 3.38Å; E665-K668 PolarHBondContact O-N 2.91Å; H666-K668 PolarHBondContact O-N 3.45Å; K668-V671 PolarHBondContact O-N 2.97Å; K668-E672 PolarHBondContact O-N 3.45Å
669	S	93.4	Very high	91.9	Very high	70 Å²	70	101.3 Å²	101.3	49%	0.49	49%	0.493	S	S	.	.	H	α-helix	trans	-65.5	-44.4	179.4	-56	0	0	0	0	111.8	E665 H666 L667 E672 E673	E665-S669 WeakPolarHBondContact O-CB 3.25Å; E665-S669 PolarHBondContact O-N 3.41Å; E665-S669 PolarHBondContact O-OG 2.89Å; H666-S669 WeakPolarHBondContact O-CB 3.31Å; H666-S669 PolarHBondContact O-N 2.93Å; H666-S669 VanDerWaalsContact O-N 3.11Å; L667-S669 VanDerWaalsContact C-N 3.32Å; L667-S669 PolarHBondContact O-N 3.26Å; S669-E672 PolarHBondContact O-N 3.42Å; S669-E673 PolarHBondContact O-N 2.91Å
670	E	92.9	Very high	90.9	Very high	87 Å²	87	106 Å²	106	41%	0.407	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-43.2	176.3	-164.7	-163.8	160.8	0	0	111.6	H666 L667 E672 E673 Q674	H666-E670 PolarHBondContact O-N 3.44Å; L667-E670 PolarHBondContact O-N 2.74Å; E670-E672 VanDerWaalsContact C-N 3.3Å; E670-E672 PolarHBondContact O-N 2.88Å; E670-E673 PolarHBondContact O-N 3.46Å; E670-Q674 WeakPolarHBondContact O-CG 3.41Å; E670-Q674 PolarHBondContact O-N 2.94Å; E670-Q674 PolarHBondContact OE1-NE2 2.87Å
671	V	93.1	Very high	89.7	Confident	76 Å²	76	101.7 Å²	101.7	46%	0.461	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-37.9	175.7	165.3	0	0	0	0	111.7	L667 K668 K675	L667-V671 WeakPolarHBondContact O-CB 3.47Å; L667-V671 VanDerWaalsContact O-CG2 3.29Å; L667-V671 WeakPolarHBondContact O-CG2 3.45Å; L667-V671 PolarHBondContact O-N 3.35Å; K668-V671 PolarHBondContact O-N 2.97Å; V671-K675 WeakPolarHBondContact O-CG 3.4Å; V671-K675 PolarHBondContact O-N 2.93Å; V671-K675 VanDerWaalsContact O-N 3.07Å
672	E	93.3	Very high	88.1	Confident	98 Å²	98	103.1 Å²	103.1	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-71.6	-39	176.1	-148.1	63.5	-139.2	0	0	112.1	K668 S669 E670 Q674 K675 E676	K668-E672 PolarHBondContact O-N 3.45Å; S669-E672 PolarHBondContact O-N 3.42Å; E670-E672 VanDerWaalsContact C-N 3.3Å; E670-E672 PolarHBondContact O-N 2.88Å; E672-Q674 PolarHBondContact O-N 3.23Å; E672-K675 WeakPolarHBondContact O-CB 3.32Å; E672-K675 PolarHBondContact O-N 3.35Å; E672-K675 WeakPolarHBondContact OE1-CD 3.45Å; E672-K675 IonicContact OE1-NZ 2.64Å; E672-K675 PolarHBondContact OE1-NZ 3.26Å; E672-K675 IonicContact OE2-NZ 3.35Å; E672-K675 PolarHBondContact OE2-NZ 3.4Å; E672-E676 PolarHBondContact O-N 3.31Å
673	E	90.8	Very high	86.2	Confident	114 Å²	114	103 Å²	103	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-42.9	172.7	-158.5	-163.6	148.7	0	0	111.3	S669 E670 K675 E676 Q677	S669-E673 PolarHBondContact O-N 2.91Å; E670-E673 PolarHBondContact O-N 3.46Å; E673-K675 VanDerWaalsContact C-N 3.29Å; E673-K675 PolarHBondContact O-N 2.97Å; E673-E676 PolarHBondContact O-N 2.94Å; E673-E676 VanDerWaalsContact O-N 3.13Å; E673-Q677 HydrophobicContact CG-CG 4.48Å; E673-Q677 WeakPolarHBondContact O-CB 3.27Å; E673-Q677 VanDerWaalsContact O-CG 3.32Å; E673-Q677 WeakPolarHBondContact O-CG 3.46Å; E673-Q677 PolarHBondContact O-N 3.24Å; E673-Q677 PolarHBondContact OE1-NE2 3.07Å
674	Q	88.1	Confident	84.2	Confident	77 Å²	77	102.3 Å²	102.3	36%	0.36	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-34.3	175.1	-71.4	-175.8	28.6	0	0	112.3	E670 E672 R678	E670-Q674 WeakPolarHBondContact O-CG 3.41Å; E670-Q674 PolarHBondContact O-N 2.94Å; E670-Q674 PolarHBondContact OE1-NE2 2.87Å; E672-Q674 PolarHBondContact O-N 3.23Å; Q674-R678 WeakPolarHBondContact O-CB 3.39Å; Q674-R678 VanDerWaalsContact O-CG 3.25Å; Q674-R678 WeakPolarHBondContact O-CG 3.36Å; Q674-R678 PolarHBondContact O-N 3.46Å
675	K	89.4	Confident	82	Confident	98 Å²	98	103.7 Å²	103.7	43%	0.426	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-45	170.9	-69.9	166.9	-169.4	167.1	0	111.6	V671 E672 E673 R678 M679	V671-K675 WeakPolarHBondContact O-CG 3.4Å; V671-K675 PolarHBondContact O-N 2.93Å; V671-K675 VanDerWaalsContact O-N 3.07Å; E672-K675 WeakPolarHBondContact O-CB 3.32Å; E672-K675 PolarHBondContact O-N 3.35Å; E672-K675 WeakPolarHBondContact OE1-CD 3.45Å; E672-K675 IonicContact OE1-NZ 2.64Å; E672-K675 PolarHBondContact OE1-NZ 3.26Å; E672-K675 IonicContact OE2-NZ 3.35Å; E672-K675 PolarHBondContact OE2-NZ 3.4Å; E673-K675 VanDerWaalsContact C-N 3.29Å; E673-K675 PolarHBondContact O-N 2.97Å; K675-R678 PolarHBondContact O-N 3.23Å; K675-M679 PolarHBondContact O-N 3.09Å
676	E	86.6	Confident	79.6	Confident	86 Å²	86	101.8 Å²	101.8	40%	0.402	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-45.5	176.1	-82.7	-148.5	-147.6	0	0	112	E672 E673 R678 M679 R680	E672-E676 PolarHBondContact O-N 3.31Å; E673-E676 PolarHBondContact O-N 2.94Å; E673-E676 VanDerWaalsContact O-N 3.13Å; E676-R678 VanDerWaalsContact C-N 3.31Å; E676-R678 PolarHBondContact O-N 2.91Å; E676-M679 PolarHBondContact O-N 2.99Å; E676-R680 WeakPolarHBondContact O-CB 3.36Å; E676-R680 VanDerWaalsContact O-CG 3.24Å; E676-R680 WeakPolarHBondContact O-CG 3.36Å; E676-R680 PolarHBondContact O-N 3.46Å; E676-R680 IonicContact OE2-CZ 2.8Å; E676-R680 IonicContact OE2-NE 2.93Å; E676-R680 PolarHBondContact OE2-NE 2.88Å; E676-R680 IonicContact OE2-NH2 2.76Å; E676-R680 PolarHBondContact OE2-NH2 3.29Å
677	Q	83.8	Confident	77.1	Confident	101 Å²	101	101.9 Å²	101.9	47%	0.472	53%	0.534	S	S	.	.	H	α-helix	trans	-60.4	-39.3	175	-69.2	-179.9	16.2	0	0	111.7	E673 S681	E673-Q677 HydrophobicContact CG-CG 4.48Å; E673-Q677 WeakPolarHBondContact O-CB 3.27Å; E673-Q677 VanDerWaalsContact O-CG 3.32Å; E673-Q677 WeakPolarHBondContact O-CG 3.46Å; E673-Q677 PolarHBondContact O-N 3.24Å; E673-Q677 PolarHBondContact OE1-NE2 3.07Å; Q677-S681 WeakPolarHBondContact O-CB 3.29Å; Q677-S681 PolarHBondContact O-N 3.41Å; Q677-S681 PolarHBondContact O-OG 2.83Å
678	R	82.3	Confident	74.8	Confident	169 Å²	169	101.3 Å²	101.3	64%	0.638	55%	0.546	S	S	*	.	H	α-helix	trans	-65.4	-43.3	172.2	-75	176.5	-169.5	-169.1	7.2	112.6	Q674 K675 E676 S681 L682	Q674-R678 WeakPolarHBondContact O-CB 3.39Å; Q674-R678 VanDerWaalsContact O-CG 3.25Å; Q674-R678 WeakPolarHBondContact O-CG 3.36Å; Q674-R678 PolarHBondContact O-N 3.46Å; K675-R678 PolarHBondContact O-N 3.23Å; E676-R678 VanDerWaalsContact C-N 3.31Å; E676-R678 PolarHBondContact O-N 2.91Å; R678-S681 WeakPolarHBondContact CA-OG 3.27Å; R678-S681 PolarHBondContact O-OG 3.35Å; R678-S681 VanDerWaalsContact O-OG 3.07Å; R678-L682 WeakPolarHBondContact O-CB 3.47Å; R678-L682 WeakPolarHBondContact O-CD1 3.21Å; R678-L682 VanDerWaalsContact O-CG 3.23Å; R678-L682 WeakPolarHBondContact O-CG 3.39Å; R678-L682 PolarHBondContact O-N 2.99Å
679	M	76.3	Confident	72	Confident	127 Å²	127	100.9 Å²	100.9	63%	0.626	56%	0.561	S	S	*	*	H	α-helix	trans	-65	-42.7	176.1	-72.1	-157.6	-65.9	0	0	112.1	K675 E676 L682 S683	K675-M679 PolarHBondContact O-N 3.09Å; E676-M679 PolarHBondContact O-N 2.99Å; M679-L682 PolarHBondContact O-N 3.22Å; M679-S683 WeakPolarHBondContact O-CB 3.07Å; M679-S683 PolarHBondContact O-N 3.31Å; M679-S683 PolarHBondContact O-OG 2.87Å
680	R	75.9	Confident	69.7	Low	160 Å²	160	106.7 Å²	106.7	60%	0.604	58%	0.577	S	S	*	*	H	α-helix	trans	-62	-48.4	176.5	-69.7	171.8	-168.5	-171.7	4	110.9	E676 S683 S684	E676-R680 WeakPolarHBondContact O-CB 3.36Å; E676-R680 VanDerWaalsContact O-CG 3.24Å; E676-R680 WeakPolarHBondContact O-CG 3.36Å; E676-R680 PolarHBondContact O-N 3.46Å; E676-R680 IonicContact OE2-CZ 2.8Å; E676-R680 IonicContact OE2-NE 2.93Å; E676-R680 PolarHBondContact OE2-NE 2.88Å; E676-R680 IonicContact OE2-NH2 2.76Å; E676-R680 PolarHBondContact OE2-NH2 3.29Å; R680-S683 PolarHBondContact O-N 3.29Å; R680-S683 PolarHBondContact O-OG 2.94Å; R680-S684 PolarHBondContact O-N 3.43Å
681	S	71.1	Confident	67	Low	62 Å²	62	110.4 Å²	110.4	43%	0.434	60%	0.6	S	S	.	*	H	α-helix	trans	-63.6	-44.1	177.7	49.1	0	0	0	0	112.6	Q677 R678 S683 S684 T685	Q677-S681 WeakPolarHBondContact O-CB 3.29Å; Q677-S681 PolarHBondContact O-N 3.41Å; Q677-S681 PolarHBondContact O-OG 2.83Å; R678-S681 WeakPolarHBondContact CA-OG 3.27Å; R678-S681 PolarHBondContact O-OG 3.35Å; R678-S681 VanDerWaalsContact O-OG 3.07Å; S681-S683 VanDerWaalsContact C-N 3.35Å; S681-S683 PolarHBondContact O-N 3.23Å; S681-S684 PolarHBondContact O-N 3.48Å; S681-S684 VanDerWaalsContact O-N 3.15Å; S681-S684 PolarHBondContact O-OG 2.76Å; S681-T685 PolarHBondContact O-N 3.38Å
682	L	63.2	Low	64.5	Low	115 Å²	115	116 Å²	116	60%	0.602	62%	0.618	S	S	*	*	H	α-helix	trans	-56.1	-46.7	171.9	-74.3	167.2	0	0	0	111.9	R678 M679 S684 T685 S686	R678-L682 WeakPolarHBondContact O-CB 3.47Å; R678-L682 WeakPolarHBondContact O-CD1 3.21Å; R678-L682 VanDerWaalsContact O-CG 3.23Å; R678-L682 WeakPolarHBondContact O-CG 3.39Å; R678-L682 PolarHBondContact O-N 2.99Å; M679-L682 PolarHBondContact O-N 3.22Å; L682-S684 VanDerWaalsContact C-N 3.27Å; L682-S684 PolarHBondContact O-N 3.41Å; L682-T685 PolarHBondContact O-N 2.92Å; L682-T685 PolarHBondContact O-OG1 2.84Å; L682-S686 PolarHBondContact O-N 3.04Å
683	S	56.9	Low	62.9	Low	78 Å²	78	117.2 Å²	117.2	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-62.6	-31.2	178.4	77.2	0	0	0	0	113.6	M679 R680 S681 T685 S686	M679-S683 WeakPolarHBondContact O-CB 3.07Å; M679-S683 PolarHBondContact O-N 3.31Å; M679-S683 PolarHBondContact O-OG 2.87Å; R680-S683 PolarHBondContact O-N 3.29Å; R680-S683 PolarHBondContact O-OG 2.94Å; S681-S683 VanDerWaalsContact C-N 3.35Å; S681-S683 PolarHBondContact O-N 3.23Å; S683-T685 VanDerWaalsContact C-N 3.28Å; S683-T685 PolarHBondContact O-N 3.48Å; S683-S686 PolarHBondContact O-OG 3.46Å
684	S	53.8	Low	60.1	Low	91 Å²	91	115.8 Å²	115.8	64%	0.636	65%	0.65	S	S	*	*	H	α-helix	trans	-73.5	-17.9	175.3	72.1	0	0	0	0	113.8	R680 S681 L682	R680-S684 PolarHBondContact O-N 3.43Å; S681-S684 PolarHBondContact O-N 3.48Å; S681-S684 VanDerWaalsContact O-N 3.15Å; S681-S684 PolarHBondContact O-OG 2.76Å; L682-S684 VanDerWaalsContact C-N 3.27Å; L682-S684 PolarHBondContact O-N 3.41Å
685	T	49.5	Very low	58.1	Low	108 Å²	108	122.1 Å²	122.1	66%	0.663	68%	0.676	S	S	*	*	H	α-helix	trans	-96.1	-10.3	177.1	57.4	0	0	0	0	114.4	S681 L682 S683	S681-T685 PolarHBondContact O-N 3.38Å; L682-T685 PolarHBondContact O-N 2.92Å; L682-T685 PolarHBondContact O-OG1 2.84Å; S683-T685 VanDerWaalsContact C-N 3.28Å; S683-T685 PolarHBondContact O-N 3.48Å
686	S	45.3	Very low	55.5	Low	88 Å²	88	124.5 Å²	124.5	62%	0.615	70%	0.699	S	S	*	*			trans	-97.6	18.2	-168.3	68.5	0	0	0	0	115.9	L682 S683 G688	L682-S686 PolarHBondContact O-N 3.04Å; S683-S686 PolarHBondContact O-OG 3.46Å; S686-G688 PolarHBondContact O-N 3.13Å
687	S	43.4	Very low	53	Low	121 Å²	121	123.7 Å²	123.7	85%	0.846	71%	0.714	S	S	*	*	S	Bend	trans	-83.9	26.7	-179.8	73	0	0	0	0	114.2
688	G	45.8	Very low	51.2	Low	63 Å²	63	125 Å²	125	65%	0.649	73%	0.731	S	S	*	*	S	Bend	trans	-155.7	23.8	-154.7	0	0	0	0	0	119.2	S686	S686-G688 PolarHBondContact O-N 3.13Å
689	S	37.4	Very low	49.2	Very low	130 Å²	130	125.7 Å²	125.7	91%	0.909	74%	0.741	S	S	*	*			trans	-167.2	153.9	154.7	-89.5	0	0	0	0	112.8
690	K	45.3	Very low	47.2	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.835	76%	0.756	S	S	*	*			trans	-135	113.1	-174.4	171.2	-163.8	179.5	-173.6	0	108.5
691	D	36.8	Very low	45.5	Very low	164 Å²	164	132 Å²	132	88%	0.877	77%	0.77	S	S	*	*			trans	-165.4	168.3	153.7	-104.5	-28.4	0	0	0	114
692	K	40.3	Very low	43.9	Very low	193 Å²	193	132.4 Å²	132.4	84%	0.839	78%	0.784	S	S	*	*			trans	-141	165.5	178.9	-84.9	-173.1	176.7	-176.1	0	108.6
693	P	58.2	Low	42.5	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	80%	0.797	S	S	*	*			cis	-129.3	157.5	-28.6	35.8	-20.8	0	0	0	112.8
694	G	33.1	Very low	41.9	Very low	84 Å²	84	136 Å²	136	87%	0.866	80%	0.803	S	S	*	*			trans	-112.5	143.7	169.2	0	0	0	0	0	112
695	K	44.8	Very low	41.1	Very low	209 Å²	209	140.3 Å²	140.3	91%	0.909	82%	0.817	S	S	*	*			trans	-132.7	103.2	-172.5	179.2	-167.2	175.6	-173.1	0	111.5
696	V	36.3	Very low	40.5	Very low	149 Å²	149	145.3 Å²	145.3	90%	0.903	82%	0.824	S	S	*	*			trans	-138.3	150.4	168.5	-173.6	0	0	0	0	109.1
697	G	34.1	Very low	40	Very low	69 Å²	69	149.4 Å²	149.4	71%	0.711	84%	0.838	S	S	*	*			trans	-65.6	161.1	-159.4	0	0	0	0	0	118.4
698	P	44.8	Very low	39.6	Very low	128 Å²	128	148.2 Å²	148.2	83%	0.831	83%	0.83	S	S	*	*			trans	-89	124	166.5	34.6	-28.8	0	0	0	111.2
699	E	40.7	Very low	39.4	Very low	183 Å²	183	153 Å²	153	86%	0.855	84%	0.84	S	S	*	*			trans	-121.8	179.9	152	-75.1	-168.3	138.1	0	0	108.2
700	W	35	Very low	39.2	Very low	248 Å²	248	152.1 Å²	152.1	94%	0.939	83%	0.833	S	S	*	*			trans	73.3	78.6	-164.2	-57.8	90.3	0	0	0	113.9	G702	W700-G702 PolarHBondContact O-N 3.46Å
701	L	39.2	Very low	39.4	Very low	171 Å²	171	148.3 Å²	148.3	90%	0.895	83%	0.828	S	S	*	*			trans	-48.4	122.2	139.8	-81.3	148.5	0	0	0	108.4
702	G	38.7	Very low	39.6	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	83%	0.828	S	S	*	*			trans	-78.8	140.6	157.5	0	0	0	0	0	108.6	W700	W700-G702 PolarHBondContact O-N 3.46Å
703	D	32.5	Very low	39.8	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	83%	0.826	S	S	*	*			trans	-117.4	147	171.4	-147.9	-17.5	0	0	0	111.6
704	T	44.6	Very low	39.1	Very low	109 Å²	109	142.9 Å²	142.9	67%	0.669	82%	0.824	S	S	*	*			trans	-102.3	94	-159	-51.2	0	0	0	0	111	R706	T704-R706 VanDerWaalsContact C-N 3.34Å; T704-R706 HydrophobicContact CG2-CG 4.14Å; T704-R706 PolarHBondContact O-N 2.97Å
705	L	37.3	Very low	39.5	Very low	180 Å²	180	151.8 Å²	151.8	94%	0.942	84%	0.843	S	S	*	*			trans	-74.5	91.4	165.2	-87.7	168.8	0	0	0	110.1	L707	L705-L707 PolarHBondContact O-N 3.26Å
706	R	36.1	Very low	39.2	Very low	213 Å²	213	148.9 Å²	148.9	80%	0.804	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-62.2	129.2	168.1	-64.3	-180	175.7	-168.5	-2	109.1	T704 S708	T704-R706 VanDerWaalsContact C-N 3.34Å; T704-R706 HydrophobicContact CG2-CG 4.14Å; T704-R706 PolarHBondContact O-N 2.97Å; R706-S708 PolarHBondContact O-N 3.2Å
707	L	36.2	Very low	39.4	Very low	174 Å²	174	148.9 Å²	148.9	91%	0.911	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-71.4	117.5	159.2	-144.3	73.2	0	0	0	107	L705	L705-L707 PolarHBondContact O-N 3.26Å
708	S	35.6	Very low	39.7	Very low	97 Å²	97	153.3 Å²	153.3	68%	0.678	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-97.3	119.7	177	53.5	0	0	0	0	109.8	R706 C710	R706-S708 PolarHBondContact O-N 3.2Å; S708-C710 PolarHBondContact O-N 3.05Å
709	D	41	Very low	39.4	Very low	162 Å²	162	154.8 Å²	154.8	87%	0.866	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-59.8	131.8	171.7	-56.3	-67.8	0	0	0	110.7
710	C	33.2	Very low	39.3	Very low	113 Å²	113	153.1 Å²	153.1	76%	0.764	84%	0.844	S	S	*	*			trans	-113.9	120	165.1	-72.7	0	0	0	0	108.4	S708	S708-C710 PolarHBondContact O-N 3.05Å
711	P	49.3	Very low	39.6	Very low	112 Å²	112	146.7 Å²	146.7	73%	0.727	84%	0.837	S	S	*	*			trans	-75.3	139	-177.6	30.3	-34.2	0	0	0	111.3	T713	P711-T713 PolarHBondContact O-N 3.34Å; P711-T713 VanDerWaalsContact O-N 3.15Å
712	V	40.2	Very low	39.6	Very low	144 Å²	144	145 Å²	145	87%	0.873	83%	0.833	S	S	*	*			trans	-71.9	104.2	168.3	178.2	0	0	0	0	109
713	T	44.3	Very low	39.6	Very low	129 Å²	129	150.7 Å²	150.7	79%	0.791	84%	0.841	S	S	*	*			trans	-95.8	107.1	163.2	47.9	0	0	0	0	109.4	P711	P711-T713 PolarHBondContact O-N 3.34Å; P711-T713 VanDerWaalsContact O-N 3.15Å
714	A	45	Very low	40.2	Very low	94 Å²	94	149.8 Å²	149.8	78%	0.777	84%	0.839	S	S	*	*			trans	-80.5	131.8	168.8	0	0	0	0	0	110.5
715	Q	40.3	Very low	39.8	Very low	271 Å²	271	153.5 Å²	153.5	100%	1.266	86%	0.855	S	S	*	*			trans	-154	0	156.9	-126.8	177.4	4.9	0	0	109.8

Retrieved 715 of 715 residues in 318.5 ms (Link to these results)

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