A0A5K4FCC8_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FCC8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 322 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	43.6	Very low	240 Å²	240	149.4 Å²	149.4	100%	1.182	78%	0.775	S	S	*	*				0	110.9	0	-89.6	178.3	160.9	0	0	107.6	T3	M1-T3 PolarHBondContact O-N 3.13Å
2	L	35.4	Very low	45.1	Very low	184 Å²	184	142.3 Å²	142.3	96%	0.963	74%	0.739	S	S	*	*			trans	-59.3	119.7	-171	-86	139.7	0	0	0	111.4
3	T	40.4	Very low	46.5	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	71%	0.71	S	S	*	*			trans	-65.6	133.9	177.7	41.6	0	0	0	0	111.3	M1 S5	M1-T3 PolarHBondContact O-N 3.13Å; T3-S5 PolarHBondContact O-N 2.95Å
4	K	36	Very low	48.2	Very low	188 Å²	188	135.9 Å²	135.9	82%	0.817	72%	0.717	S	S	*	*			trans	-43.4	119.5	175.7	-65.3	168.9	175.1	177.5	0	112.8	L6	K4-L6 PolarHBondContact O-N 3.15Å
5	S	34.9	Very low	50.1	Low	97 Å²	97	134 Å²	134	68%	0.678	71%	0.714	S	S	*	*			trans	-75.9	101	157.1	156.9	0	0	0	0	107.9	T3 F7	T3-S5 PolarHBondContact O-N 2.95Å; S5-F7 PolarHBondContact O-N 2.85Å
6	L	42.3	Very low	51.7	Low	155 Å²	155	128.4 Å²	128.4	81%	0.812	68%	0.68	S	S	*	*			trans	-80.7	20.3	179	-109.9	147.8	0	0	0	113	K4	K4-L6 PolarHBondContact O-N 3.15Å
7	F	43.3	Very low	53.1	Low	169 Å²	169	131.9 Å²	131.9	74%	0.741	69%	0.688	S	S	*	*			trans	-80.6	123.5	179.8	-70.8	-76.8	0	0	0	110.1	S5 I9	S5-F7 PolarHBondContact O-N 2.85Å; F7-I9 PolarHBondContact O-N 2.98Å; F7-I9 VanDerWaalsContact O-N 3.15Å
8	P	50	Low	54.5	Low	87 Å²	87	128.7 Å²	128.7	57%	0.565	67%	0.672	S	S	*	*			trans	-58.2	122.6	168.4	24.3	-30.4	0	0	0	107.4	H10	P8-H10 VanDerWaalsContact C-N 3.3Å; P8-H10 PolarHBondContact O-N 3.01Å
9	I	49.4	Very low	55.6	Low	157 Å²	157	125.6 Å²	125.6	81%	0.805	66%	0.655	S	S	*	*			trans	-62.2	99.5	172	-62.4	169.7	0	0	0	105.7	F7 I11	F7-I9 PolarHBondContact O-N 2.98Å; F7-I9 VanDerWaalsContact O-N 3.15Å; I9-I11 HydrophobicContact CG2-CG1 4.44Å; I9-I11 PolarHBondContact O-N 3.02Å
10	H	53	Low	56.6	Low	92 Å²	92	125.2 Å²	125.2	43%	0.426	65%	0.654	S	S	.	*			trans	-68.2	101.6	171.6	-64.1	-32.6	0	0	0	107	P8 I12	P8-H10 VanDerWaalsContact C-N 3.3Å; P8-H10 PolarHBondContact O-N 3.01Å; H10-I12 HydrophobicContact CB-CG1 4.27Å; H10-I12 PolarHBondContact O-N 2.96Å
11	I	58.4	Low	57.6	Low	141 Å²	141	122.9 Å²	122.9	72%	0.723	64%	0.64	S	S	*	*			trans	-71.2	89	167.5	-57	175.3	0	0	0	105.4	I9	I9-I11 HydrophobicContact CG2-CG1 4.44Å; I9-I11 PolarHBondContact O-N 3.02Å
12	I	61.6	Low	59.5	Low	65 Å²	65	112 Å²	112	33%	0.333	59%	0.586	S	S	.	*			trans	-73.9	127.3	171.4	-59.5	172.3	0	0	0	106.2	H10 I19	H10-I12 HydrophobicContact CB-CG1 4.27Å; H10-I12 PolarHBondContact O-N 2.96Å; I12-I19 HydrophobicContact CD1-CB 4.07Å; I12-I19 HydrophobicContact CD1-CD1 4.46Å; I12-I19 HydrophobicContact CD1-CG1 4.41Å
13	D	64.4	Low	61.5	Low	68 Å²	68	106 Å²	106	36%	0.364	56%	0.563	S	S	.	*			trans	-60.8	122.8	170.8	-176.6	-28.7	0	0	0	108.2	T15 Y16 Y22	D13-T15 PolarHBondContact O-N 2.92Å; D13-T15 WeakPolarHBondContact OD1-CB 3.29Å; D13-T15 WeakPolarHBondContact OD1-CG2 3.4Å; D13-T15 PolarHBondContact OD1-N 3.48Å; D13-T15 PolarHBondContact OD1-OG1 3.49Å; D13-T15 PolarHBondContact OD2-OG1 3Å; D13-Y16 HydrophobicContact CB-CD2 3.97Å; D13-Y16 HydrophobicContact CB-CE2 4.34Å; D13-Y16 PolarHBondContact O-N 3.49Å; D13-Y22 HydrophobicContact CB-CD2 4.41Å; D13-Y22 HydrophobicContact CB-CE2 4Å
14	P	69.8	Low	63.3	Low	126 Å²	126	106.8 Å²	106.8	82%	0.818	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-8.8	-174.9	26.2	-36.1	0	0	0	113.8	Y16	P14-Y16 PolarHBondContact O-N 3.11Å
15	T	77.2	Confident	65.2	Low	108 Å²	108	101.1 Å²	101.1	66%	0.663	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.4	169.8	51.5	0	0	0	0	113.6	D13	D13-T15 PolarHBondContact O-N 2.92Å; D13-T15 WeakPolarHBondContact OD1-CB 3.29Å; D13-T15 WeakPolarHBondContact OD1-CG2 3.4Å; D13-T15 PolarHBondContact OD1-N 3.48Å; D13-T15 PolarHBondContact OD1-OG1 3.49Å; D13-T15 PolarHBondContact OD2-OG1 3Å
16	Y	75.2	Confident	67.2	Low	44 Å²	44	100.3 Å²	100.3	17%	0.173	52%	0.516	C	S	.	.	S	Bend	trans	-96.2	134.2	179.6	-68.2	-91.1	0	0	0	111.6	D13 P14 N18 E21 Y22 D25 Y26	D13-Y16 HydrophobicContact CB-CD2 3.97Å; D13-Y16 HydrophobicContact CB-CE2 4.34Å; D13-Y16 PolarHBondContact O-N 3.49Å; P14-Y16 PolarHBondContact O-N 3.11Å; Y16-N18 VanDerWaalsContact C-N 3.33Å; Y16-N18 PolarHBondContact O-N 3.36Å; Y16-E21 VanDerWaalsContact CD1-C 3.48Å; Y16-E21 HydrophobicContact CD1-CB 4.03Å; Y16-E21 HydrophobicContact CD1-CG 3.9Å; Y16-Y22 AromaticContact CD2-CD2 3.57Å; Y16-Y22 HydrophobicContact CD2-CD2 3.57Å; Y16-Y22 HydrophobicContact CD2-CE2 4.27Å; Y16-Y22 AromaticContact CE2-CD2 3.86Å; Y16-Y22 HydrophobicContact CE2-CD2 3.86Å; Y16-Y22 HydrophobicContact CE2-CE2 4.28Å; Y16-Y22 AromaticContact CG-CD2 3.93Å; Y16-Y22 HydrophobicContact CG-CD2 3.93Å; Y16-D25 HydrophobicContact CE1-CB 4.36Å; Y16-D25 VanDerWaalsContact CE1-OD2 3.23Å; Y16-D25 WeakPolarHBondContact CE1-OD2 3.48Å; Y16-D25 WeakPolarHBondContact OH-CB 3.29Å; Y16-D25 PolarHBondContact OH-OD2 3.11Å; Y16-Y26 HydrophobicContact CE2-CE2 4.31Å; Y16-Y26 WeakPolarHBondContact OH-CE2 3.38Å
17	K	75.8	Confident	68.7	Low	188 Å²	188	97 Å²	97	82%	0.817	50%	0.499	S	S	*	.	S	Bend	trans	-69.4	-32.9	-176.5	-172	178	179.1	177.7	0	112.5	E21	K17-E21 WeakPolarHBondContact CB-OE2 3.33Å; K17-E21 PolarHBondContact N-OE2 2.82Å
18	N	78	Confident	70	Confident	74 Å²	74	92 Å²	92	40%	0.396	48%	0.476	S	S	.	.	S	Bend	trans	-153.4	165.5	179.9	58.6	30.7	0	0	0	111.1	Y16 N20 E21 Y22	Y16-N18 VanDerWaalsContact C-N 3.33Å; Y16-N18 PolarHBondContact O-N 3.36Å; N18-N20 PolarHBondContact O-N 2.85Å; N18-N20 PolarHBondContact OD1-N 2.89Å; N18-E21 WeakPolarHBondContact O-CB 3.36Å; N18-E21 PolarHBondContact O-N 2.8Å; N18-E21 VanDerWaalsContact OD1-CB 3.27Å; N18-E21 WeakPolarHBondContact OD1-CB 3.41Å; N18-E21 PolarHBondContact OD1-N 2.57Å; N18-Y22 PolarHBondContact O-N 3.04Å; N18-Y22 VanDerWaalsContact O-N 3.15Å
19	I	74.9	Confident	70.9	Confident	70 Å²	70	91.2 Å²	91.2	36%	0.359	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-29.3	178.1	-164.3	160.8	0	0	0	112.6	I12 E21 Y22 A23	I12-I19 HydrophobicContact CD1-CB 4.07Å; I12-I19 HydrophobicContact CD1-CD1 4.46Å; I12-I19 HydrophobicContact CD1-CG1 4.41Å; I19-E21 VanDerWaalsContact C-N 3.32Å; I19-E21 PolarHBondContact O-N 3.27Å; I19-Y22 PolarHBondContact O-N 3.48Å; I19-A23 VanDerWaalsContact O-CB 3.31Å; I19-A23 WeakPolarHBondContact O-CB 3.49Å; I19-A23 PolarHBondContact O-N 3.15Å
20	N	76.4	Confident	72	Confident	117 Å²	117	92.3 Å²	92.3	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-69.2	-31	177.7	-65.7	-14.3	0	0	0	112.3	N18	N18-N20 PolarHBondContact O-N 2.85Å; N18-N20 PolarHBondContact OD1-N 2.89Å
21	E	76.5	Confident	72.9	Confident	77 Å²	77	98.3 Å²	98.3	36%	0.36	49%	0.492	S	S	.	.	H	α-helix	trans	-76.6	-40.3	175.2	-158.6	174	-150.5	0	0	110.2	Y16 K17 N18 I19 A23 K24	Y16-E21 VanDerWaalsContact CD1-C 3.48Å; Y16-E21 HydrophobicContact CD1-CB 4.03Å; Y16-E21 HydrophobicContact CD1-CG 3.9Å; K17-E21 WeakPolarHBondContact CB-OE2 3.33Å; K17-E21 PolarHBondContact N-OE2 2.82Å; N18-E21 WeakPolarHBondContact O-CB 3.36Å; N18-E21 PolarHBondContact O-N 2.8Å; N18-E21 VanDerWaalsContact OD1-CB 3.27Å; N18-E21 WeakPolarHBondContact OD1-CB 3.41Å; N18-E21 PolarHBondContact OD1-N 2.57Å; I19-E21 VanDerWaalsContact C-N 3.32Å; I19-E21 PolarHBondContact O-N 3.27Å; E21-A23 VanDerWaalsContact C-N 3.34Å; E21-A23 PolarHBondContact O-N 3.35Å; E21-K24 WeakPolarHBondContact O-CB 3.4Å; E21-K24 PolarHBondContact O-N 3.42Å
22	Y	77.1	Confident	73.4	Confident	12 Å²	12	94 Å²	94	5%	0.047	48%	0.483	C	S	.	.	H	α-helix	trans	-59	-44.5	173.3	-171.2	-97.8	0	0	0	112.1	D13 Y16 N18 I19 K24 D25 Y26 Y28 P34	D13-Y22 HydrophobicContact CB-CD2 4.41Å; D13-Y22 HydrophobicContact CB-CE2 4Å; Y16-Y22 AromaticContact CD2-CD2 3.57Å; Y16-Y22 HydrophobicContact CD2-CD2 3.57Å; Y16-Y22 HydrophobicContact CD2-CE2 4.27Å; Y16-Y22 AromaticContact CE2-CD2 3.86Å; Y16-Y22 HydrophobicContact CE2-CD2 3.86Å; Y16-Y22 HydrophobicContact CE2-CE2 4.28Å; Y16-Y22 AromaticContact CG-CD2 3.93Å; Y16-Y22 HydrophobicContact CG-CD2 3.93Å; N18-Y22 PolarHBondContact O-N 3.04Å; N18-Y22 VanDerWaalsContact O-N 3.15Å; I19-Y22 PolarHBondContact O-N 3.48Å; Y22-K24 PolarHBondContact O-N 2.96Å; Y22-K24 VanDerWaalsContact O-N 3.1Å; Y22-D25 PolarHBondContact O-N 3.22Å; Y22-D25 VanDerWaalsContact O-N 3.07Å; Y22-Y26 HydrophobicContact CD2-CD2 4.32Å; Y22-Y26 HydrophobicContact CE1-CG 4.31Å; Y22-Y26 AromaticContact CE2-CD2 3.89Å; Y22-Y26 HydrophobicContact CE2-CD2 3.89Å; Y22-Y26 HydrophobicContact CE2-CG 4.24Å; Y22-Y26 AromaticContact CZ-CG 3.93Å; Y22-Y26 PolarHBondContact O-N 3.43Å; Y22-Y28 HydrophobicContact CD1-CE2 4.46Å; Y22-Y28 HydrophobicContact CE1-CE2 4.11Å; Y22-Y28 AromaticContact CE1-CZ 3.78Å; Y22-Y28 WeakPolarHBondContact CE1-OH 3.46Å; Y22-P34 HydrophobicContact CE1-CB 4.3Å; Y22-P34 WeakPolarHBondContact OH-CB 3.45Å; Y22-P34 WeakPolarHBondContact OH-CG 3.3Å
23	A	77.2	Confident	73.9	Confident	59 Å²	59	94.7 Å²	94.7	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-13.5	179.6	0	0	0	0	0	114.2	I19 E21 Y26	I19-A23 VanDerWaalsContact O-CB 3.31Å; I19-A23 WeakPolarHBondContact O-CB 3.49Å; I19-A23 PolarHBondContact O-N 3.15Å; E21-A23 VanDerWaalsContact C-N 3.34Å; E21-A23 PolarHBondContact O-N 3.35Å; A23-Y26 WeakPolarHBondContact CA-O 3.44Å
24	K	78.1	Confident	74.3	Confident	148 Å²	148	94.2 Å²	94.2	64%	0.643	49%	0.491	S	S	*	.	H	α-helix	trans	-73.4	-33.1	173.2	-68.1	176.9	-178.8	176.7	0	112.2	E21 Y22 N37	E21-K24 WeakPolarHBondContact O-CB 3.4Å; E21-K24 PolarHBondContact O-N 3.42Å; Y22-K24 PolarHBondContact O-N 2.96Å; Y22-K24 VanDerWaalsContact O-N 3.1Å; K24-N37 VanDerWaalsContact C-ND2 3.34Å; K24-N37 PolarHBondContact O-ND2 3.12Å
25	D	76.5	Confident	74.6	Confident	70 Å²	70	90.1 Å²	90.1	37%	0.374	46%	0.461	S	S	.	.	H	α-helix	trans	-106.7	-28.1	-172.6	-67	-24.7	0	0	0	112.6	Y16 Y22 S36 N37	Y16-D25 HydrophobicContact CE1-CB 4.36Å; Y16-D25 VanDerWaalsContact CE1-OD2 3.23Å; Y16-D25 WeakPolarHBondContact CE1-OD2 3.48Å; Y16-D25 WeakPolarHBondContact OH-CB 3.29Å; Y16-D25 PolarHBondContact OH-OD2 3.11Å; Y22-D25 PolarHBondContact O-N 3.22Å; Y22-D25 VanDerWaalsContact O-N 3.07Å; D25-S36 CarbonylContact O-C 3.58Å; D25-S36 WeakPolarHBondContact O-CA 3.41Å; D25-N37 PolarHBondContact O-N 2.8Å
26	Y	76.8	Confident	74.7	Confident	80 Å²	80	86.6 Å²	86.6	31%	0.314	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140	-176.1	-66.3	-89.3	0	0	0	111.7	Y16 Y22 A23 P34 I35	Y16-Y26 HydrophobicContact CE2-CE2 4.31Å; Y16-Y26 WeakPolarHBondContact OH-CE2 3.38Å; Y22-Y26 HydrophobicContact CD2-CD2 4.32Å; Y22-Y26 HydrophobicContact CE1-CG 4.31Å; Y22-Y26 AromaticContact CE2-CD2 3.89Å; Y22-Y26 HydrophobicContact CE2-CD2 3.89Å; Y22-Y26 HydrophobicContact CE2-CG 4.24Å; Y22-Y26 AromaticContact CZ-CG 3.93Å; Y22-Y26 PolarHBondContact O-N 3.43Å; A23-Y26 WeakPolarHBondContact CA-O 3.44Å; Y26-P34 HydrophobicContact CD1-CB 4.22Å; Y26-I35 WeakPolarHBondContact CA-O 3.37Å
27	D	73.9	Confident	74.7	Confident	84 Å²	84	86.1 Å²	86.1	45%	0.449	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	165.2	165.5	-161.2	1.1	0	0	0	109	P34 I35 L40	D27-P34 CarbonylContact O-C 3.51Å; D27-P34 WeakPolarHBondContact O-CA 3.42Å; D27-I35 PolarHBondContact N-O 3.45Å; D27-I35 PolarHBondContact O-N 3.48Å; D27-I35 VanDerWaalsContact O-O 3.14Å; D27-L40 HydrophobicContact CB-CD1 4.23Å
28	Y	69.5	Low	74.8	Confident	64 Å²	64	85.9 Å²	85.9	25%	0.251	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.5	177.6	-69.4	-83.9	0	0	0	110.9	Y22 G32 V33 P34	Y22-Y28 HydrophobicContact CD1-CE2 4.46Å; Y22-Y28 HydrophobicContact CE1-CE2 4.11Å; Y22-Y28 AromaticContact CE1-CZ 3.78Å; Y22-Y28 WeakPolarHBondContact CE1-OH 3.46Å; Y28-G32 WeakPolarHBondContact CD1-O 3.31Å; Y28-V33 WeakPolarHBondContact CA-O 3.45Å; Y28-P34 HydrophobicContact CD1-CB 4.26Å; Y28-P34 HydrophobicContact CE1-CB 4.07Å; Y28-P34 HydrophobicContact CE1-CG 4.46Å
29	D	70.2	Confident	74.9	Confident	71 Å²	71	88.2 Å²	88.2	38%	0.38	44%	0.442	S	S	.	.			trans	-62.6	167.3	168.3	-158.4	-4.6	0	0	0	110.7	R31 G32 V33 I35	D29-R31 PolarHBondContact O-N 3.46Å; D29-G32 WeakPolarHBondContact O-CA 3.42Å; D29-G32 PolarHBondContact O-N 3.14Å; D29-V33 PolarHBondContact N-O 2.89Å; D29-I35 HydrophobicContact CB-CD1 3.48Å; D29-I35 VanDerWaalsContact CB-CD1 3.48Å; D29-I35 HydrophobicContact CB-CG1 4.12Å
30	L	72	Confident	74.8	Confident	180 Å²	180	86.7 Å²	86.7	94%	0.942	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-19.4	172.1	-65.5	174.8	0	0	0	113.3
31	R	72.2	Confident	74.6	Confident	218 Å²	218	83.8 Å²	83.8	82%	0.823	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	1.3	175.4	-61.3	-176.3	180	-135.5	0	113.9	D29 V33	D29-R31 PolarHBondContact O-N 3.46Å; R31-V33 VanDerWaalsContact C-N 3.28Å; R31-V33 HydrophobicContact CB-CG2 4.18Å; R31-V33 PolarHBondContact O-N 3.37Å
32	G	68.7	Low	74.8	Confident	51 Å²	51	86.1 Å²	86.1	53%	0.526	43%	0.432	S	S	.	.	S	Bend	trans	72.1	18.6	-175.4	0	0	0	0	0	114.1	Y28 D29	Y28-G32 WeakPolarHBondContact CD1-O 3.31Å; D29-G32 WeakPolarHBondContact O-CA 3.42Å; D29-G32 PolarHBondContact O-N 3.14Å
33	V	72.6	Confident	74.8	Confident	80 Å²	80	90 Å²	90	49%	0.485	45%	0.454	S	S	.	.			trans	-93.8	130.1	178.4	-179.4	0	0	0	0	108.8	Y28 D29 R31 I35	Y28-V33 WeakPolarHBondContact CA-O 3.45Å; D29-V33 PolarHBondContact N-O 2.89Å; R31-V33 VanDerWaalsContact C-N 3.28Å; R31-V33 HydrophobicContact CB-CG2 4.18Å; R31-V33 PolarHBondContact O-N 3.37Å; V33-I35 PolarHBondContact O-N 2.9Å
34	P	72.8	Confident	74.6	Confident	57 Å²	57	93.2 Å²	93.2	37%	0.37	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	127.9	177.5	27.2	-33.6	0	0	0	111.3	Y22 Y26 D27 Y28	Y22-P34 HydrophobicContact CE1-CB 4.3Å; Y22-P34 WeakPolarHBondContact OH-CB 3.45Å; Y22-P34 WeakPolarHBondContact OH-CG 3.3Å; Y26-P34 HydrophobicContact CD1-CB 4.22Å; D27-P34 CarbonylContact O-C 3.51Å; D27-P34 WeakPolarHBondContact O-CA 3.42Å; Y28-P34 HydrophobicContact CD1-CB 4.26Å; Y28-P34 HydrophobicContact CE1-CB 4.07Å; Y28-P34 HydrophobicContact CE1-CG 4.46Å
35	I	74.8	Confident	74.5	Confident	40 Å²	40	89.8 Å²	89.8	21%	0.205	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.5	175.1	-64.3	-179	0	0	0	107.1	Y26 D27 D29 V33 N37 K39 L40	Y26-I35 WeakPolarHBondContact CA-O 3.37Å; D27-I35 PolarHBondContact N-O 3.45Å; D27-I35 PolarHBondContact O-N 3.48Å; D27-I35 VanDerWaalsContact O-O 3.14Å; D29-I35 HydrophobicContact CB-CD1 3.48Å; D29-I35 VanDerWaalsContact CB-CD1 3.48Å; D29-I35 HydrophobicContact CB-CG1 4.12Å; V33-I35 PolarHBondContact O-N 2.9Å; I35-N37 PolarHBondContact O-N 2.92Å; I35-K39 HydrophobicContact CG2-CB 4.15Å; I35-K39 HydrophobicContact CG2-CD 4.44Å; I35-K39 HydrophobicContact CG2-CG 4.47Å; I35-L40 HydrophobicContact CG2-CD1 4.35Å
36	S	80.3	Confident	74.5	Confident	35 Å²	35	93 Å²	93	25%	0.245	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	137.5	175	63.6	0	0	0	0	110.7	D25 W38 K39 L40	D25-S36 CarbonylContact O-C 3.58Å; D25-S36 WeakPolarHBondContact O-CA 3.41Å; S36-W38 PolarHBondContact O-N 2.9Å; S36-W38 VanDerWaalsContact O-N 3.12Å; S36-K39 WeakPolarHBondContact O-CA 3.39Å; S36-K39 WeakPolarHBondContact O-CB 3.44Å; S36-K39 PolarHBondContact O-N 2.85Å; S36-K39 WeakPolarHBondContact OG-CB 3.42Å; S36-K39 PolarHBondContact OG-N 3.39Å; S36-L40 PolarHBondContact O-N 2.93Å; S36-L40 VanDerWaalsContact O-N 3.11Å
37	N	75.6	Confident	74.4	Confident	33 Å²	33	94.4 Å²	94.4	18%	0.176	48%	0.476	C	S	.	.	H	α-helix	trans	-54.5	-34.9	177.5	-76.5	-22	0	0	0	111.4	K24 D25 I35 K39 L40 I41	K24-N37 VanDerWaalsContact C-ND2 3.34Å; K24-N37 PolarHBondContact O-ND2 3.12Å; D25-N37 PolarHBondContact O-N 2.8Å; I35-N37 PolarHBondContact O-N 2.92Å; N37-K39 PolarHBondContact O-N 3.15Å; N37-L40 WeakPolarHBondContact O-CB 3.47Å; N37-L40 PolarHBondContact O-N 3.4Å; N37-I41 VanDerWaalsContact O-CG1 3.25Å; N37-I41 WeakPolarHBondContact O-CG1 3.36Å; N37-I41 PolarHBondContact O-N 3.15Å
38	W	76.7	Confident	74.1	Confident	184 Å²	184	92.6 Å²	92.6	70%	0.697	46%	0.463	S	S	*	.	H	α-helix	trans	-58.8	-44.3	172.4	-75	102.1	0	0	0	113.6	S36 L40 I41 I42	S36-W38 PolarHBondContact O-N 2.9Å; S36-W38 VanDerWaalsContact O-N 3.12Å; W38-L40 VanDerWaalsContact C-N 3.28Å; W38-L40 PolarHBondContact O-N 3.34Å; W38-I41 PolarHBondContact O-N 3.13Å; W38-I42 VanDerWaalsContact O-CG1 3.26Å; W38-I42 WeakPolarHBondContact O-CG1 3.44Å; W38-I42 PolarHBondContact O-N 3.2Å
39	K	80.4	Confident	74	Confident	122 Å²	122	94.3 Å²	94.3	53%	0.53	48%	0.476	S	S	.	.	H	α-helix	trans	-66.9	-34.7	177.3	-170.2	173.8	-178	-179	0	111	I35 S36 N37 N43	I35-K39 HydrophobicContact CG2-CB 4.15Å; I35-K39 HydrophobicContact CG2-CD 4.44Å; I35-K39 HydrophobicContact CG2-CG 4.47Å; S36-K39 WeakPolarHBondContact O-CA 3.39Å; S36-K39 WeakPolarHBondContact O-CB 3.44Å; S36-K39 PolarHBondContact O-N 2.85Å; S36-K39 WeakPolarHBondContact OG-CB 3.42Å; S36-K39 PolarHBondContact OG-N 3.39Å; N37-K39 PolarHBondContact O-N 3.15Å; K39-N43 VanDerWaalsContact O-CB 3.31Å; K39-N43 WeakPolarHBondContact O-CB 3.47Å; K39-N43 PolarHBondContact O-N 3.02Å; K39-N43 PolarHBondContact O-ND2 3.28Å
40	L	72	Confident	74.3	Confident	38 Å²	38	97 Å²	97	20%	0.199	48%	0.484	C	S	.	.	H	α-helix	trans	-67.4	-43.5	175.8	-134.1	151.2	0	0	0	111.5	D27 I35 S36 N37 W38 I42 N43 Y44 Y48	D27-L40 HydrophobicContact CB-CD1 4.23Å; I35-L40 HydrophobicContact CG2-CD1 4.35Å; S36-L40 PolarHBondContact O-N 2.93Å; S36-L40 VanDerWaalsContact O-N 3.11Å; N37-L40 WeakPolarHBondContact O-CB 3.47Å; N37-L40 PolarHBondContact O-N 3.4Å; W38-L40 VanDerWaalsContact C-N 3.28Å; W38-L40 PolarHBondContact O-N 3.34Å; L40-I42 VanDerWaalsContact C-N 3.34Å; L40-I42 PolarHBondContact O-N 3.32Å; L40-N43 PolarHBondContact O-N 2.77Å; L40-Y44 HydrophobicContact CD2-CD2 3.93Å; L40-Y44 HydrophobicContact CG-CD2 4.38Å; L40-Y44 PolarHBondContact O-N 2.82Å; L40-Y48 HydrophobicContact CB-CE2 4.01Å; L40-Y48 HydrophobicContact CD2-CE2 3.48Å; L40-Y48 VanDerWaalsContact CD2-CE2 3.48Å; L40-Y48 HydrophobicContact CG-CE2 4.33Å
41	I	73.9	Confident	74.2	Confident	57 Å²	57	95.3 Å²	95.3	29%	0.292	47%	0.466	S	S	.	.	H	α-helix	trans	-61.4	-42.4	175.5	-68.2	163	0	0	0	111.3	N37 W38 P45 Y48	N37-I41 VanDerWaalsContact O-CG1 3.25Å; N37-I41 WeakPolarHBondContact O-CG1 3.36Å; N37-I41 PolarHBondContact O-N 3.15Å; W38-I41 PolarHBondContact O-N 3.13Å; I41-P45 WeakPolarHBondContact O-CA 3.41Å; I41-Y48 HydrophobicContact CB-CD2 4.34Å; I41-Y48 HydrophobicContact CB-CE2 4.4Å; I41-Y48 HydrophobicContact CG1-CD1 4.1Å; I41-Y48 HydrophobicContact CG1-CD2 3.91Å; I41-Y48 HydrophobicContact CG1-CE1 4.01Å; I41-Y48 HydrophobicContact CG1-CE2 3.8Å; I41-Y48 HydrophobicContact CG1-CG 4.04Å
42	I	78.9	Confident	73.9	Confident	125 Å²	125	90.8 Å²	90.8	64%	0.641	45%	0.45	S	S	*	.	H	α-helix	trans	-70.2	-40.1	-179.7	-69	167.2	0	0	0	111.4	W38 L40	W38-I42 VanDerWaalsContact O-CG1 3.26Å; W38-I42 WeakPolarHBondContact O-CG1 3.44Å; W38-I42 PolarHBondContact O-N 3.2Å; L40-I42 VanDerWaalsContact C-N 3.34Å; L40-I42 PolarHBondContact O-N 3.32Å
43	N	77.2	Confident	73.9	Confident	93 Å²	93	93.3 Å²	93.3	50%	0.497	45%	0.451	S	S	.	.	H	α-helix	trans	-78.6	-27.8	-177.8	-71.5	-13	0	0	0	112.9	K39 L40 P45	K39-N43 VanDerWaalsContact O-CB 3.31Å; K39-N43 WeakPolarHBondContact O-CB 3.47Å; K39-N43 PolarHBondContact O-N 3.02Å; K39-N43 PolarHBondContact O-ND2 3.28Å; L40-N43 PolarHBondContact O-N 2.77Å; N43-P45 VanDerWaalsContact C-CD 3.46Å
44	Y	74.5	Confident	73.8	Confident	127 Å²	127	95 Å²	95	50%	0.498	45%	0.454	S	S	.	.			trans	-131.1	56.9	-175.3	-56.7	-75.5	0	0	0	113.1	L40 L46 I47 Y48	L40-Y44 HydrophobicContact CD2-CD2 3.93Å; L40-Y44 HydrophobicContact CG-CD2 4.38Å; L40-Y44 PolarHBondContact O-N 2.82Å; Y44-L46 PolarHBondContact O-N 3.4Å; Y44-L46 VanDerWaalsContact O-N 3.16Å; Y44-I47 HydrophobicContact CD1-CD1 4.02Å; Y44-I47 HydrophobicContact CG-CD1 4.21Å; Y44-I47 PolarHBondContact O-N 3Å; Y44-Y48 PolarHBondContact O-N 3.47Å
45	P	76.4	Confident	73.5	Confident	77 Å²	77	95.7 Å²	95.7	50%	0.5	45%	0.454	S	S	.	.	H	α-helix	trans	-60.7	-32.3	-175.3	24.8	-34.4	0	0	0	112.4	I41 N43 L49	I41-P45 WeakPolarHBondContact O-CA 3.41Å; N43-P45 VanDerWaalsContact C-CD 3.46Å; P45-L49 VanDerWaalsContact O-CB 3.25Å; P45-L49 WeakPolarHBondContact O-CB 3.48Å; P45-L49 PolarHBondContact O-N 3.29Å
46	L	76.2	Confident	73	Confident	136 Å²	136	102.9 Å²	102.9	71%	0.712	48%	0.48	S	S	*	.	H	α-helix	trans	-70.3	-37	-179.5	-67.3	174.3	0	0	0	113.4	Y44 L49 K50	Y44-L46 PolarHBondContact O-N 3.4Å; Y44-L46 VanDerWaalsContact O-N 3.16Å; L46-L49 PolarHBondContact O-N 3.45Å; L46-K50 WeakPolarHBondContact O-CB 3.48Å; L46-K50 PolarHBondContact O-N 3.01Å
47	I	73.8	Confident	72.2	Confident	111 Å²	111	104.7 Å²	104.7	57%	0.569	49%	0.492	S	S	*	.	H	α-helix	trans	-68.8	-44.6	178.9	-60.5	179.5	0	0	0	109.1	Y44 K50 Y51	Y44-I47 HydrophobicContact CD1-CD1 4.02Å; Y44-I47 HydrophobicContact CG-CD1 4.21Å; Y44-I47 PolarHBondContact O-N 3Å; I47-K50 PolarHBondContact O-N 2.86Å; I47-Y51 PolarHBondContact O-N 3.08Å
48	Y	67.2	Low	71.7	Confident	45 Å²	45	107.8 Å²	107.8	18%	0.176	51%	0.505	C	S	.	.	H	α-helix	trans	-64.7	-44.6	174.6	-82.4	-79	0	0	0	111.7	L40 I41 Y44 K50 Y51 Y52	L40-Y48 HydrophobicContact CB-CE2 4.01Å; L40-Y48 HydrophobicContact CD2-CE2 3.48Å; L40-Y48 VanDerWaalsContact CD2-CE2 3.48Å; L40-Y48 HydrophobicContact CG-CE2 4.33Å; I41-Y48 HydrophobicContact CB-CD2 4.34Å; I41-Y48 HydrophobicContact CB-CE2 4.4Å; I41-Y48 HydrophobicContact CG1-CD1 4.1Å; I41-Y48 HydrophobicContact CG1-CD2 3.91Å; I41-Y48 HydrophobicContact CG1-CE1 4.01Å; I41-Y48 HydrophobicContact CG1-CE2 3.8Å; I41-Y48 HydrophobicContact CG1-CG 4.04Å; Y44-Y48 PolarHBondContact O-N 3.47Å; Y48-K50 VanDerWaalsContact C-N 3.26Å; Y48-K50 PolarHBondContact O-N 3.3Å; Y48-Y51 CarbonylContact O-C 3.57Å; Y48-Y51 PolarHBondContact O-N 3.17Å; Y48-Y51 VanDerWaalsContact O-N 3.11Å; Y48-Y52 HydrophobicContact CD1-CE2 4Å; Y48-Y52 WeakPolarHBondContact O-CB 3.49Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.36Å; Y48-Y52 PolarHBondContact O-N 3.44Å
49	L	68.2	Low	71.1	Confident	100 Å²	100	104.5 Å²	104.5	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-56.1	-43.3	176.2	-168.8	87.7	0	0	0	111.1	P45 L46 Y52 L53	P45-L49 VanDerWaalsContact O-CB 3.25Å; P45-L49 WeakPolarHBondContact O-CB 3.48Å; P45-L49 PolarHBondContact O-N 3.29Å; L46-L49 PolarHBondContact O-N 3.45Å; L49-Y52 PolarHBondContact O-N 2.95Å; L49-L53 HydrophobicContact CD2-CD1 4Å; L49-L53 HydrophobicContact CG-CD1 3.9Å; L49-L53 HydrophobicContact CG-CG 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 WeakPolarHBondContact O-CG 3.44Å; L49-L53 PolarHBondContact O-N 3.23Å
50	K	76.9	Confident	70.5	Confident	129 Å²	129	102.4 Å²	102.4	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-60.2	-48.5	175.2	-175.6	-175.7	173.4	-171.8	0	111.6	L46 I47 Y48 Y52 L53 E54	L46-K50 WeakPolarHBondContact O-CB 3.48Å; L46-K50 PolarHBondContact O-N 3.01Å; I47-K50 PolarHBondContact O-N 2.86Å; Y48-K50 VanDerWaalsContact C-N 3.26Å; Y48-K50 PolarHBondContact O-N 3.3Å; K50-Y52 VanDerWaalsContact C-N 3.31Å; K50-Y52 PolarHBondContact O-N 3.17Å; K50-L53 PolarHBondContact O-N 3.5Å; K50-L53 VanDerWaalsContact O-N 3.17Å; K50-E54 WeakPolarHBondContact CE-OE1 3.31Å; K50-E54 IonicContact NZ-OE1 3.88Å; K50-E54 PolarHBondContact O-N 2.86Å
51	Y	68.4	Low	70.5	Confident	143 Å²	143	108.7 Å²	108.7	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-62.6	-37.1	177.6	-174.2	-97	0	0	0	112.7	I47 Y48 N55	I47-Y51 PolarHBondContact O-N 3.08Å; Y48-Y51 CarbonylContact O-C 3.57Å; Y48-Y51 PolarHBondContact O-N 3.17Å; Y48-Y51 VanDerWaalsContact O-N 3.11Å; Y51-N55 VanDerWaalsContact CE1-ND2 3.33Å; Y51-N55 WeakPolarHBondContact CE1-ND2 3.42Å; Y51-N55 PolarHBondContact O-N 3.28Å; Y51-N55 PolarHBondContact O-ND2 3.34Å
52	Y	67.3	Low	70.6	Confident	124 Å²	124	109.2 Å²	109.2	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-72	-29.6	175.1	-81.7	-69.1	0	0	0	112.7	Y48 L49 K50	Y48-Y52 HydrophobicContact CD1-CE2 4Å; Y48-Y52 WeakPolarHBondContact O-CB 3.49Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.36Å; Y48-Y52 PolarHBondContact O-N 3.44Å; L49-Y52 PolarHBondContact O-N 2.95Å; K50-Y52 VanDerWaalsContact C-N 3.31Å; K50-Y52 PolarHBondContact O-N 3.17Å
53	L	67.5	Low	70.6	Confident	103 Å²	103	108 Å²	108	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-78.3	-37.7	175.8	-77.1	165.9	0	0	0	112.3	L49 K50 N55	L49-L53 HydrophobicContact CD2-CD1 4Å; L49-L53 HydrophobicContact CG-CD1 3.9Å; L49-L53 HydrophobicContact CG-CG 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 WeakPolarHBondContact O-CG 3.44Å; L49-L53 PolarHBondContact O-N 3.23Å; K50-L53 PolarHBondContact O-N 3.5Å; K50-L53 VanDerWaalsContact O-N 3.17Å; L53-N55 VanDerWaalsContact C-N 3.28Å; L53-N55 PolarHBondContact O-N 3.48Å
54	E	70.4	Confident	70.8	Confident	117 Å²	117	106.5 Å²	106.5	55%	0.547	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-33.5	175.3	-79.7	174.8	178	0	0	111.6	K50 Y56	K50-E54 WeakPolarHBondContact CE-OE1 3.31Å; K50-E54 IonicContact NZ-OE1 3.88Å; K50-E54 PolarHBondContact O-N 2.86Å; E54-Y56 WeakPolarHBondContact O-CD2 3.35Å; E54-Y56 PolarHBondContact O-N 3.44Å; E54-Y56 VanDerWaalsContact O-N 3.15Å
55	N	67.9	Low	71.1	Confident	70 Å²	70	106.9 Å²	106.9	37%	0.374	52%	0.52	S	S	.	.	S	Bend	trans	-83.5	85	169.3	-70.6	-52.3	0	0	0	109.7	Y51 L53 S57 F58	Y51-N55 VanDerWaalsContact CE1-ND2 3.33Å; Y51-N55 WeakPolarHBondContact CE1-ND2 3.42Å; Y51-N55 PolarHBondContact O-N 3.28Å; Y51-N55 PolarHBondContact O-ND2 3.34Å; L53-N55 VanDerWaalsContact C-N 3.28Å; L53-N55 PolarHBondContact O-N 3.48Å; N55-S57 PolarHBondContact O-N 2.9Å; N55-S57 PolarHBondContact O-OG 3.47Å; N55-F58 PolarHBondContact O-N 3.45Å
56	Y	63.5	Low	71.5	Confident	192 Å²	192	106.8 Å²	106.8	75%	0.753	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	-5.3	178.1	-76.2	-90.2	0	0	0	116.9	E54 F58 L59	E54-Y56 WeakPolarHBondContact O-CD2 3.35Å; E54-Y56 PolarHBondContact O-N 3.44Å; E54-Y56 VanDerWaalsContact O-N 3.15Å; Y56-F58 PolarHBondContact O-N 2.86Å; Y56-L59 PolarHBondContact O-N 3.45Å
57	S	63.6	Low	72	Confident	72 Å²	72	105.2 Å²	105.2	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-29	173	61.7	0	0	0	0	113.2	N55 L59 S60 Y61	N55-S57 PolarHBondContact O-N 2.9Å; N55-S57 PolarHBondContact O-OG 3.47Å; S57-L59 VanDerWaalsContact C-N 3.32Å; S57-L59 PolarHBondContact O-N 3.34Å; S57-S60 PolarHBondContact O-N 2.93Å; S57-S60 PolarHBondContact O-OG 3.38Å; S57-Y61 WeakPolarHBondContact O-CD2 3.45Å
58	F	64.3	Low	72.6	Confident	99 Å²	99	104.4 Å²	104.4	43%	0.434	50%	0.502	S	S	.	.	H	α-helix	trans	-67.2	-32.8	178.3	-177.1	-104.9	0	0	0	113	N55 Y56 S60 Y61 L62	N55-F58 PolarHBondContact O-N 3.45Å; Y56-F58 PolarHBondContact O-N 2.86Å; F58-S60 PolarHBondContact O-N 2.62Å; F58-Y61 PolarHBondContact O-N 3.48Å; F58-Y61 VanDerWaalsContact O-N 3.12Å; F58-L62 HydrophobicContact CE1-CB 4.26Å; F58-L62 HydrophobicContact CE1-CD1 3.63Å; F58-L62 HydrophobicContact CE1-CD2 4.26Å; F58-L62 HydrophobicContact CE1-CG 4.27Å; F58-L62 HydrophobicContact CE2-CD1 4.42Å; F58-L62 HydrophobicContact CZ-CD1 3.49Å; F58-L62 VanDerWaalsContact CZ-CD1 3.49Å; F58-L62 PolarHBondContact O-N 3.19Å
59	L	64.5	Low	73.6	Confident	114 Å²	114	107.5 Å²	107.5	60%	0.597	52%	0.521	S	S	*	.	H	α-helix	trans	-62.7	-35.1	-178.8	-130.7	95.9	0	0	0	111.6	Y56 S57 L62 L63	Y56-L59 PolarHBondContact O-N 3.45Å; S57-L59 VanDerWaalsContact C-N 3.32Å; S57-L59 PolarHBondContact O-N 3.34Å; L59-L62 PolarHBondContact O-N 3.37Å; L59-L63 PolarHBondContact O-N 3.09Å
60	S	68.7	Low	74.6	Confident	78 Å²	78	106.8 Å²	106.8	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-70	-34.9	176.9	67.7	0	0	0	0	112.1	S57 F58 P64	S57-S60 PolarHBondContact O-N 2.93Å; S57-S60 PolarHBondContact O-OG 3.38Å; F58-S60 PolarHBondContact O-N 2.62Å; S60-P64 VanDerWaalsContact O-CD 3.31Å; S60-P64 WeakPolarHBondContact O-CD 3.49Å
61	Y	71.1	Confident	75.1	Confident	171 Å²	171	106.6 Å²	106.6	67%	0.671	52%	0.516	S	S	*	.	H	α-helix	trans	-70.9	-30.1	172.4	-71.3	-69.9	0	0	0	112.9	S57 F58 P64 F65	S57-Y61 WeakPolarHBondContact O-CD2 3.45Å; F58-Y61 PolarHBondContact O-N 3.48Å; F58-Y61 VanDerWaalsContact O-N 3.12Å; Y61-P64 WeakPolarHBondContact O-CD 3.42Å; Y61-P64 WeakPolarHBondContact O-CG 3.33Å; Y61-F65 WeakPolarHBondContact O-CD2 3.46Å
62	L	75.4	Confident	75.8	Confident	68 Å²	68	104.8 Å²	104.8	36%	0.356	51%	0.513	S	S	.	.	H	α-helix	trans	-81.5	-29.3	179.2	-150.4	83.2	0	0	0	113.1	F58 L59 F65 I66	F58-L62 HydrophobicContact CE1-CB 4.26Å; F58-L62 HydrophobicContact CE1-CD1 3.63Å; F58-L62 HydrophobicContact CE1-CD2 4.26Å; F58-L62 HydrophobicContact CE1-CG 4.27Å; F58-L62 HydrophobicContact CE2-CD1 4.42Å; F58-L62 HydrophobicContact CZ-CD1 3.49Å; F58-L62 VanDerWaalsContact CZ-CD1 3.49Å; F58-L62 PolarHBondContact O-N 3.19Å; L59-L62 PolarHBondContact O-N 3.37Å; L62-F65 WeakPolarHBondContact O-CB 3.07Å; L62-F65 PolarHBondContact O-N 3.1Å; L62-I66 HydrophobicContact CD2-CD1 4.09Å; L62-I66 HydrophobicContact CD2-CG1 4.37Å; L62-I66 HydrophobicContact CG-CD1 4.45Å; L62-I66 HydrophobicContact CG-CG1 4.46Å; L62-I66 PolarHBondContact O-N 2.88Å; L62-I66 VanDerWaalsContact O-N 3.1Å
63	L	79	Confident	76.7	Confident	99 Å²	99	103.8 Å²	103.8	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-47.7	-48.8	-179.6	-167.7	73.5	0	0	0	114.7	L59 F65 I66 L67	L59-L63 PolarHBondContact O-N 3.09Å; L63-F65 VanDerWaalsContact C-N 3.31Å; L63-F65 PolarHBondContact O-N 3.48Å; L63-I66 PolarHBondContact O-N 3.3Å; L63-L67 HydrophobicContact CG-CD1 4.45Å; L63-L67 WeakPolarHBondContact O-CG 3.32Å; L63-L67 PolarHBondContact O-N 2.83Å
64	P	81	Confident	77.7	Confident	62 Å²	62	103.8 Å²	103.8	40%	0.403	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-35.6	178.9	24.3	-35.1	0	0	0	112.8	S60 Y61 L67 I68	S60-P64 VanDerWaalsContact O-CD 3.31Å; S60-P64 WeakPolarHBondContact O-CD 3.49Å; Y61-P64 WeakPolarHBondContact O-CD 3.42Å; Y61-P64 WeakPolarHBondContact O-CG 3.33Å; P64-L67 PolarHBondContact O-N 2.97Å; P64-I68 VanDerWaalsContact O-CG1 3.3Å; P64-I68 WeakPolarHBondContact O-CG1 3.03Å; P64-I68 PolarHBondContact O-N 2.92Å
65	F	82.4	Confident	78.3	Confident	134 Å²	134	102.1 Å²	102.1	59%	0.588	51%	0.508	S	S	*	.	H	α-helix	trans	-67.3	-39.4	177.1	-67.6	-81.5	0	0	0	111.8	Y61 L62 L63 I68 L69	Y61-F65 WeakPolarHBondContact O-CD2 3.46Å; L62-F65 WeakPolarHBondContact O-CB 3.07Å; L62-F65 PolarHBondContact O-N 3.1Å; L63-F65 VanDerWaalsContact C-N 3.31Å; L63-F65 PolarHBondContact O-N 3.48Å; F65-I68 PolarHBondContact O-N 3.17Å; F65-L69 WeakPolarHBondContact O-CG 3.36Å; F65-L69 PolarHBondContact O-N 2.99Å
66	I	84.7	Confident	78.9	Confident	75 Å²	75	103.4 Å²	103.4	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-44.9	175	-61.7	170.6	0	0	0	110.3	L62 L63 I68 L69 I70	L62-I66 HydrophobicContact CD2-CD1 4.09Å; L62-I66 HydrophobicContact CD2-CG1 4.37Å; L62-I66 HydrophobicContact CG-CD1 4.45Å; L62-I66 HydrophobicContact CG-CG1 4.46Å; L62-I66 PolarHBondContact O-N 2.88Å; L62-I66 VanDerWaalsContact O-N 3.1Å; L63-I66 PolarHBondContact O-N 3.3Å; I66-I68 PolarHBondContact O-N 3.32Å; I66-L69 PolarHBondContact O-N 3.36Å; I66-I70 HydrophobicContact CG2-CD1 3.85Å; I66-I70 HydrophobicContact CG2-CG1 4.44Å; I66-I70 WeakPolarHBondContact O-CG1 3.35Å; I66-I70 PolarHBondContact O-N 3.29Å
67	L	86.9	Confident	79.8	Confident	104 Å²	104	98.5 Å²	98.5	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-41.1	179.3	-70.2	174	0	0	0	112.5	L63 P64 I70 F71	L63-L67 HydrophobicContact CG-CD1 4.45Å; L63-L67 WeakPolarHBondContact O-CG 3.32Å; L63-L67 PolarHBondContact O-N 2.83Å; P64-L67 PolarHBondContact O-N 2.97Å; L67-I70 PolarHBondContact O-N 3.45Å; L67-F71 WeakPolarHBondContact O-CB 3.32Å; L67-F71 PolarHBondContact O-N 3.45Å
68	I	86.8	Confident	80.6	Confident	94 Å²	94	97.2 Å²	97.2	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-42.2	175.5	-68.1	164.8	0	0	0	111	P64 F65 I66 F71 H72	P64-I68 VanDerWaalsContact O-CG1 3.3Å; P64-I68 WeakPolarHBondContact O-CG1 3.03Å; P64-I68 PolarHBondContact O-N 2.92Å; F65-I68 PolarHBondContact O-N 3.17Å; I66-I68 PolarHBondContact O-N 3.32Å; I68-F71 PolarHBondContact O-N 3.32Å; I68-H72 PolarHBondContact O-N 3.29Å
69	L	86.7	Confident	81.1	Confident	110 Å²	110	98.1 Å²	98.1	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-63	-43.9	176.8	-75.6	169.2	0	0	0	111.8	F65 I66 F71 H72 I73	F65-L69 WeakPolarHBondContact O-CG 3.36Å; F65-L69 PolarHBondContact O-N 2.99Å; I66-L69 PolarHBondContact O-N 3.36Å; L69-F71 VanDerWaalsContact C-N 3.34Å; L69-F71 PolarHBondContact O-N 3.11Å; L69-H72 PolarHBondContact O-N 3.38Å; L69-I73 VanDerWaalsContact O-CG1 3.29Å; L69-I73 WeakPolarHBondContact O-CG1 3.39Å; L69-I73 PolarHBondContact O-N 3.44Å
70	I	88.9	Confident	81.5	Confident	85 Å²	85	95.1 Å²	95.1	44%	0.436	49%	0.489	S	S	.	.	H	α-helix	trans	-61.5	-44.4	175.9	-67.8	168.1	0	0	0	110.4	I66 L67 H72 I73 L74	I66-I70 HydrophobicContact CG2-CD1 3.85Å; I66-I70 HydrophobicContact CG2-CG1 4.44Å; I66-I70 WeakPolarHBondContact O-CG1 3.35Å; I66-I70 PolarHBondContact O-N 3.29Å; L67-I70 PolarHBondContact O-N 3.45Å; I70-H72 VanDerWaalsContact C-N 3.35Å; I70-H72 PolarHBondContact O-N 2.81Å; I70-I73 PolarHBondContact O-N 3.17Å; I70-L74 HydrophobicContact CG2-CD1 4.03Å; I70-L74 HydrophobicContact CG2-CG 4.39Å; I70-L74 WeakPolarHBondContact O-CG 3.4Å; I70-L74 PolarHBondContact O-N 3.29Å
71	F	88.9	Confident	82	Confident	124 Å²	124	96.4 Å²	96.4	54%	0.544	49%	0.489	S	S	.	.	H	α-helix	trans	-59	-44.7	177	180	-98.9	0	0	0	111.9	L67 I68 L69 I73 L74 M75	L67-F71 WeakPolarHBondContact O-CB 3.32Å; L67-F71 PolarHBondContact O-N 3.45Å; I68-F71 PolarHBondContact O-N 3.32Å; L69-F71 VanDerWaalsContact C-N 3.34Å; L69-F71 PolarHBondContact O-N 3.11Å; F71-I73 PolarHBondContact O-N 3.03Å; F71-L74 PolarHBondContact O-N 3.44Å; F71-M75 HydrophobicContact CD1-CG 4.15Å; F71-M75 HydrophobicContact CE1-CG 3.7Å; F71-M75 HydrophobicContact CE1-SD 4.5Å; F71-M75 HydrophobicContact CE2-CG 4.19Å; F71-M75 HydrophobicContact CE2-SD 4.33Å; F71-M75 HydrophobicContact CZ-CG 3.72Å; F71-M75 HydrophobicContact CZ-SD 3.96Å; F71-M75 WeakPolarHBondContact O-CG 3.3Å; F71-M75 PolarHBondContact O-N 2.87Å
72	H	82.4	Confident	82.1	Confident	105 Å²	105	93.1 Å²	93.1	49%	0.486	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-39.6	175.5	-82.8	-41.4	0	0	0	113.2	I68 L69 I70 L74 M75 N76	I68-H72 PolarHBondContact O-N 3.29Å; L69-H72 PolarHBondContact O-N 3.38Å; I70-H72 VanDerWaalsContact C-N 3.35Å; I70-H72 PolarHBondContact O-N 2.81Å; H72-L74 VanDerWaalsContact C-N 3.35Å; H72-M75 PolarHBondContact O-N 3.33Å; H72-N76 WeakPolarHBondContact O-CB 3.48Å; H72-N76 PolarHBondContact O-N 3.24Å; H72-N76 PolarHBondContact O-ND2 2.94Å
73	I	86	Confident	81.8	Confident	103 Å²	103	91.2 Å²	91.2	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-63.3	-43.1	175.8	-67.6	164	0	0	0	110.5	L69 I70 F71 N76 L77	L69-I73 VanDerWaalsContact O-CG1 3.29Å; L69-I73 WeakPolarHBondContact O-CG1 3.39Å; L69-I73 PolarHBondContact O-N 3.44Å; I70-I73 PolarHBondContact O-N 3.17Å; F71-I73 PolarHBondContact O-N 3.03Å; I73-N76 PolarHBondContact O-N 3.27Å; I73-L77 HydrophobicContact CG2-CD1 3.85Å; I73-L77 WeakPolarHBondContact O-CB 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.48Å; I73-L77 PolarHBondContact O-N 2.88Å
74	L	88.9	Confident	81.6	Confident	104 Å²	104	91.3 Å²	91.3	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-65.3	-41.8	177.9	-70.9	173.4	0	0	0	112.6	I70 F71 H72 L77 A78	I70-L74 HydrophobicContact CG2-CD1 4.03Å; I70-L74 HydrophobicContact CG2-CG 4.39Å; I70-L74 WeakPolarHBondContact O-CG 3.4Å; I70-L74 PolarHBondContact O-N 3.29Å; F71-L74 PolarHBondContact O-N 3.44Å; H72-L74 VanDerWaalsContact C-N 3.35Å; L74-L77 PolarHBondContact O-N 3.27Å; L74-A78 WeakPolarHBondContact O-CB 3.32Å; L74-A78 PolarHBondContact O-N 2.59Å
75	M	82.7	Confident	81.4	Confident	81 Å²	81	96 Å²	96	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-46.7	175.7	-73.7	-58.9	-59.6	0	0	111.5	F71 H72 L77 A78 E79	F71-M75 HydrophobicContact CD1-CG 4.15Å; F71-M75 HydrophobicContact CE1-CG 3.7Å; F71-M75 HydrophobicContact CE1-SD 4.5Å; F71-M75 HydrophobicContact CE2-CG 4.19Å; F71-M75 HydrophobicContact CE2-SD 4.33Å; F71-M75 HydrophobicContact CZ-CG 3.72Å; F71-M75 HydrophobicContact CZ-SD 3.96Å; F71-M75 WeakPolarHBondContact O-CG 3.3Å; F71-M75 PolarHBondContact O-N 2.87Å; H72-M75 PolarHBondContact O-N 3.33Å; M75-L77 VanDerWaalsContact C-N 3.3Å; M75-L77 PolarHBondContact O-N 2.94Å; M75-A78 PolarHBondContact O-N 3.03Å; M75-E79 WeakPolarHBondContact O-CG 3.28Å; M75-E79 PolarHBondContact O-N 3.43Å
76	N	80.4	Confident	80.7	Confident	98 Å²	98	92.9 Å²	92.9	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-38	176.4	-69.2	-12.2	0	0	0	112	H72 I73 S80	H72-N76 WeakPolarHBondContact O-CB 3.48Å; H72-N76 PolarHBondContact O-N 3.24Å; H72-N76 PolarHBondContact O-ND2 2.94Å; I73-N76 PolarHBondContact O-N 3.27Å; N76-S80 WeakPolarHBondContact O-CB 3.35Å; N76-S80 PolarHBondContact O-N 3.36Å; N76-S80 PolarHBondContact O-OG 3.32Å
77	L	81.8	Confident	80.2	Confident	88 Å²	88	93.3 Å²	93.3	46%	0.461	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-46	174.4	-83.4	160.7	0	0	0	111.3	I73 L74 M75 E79 S80 I81	I73-L77 HydrophobicContact CG2-CD1 3.85Å; I73-L77 WeakPolarHBondContact O-CB 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.48Å; I73-L77 PolarHBondContact O-N 2.88Å; L74-L77 PolarHBondContact O-N 3.27Å; M75-L77 VanDerWaalsContact C-N 3.3Å; M75-L77 PolarHBondContact O-N 2.94Å; L77-E79 PolarHBondContact O-N 3.26Å; L77-S80 WeakPolarHBondContact CA-OG 3.37Å; L77-S80 PolarHBondContact O-N 3.1Å; L77-S80 PolarHBondContact O-OG 3.39Å; L77-I81 VanDerWaalsContact O-CG1 3.3Å; L77-I81 WeakPolarHBondContact O-CG1 3.38Å; L77-I81 PolarHBondContact O-N 2.91Å
78	A	82	Confident	79.6	Confident	46 Å²	46	93.8 Å²	93.8	38%	0.38	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-43.5	177.6	0	0	0	0	0	112	L74 M75 I81 N82	L74-A78 WeakPolarHBondContact O-CB 3.32Å; L74-A78 PolarHBondContact O-N 2.59Å; M75-A78 PolarHBondContact O-N 3.03Å; A78-I81 PolarHBondContact O-N 3.45Å; A78-N82 WeakPolarHBondContact O-CB 3.47Å; A78-N82 PolarHBondContact O-N 3.44Å; A78-N82 PolarHBondContact O-ND2 3.34Å
79	E	74	Confident	79.3	Confident	118 Å²	118	94.6 Å²	94.6	55%	0.551	48%	0.481	S	S	*	.	H	α-helix	trans	-60.9	-44.4	173.7	-74.3	175.7	-170.9	0	0	111.7	M75 L77 I81 N82 C83	M75-E79 WeakPolarHBondContact O-CG 3.28Å; M75-E79 PolarHBondContact O-N 3.43Å; L77-E79 PolarHBondContact O-N 3.26Å; E79-I81 PolarHBondContact O-N 2.7Å; E79-N82 PolarHBondContact O-N 2.92Å; E79-C83 WeakPolarHBondContact O-CB 3.24Å; E79-C83 PolarHBondContact O-N 3.33Å
80	S	73.4	Confident	78.4	Confident	51 Å²	51	92.8 Å²	92.8	36%	0.357	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-39.8	178.4	75.6	0	0	0	0	112.7	N76 L77 C83 L84	N76-S80 WeakPolarHBondContact O-CB 3.35Å; N76-S80 PolarHBondContact O-N 3.36Å; N76-S80 PolarHBondContact O-OG 3.32Å; L77-S80 WeakPolarHBondContact CA-OG 3.37Å; L77-S80 PolarHBondContact O-N 3.1Å; L77-S80 PolarHBondContact O-OG 3.39Å; S80-C83 PolarHBondContact O-N 3.21Å; S80-L84 WeakPolarHBondContact O-CB 3.47Å; S80-L84 VanDerWaalsContact O-CG 3.31Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 3.2Å
81	I	78.1	Confident	77.7	Confident	105 Å²	105	94.2 Å²	94.2	54%	0.538	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-42.5	176.5	-68.5	166.7	0	0	0	110	L77 A78 E79 L84 Y85	L77-I81 VanDerWaalsContact O-CG1 3.3Å; L77-I81 WeakPolarHBondContact O-CG1 3.38Å; L77-I81 PolarHBondContact O-N 2.91Å; A78-I81 PolarHBondContact O-N 3.45Å; E79-I81 PolarHBondContact O-N 2.7Å; I81-L84 PolarHBondContact O-N 3.29Å; I81-Y85 WeakPolarHBondContact O-CB 3.3Å; I81-Y85 PolarHBondContact O-N 3.18Å
82	N	74.3	Confident	77	Confident	102 Å²	102	95 Å²	95	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-42.2	175.8	-77.8	-23.1	0	0	0	111.8	A78 E79 Y85 C86	A78-N82 WeakPolarHBondContact O-CB 3.47Å; A78-N82 PolarHBondContact O-N 3.44Å; A78-N82 PolarHBondContact O-ND2 3.34Å; E79-N82 PolarHBondContact O-N 2.92Å; N82-Y85 PolarHBondContact O-N 2.97Å; N82-C86 PolarHBondContact O-N 3.42Å; N82-C86 PolarHBondContact O-SG 3.13Å; N82-C86 VanDerWaalsContact O-SG 3.36Å
83	C	68.9	Low	76.5	Confident	27 Å²	27	94.4 Å²	94.4	18%	0.182	48%	0.478	C	S	.	.	H	α-helix	trans	-61.4	-45.6	174.8	-179.5	0	0	0	0	111.3	E79 S80 Y85 C86 K87 E224	E79-C83 WeakPolarHBondContact O-CB 3.24Å; E79-C83 PolarHBondContact O-N 3.33Å; S80-C83 PolarHBondContact O-N 3.21Å; C83-Y85 PolarHBondContact O-N 3.49Å; C83-C86 PolarHBondContact O-N 2.85Å; C83-K87 WeakPolarHBondContact O-CG 3.41Å; C83-K87 PolarHBondContact O-N 3.15Å; C83-E224 PolarHBondContact SG-OE1 2.92Å
84	L	73.9	Confident	75.7	Confident	102 Å²	102	95.2 Å²	95.2	53%	0.534	48%	0.475	S	S	.	.	H	α-helix	trans	-61.6	-42.3	175.2	-77	166.8	0	0	0	112.2	S80 I81 K87 M88	S80-L84 WeakPolarHBondContact O-CB 3.47Å; S80-L84 VanDerWaalsContact O-CG 3.31Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 3.2Å; I81-L84 PolarHBondContact O-N 3.29Å; L84-K87 PolarHBondContact O-N 2.95Å; L84-M88 WeakPolarHBondContact O-CG 3.45Å; L84-M88 PolarHBondContact O-N 3.17Å
85	Y	78.4	Confident	75	Confident	159 Å²	159	96.8 Å²	96.8	62%	0.624	48%	0.477	S	S	*	.	H	α-helix	trans	-61.3	-45.6	176.5	179.4	-99.8	0	0	0	111.6	I81 N82 C83 M88 K89	I81-Y85 WeakPolarHBondContact O-CB 3.3Å; I81-Y85 PolarHBondContact O-N 3.18Å; N82-Y85 PolarHBondContact O-N 2.97Å; C83-Y85 PolarHBondContact O-N 3.49Å; Y85-M88 PolarHBondContact O-N 3.18Å; Y85-K89 WeakPolarHBondContact O-CB 3.43Å; Y85-K89 PolarHBondContact O-N 3.22Å
86	C	67.6	Low	74.4	Confident	69 Å²	69	100.3 Å²	100.3	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-46	174.8	-72.9	0	0	0	0	111.8	N82 C83 M88 K89 I90	N82-C86 PolarHBondContact O-N 3.42Å; N82-C86 PolarHBondContact O-SG 3.13Å; N82-C86 VanDerWaalsContact O-SG 3.36Å; C83-C86 PolarHBondContact O-N 2.85Å; C86-M88 PolarHBondContact O-N 2.9Å; C86-K89 WeakPolarHBondContact O-CB 3.4Å; C86-K89 PolarHBondContact O-N 2.95Å; C86-I90 WeakPolarHBondContact O-CG1 3.44Å; C86-I90 PolarHBondContact O-N 2.74Å
87	K	73	Confident	73.5	Confident	84 Å²	84	99.5 Å²	99.5	37%	0.365	48%	0.483	S	S	.	.	H	α-helix	trans	-58.9	-45.7	175.8	-75.3	175.9	178.9	170.7	0	111.7	C83 L84 K89 I90 I91	C83-K87 WeakPolarHBondContact O-CG 3.41Å; C83-K87 PolarHBondContact O-N 3.15Å; L84-K87 PolarHBondContact O-N 2.95Å; K87-K89 VanDerWaalsContact C-N 3.34Å; K87-K89 PolarHBondContact O-N 2.84Å; K87-I90 PolarHBondContact O-N 3.08Å; K87-I91 VanDerWaalsContact O-CG1 3.3Å; K87-I91 WeakPolarHBondContact O-CG1 3.42Å; K87-I91 PolarHBondContact O-N 3.33Å
88	M	74.6	Confident	72.3	Confident	115 Å²	115	97.7 Å²	97.7	57%	0.567	48%	0.475	S	S	*	.	H	α-helix	trans	-63.6	-37.9	176.5	-76.9	179.7	73.8	0	0	112.5	L84 Y85 C86 I91 K92	L84-M88 WeakPolarHBondContact O-CG 3.45Å; L84-M88 PolarHBondContact O-N 3.17Å; Y85-M88 PolarHBondContact O-N 3.18Å; C86-M88 PolarHBondContact O-N 2.9Å; M88-I91 PolarHBondContact O-N 3.33Å; M88-K92 WeakPolarHBondContact O-CG 3.37Å; M88-K92 PolarHBondContact O-N 3.44Å
89	K	80.1	Confident	71.4	Confident	111 Å²	111	100.7 Å²	100.7	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-46.8	176	-171.8	-177.1	176.3	-171.8	0	111.2	Y85 C86 K87 I91 K92 E93	Y85-K89 WeakPolarHBondContact O-CB 3.43Å; Y85-K89 PolarHBondContact O-N 3.22Å; C86-K89 WeakPolarHBondContact O-CB 3.4Å; C86-K89 PolarHBondContact O-N 2.95Å; K87-K89 VanDerWaalsContact C-N 3.34Å; K87-K89 PolarHBondContact O-N 2.84Å; K89-I91 PolarHBondContact O-N 3.33Å; K89-K92 PolarHBondContact O-N 3.42Å; K89-E93 WeakPolarHBondContact CE-OE1 3.17Å; K89-E93 PolarHBondContact O-N 2.85Å
90	I	69	Low	70.8	Confident	71 Å²	71	103.2 Å²	103.2	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-45.3	177.3	-66.6	166.5	0	0	0	110.6	C86 K87 K92 E93 W94	C86-I90 WeakPolarHBondContact O-CG1 3.44Å; C86-I90 PolarHBondContact O-N 2.74Å; K87-I90 PolarHBondContact O-N 3.08Å; I90-K92 VanDerWaalsContact C-N 3.32Å; I90-K92 PolarHBondContact O-N 2.94Å; I90-E93 PolarHBondContact O-N 2.84Å; I90-W94 WeakPolarHBondContact O-CB 3.44Å; I90-W94 PolarHBondContact O-N 3.48Å
91	I	73.8	Confident	69.7	Low	116 Å²	116	106 Å²	106	60%	0.595	50%	0.501	S	S	*	.	H	α-helix	trans	-61.7	-40.3	177.9	-67.7	165.6	0	0	0	111.4	K87 M88 K89 W94 K95	K87-I91 VanDerWaalsContact O-CG1 3.3Å; K87-I91 WeakPolarHBondContact O-CG1 3.42Å; K87-I91 PolarHBondContact O-N 3.33Å; M88-I91 PolarHBondContact O-N 3.33Å; K89-I91 PolarHBondContact O-N 3.33Å; I91-W94 PolarHBondContact O-N 3.27Å; I91-K95 WeakPolarHBondContact O-CB 3.42Å; I91-K95 PolarHBondContact O-N 3.42Å
92	K	75.1	Confident	68.2	Low	140 Å²	140	108.6 Å²	108.6	61%	0.609	51%	0.505	S	S	*	.	H	α-helix	trans	-65.7	-41.4	177.2	-78.3	-179.6	179.7	179.6	0	112.4	M88 K89 I90 K95 K96	M88-K92 WeakPolarHBondContact O-CG 3.37Å; M88-K92 PolarHBondContact O-N 3.44Å; K89-K92 PolarHBondContact O-N 3.42Å; I90-K92 VanDerWaalsContact C-N 3.32Å; I90-K92 PolarHBondContact O-N 2.94Å; K92-K95 PolarHBondContact O-N 3.09Å; K92-K96 WeakPolarHBondContact O-CG 3.16Å; K92-K96 PolarHBondContact O-N 3.34Å; K92-K96 VanDerWaalsContact O-N 3.11Å
93	E	71	Confident	66.4	Low	92 Å²	92	114.2 Å²	114.2	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-69	-39.9	176.4	-71.7	-169.6	-168.6	0	0	111.7	K89 I90 K95 K96 F97	K89-E93 WeakPolarHBondContact CE-OE1 3.17Å; K89-E93 PolarHBondContact O-N 2.85Å; I90-E93 PolarHBondContact O-N 2.84Å; E93-K95 VanDerWaalsContact C-N 3.35Å; E93-K95 PolarHBondContact O-N 2.96Å; E93-K96 WeakPolarHBondContact O-CB 3.45Å; E93-K96 PolarHBondContact O-N 3.48Å; E93-F97 PolarHBondContact O-N 2.59Å
94	W	69.3	Low	65.1	Low	121 Å²	121	118.3 Å²	118.3	46%	0.458	55%	0.545	S	S	.	.	H	α-helix	trans	-59	-44.6	171.9	-101	88.7	0	0	0	112.5	I90 I91 K96 F97 T98	I90-W94 WeakPolarHBondContact O-CB 3.44Å; I90-W94 PolarHBondContact O-N 3.48Å; I91-W94 PolarHBondContact O-N 3.27Å; W94-K96 VanDerWaalsContact C-N 3.32Å; W94-K96 PolarHBondContact O-N 3.11Å; W94-F97 WeakPolarHBondContact O-CB 3.43Å; W94-F97 PolarHBondContact O-N 3.15Å; W94-F97 VanDerWaalsContact O-N 3.14Å; W94-T98 HydrophobicContact CE3-CG2 4.14Å; W94-T98 HydrophobicContact CZ3-CG2 4.47Å; W94-T98 PolarHBondContact O-N 3.35Å; W94-T98 PolarHBondContact O-OG1 3.46Å
95	K	73.3	Confident	63.2	Low	136 Å²	136	120.1 Å²	120.1	59%	0.591	56%	0.56	S	S	*	*	H	α-helix	trans	-60.8	-42.2	176.7	-171.2	175.9	179.9	179.7	0	111.7	I91 K92 E93 F97 T98 D99	I91-K95 WeakPolarHBondContact O-CB 3.42Å; I91-K95 PolarHBondContact O-N 3.42Å; K92-K95 PolarHBondContact O-N 3.09Å; E93-K95 VanDerWaalsContact C-N 3.35Å; E93-K95 PolarHBondContact O-N 2.96Å; K95-F97 VanDerWaalsContact C-N 3.34Å; K95-F97 PolarHBondContact O-N 3.49Å; K95-T98 WeakPolarHBondContact CA-OG1 3.42Å; K95-T98 PolarHBondContact O-N 3.23Å; K95-T98 PolarHBondContact O-OG1 2.8Å; K95-D99 WeakPolarHBondContact O-CB 3.28Å; K95-D99 PolarHBondContact O-N 2.79Å
96	K	71.7	Confident	61.3	Low	156 Å²	156	117.3 Å²	117.3	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-63.4	-38.9	174.2	-72.5	179.1	178.7	-175.9	0	112.2	K92 E93 W94 K100	K92-K96 WeakPolarHBondContact O-CG 3.16Å; K92-K96 PolarHBondContact O-N 3.34Å; K92-K96 VanDerWaalsContact O-N 3.11Å; E93-K96 WeakPolarHBondContact O-CB 3.45Å; E93-K96 PolarHBondContact O-N 3.48Å; W94-K96 VanDerWaalsContact C-N 3.32Å; W94-K96 PolarHBondContact O-N 3.11Å; K96-K100 WeakPolarHBondContact O-CB 3.45Å; K96-K100 PolarHBondContact O-N 2.87Å; K96-K100 VanDerWaalsContact O-N 3.11Å
97	F	60.3	Low	59.7	Low	81 Å²	81	120.4 Å²	120.4	36%	0.355	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-46.3	177.5	-175.6	-92.6	0	0	0	111.7	E93 W94 K95 D99 K100 H101	E93-F97 PolarHBondContact O-N 2.59Å; W94-F97 WeakPolarHBondContact O-CB 3.43Å; W94-F97 PolarHBondContact O-N 3.15Å; W94-F97 VanDerWaalsContact O-N 3.14Å; K95-F97 VanDerWaalsContact C-N 3.34Å; K95-F97 PolarHBondContact O-N 3.49Å; F97-D99 PolarHBondContact O-N 3.23Å; F97-K100 PolarHBondContact O-N 3.46Å; F97-H101 AromaticContact CD2-CD2 3.52Å; F97-H101 AromaticContact CD2-NE2 3.83Å; F97-H101 AromaticContact CE1-CD2 3.94Å; F97-H101 AromaticContact CE2-CD2 3.29Å; F97-H101 WeakPolarHBondContact CE2-CD2 3.43Å; F97-H101 AromaticContact CE2-NE2 3.4Å; F97-H101 WeakPolarHBondContact CE2-NE2 3.4Å; F97-H101 AromaticContact CG-CD2 3.94Å; F97-H101 AromaticContact CZ-CD2 3.52Å; F97-H101 AromaticContact CZ-NE2 3.93Å; F97-H101 PolarHBondContact O-CD2 2.94Å; F97-H101 PolarHBondContact O-N 3.21Å
98	T	57.6	Low	57.9	Low	50 Å²	50	125.1 Å²	125.1	31%	0.307	60%	0.604	S	S	.	*	H	α-helix	trans	-62.5	-42.9	176.7	50.7	0	0	0	0	111.6	W94 K95 K100 H101 Y102	W94-T98 HydrophobicContact CE3-CG2 4.14Å; W94-T98 HydrophobicContact CZ3-CG2 4.47Å; W94-T98 PolarHBondContact O-N 3.35Å; W94-T98 PolarHBondContact O-OG1 3.46Å; K95-T98 WeakPolarHBondContact CA-OG1 3.42Å; K95-T98 PolarHBondContact O-N 3.23Å; K95-T98 PolarHBondContact O-OG1 2.8Å; T98-K100 VanDerWaalsContact C-N 3.28Å; T98-K100 PolarHBondContact O-N 3.25Å; T98-H101 PolarHBondContact O-N 3.22Å; T98-Y102 WeakPolarHBondContact O-CA 3.13Å; T98-Y102 WeakPolarHBondContact O-CB 3.39Å; T98-Y102 PolarHBondContact O-N 3.47Å
99	D	61.5	Low	55.9	Low	109 Å²	109	126.8 Å²	126.8	58%	0.583	62%	0.615	S	S	*	*	H	α-helix	trans	-66.3	-31.3	179.5	-70	-9.3	0	0	0	112	K95 F97	K95-D99 WeakPolarHBondContact O-CB 3.28Å; K95-D99 PolarHBondContact O-N 2.79Å; F97-D99 PolarHBondContact O-N 3.23Å
100	K	61.8	Low	53.7	Low	170 Å²	170	129.5 Å²	129.5	74%	0.739	63%	0.627	S	S	*	*	H	α-helix	trans	-78.5	-39.4	178.9	-167.3	-179.2	-178.6	-171.2	0	113.2	K96 F97 T98	K96-K100 WeakPolarHBondContact O-CB 3.45Å; K96-K100 PolarHBondContact O-N 2.87Å; K96-K100 VanDerWaalsContact O-N 3.11Å; F97-K100 PolarHBondContact O-N 3.46Å; T98-K100 VanDerWaalsContact C-N 3.28Å; T98-K100 PolarHBondContact O-N 3.25Å
101	H	51	Low	52.3	Low	111 Å²	111	131.7 Å²	131.7	51%	0.514	65%	0.646	S	S	.	*	H	α-helix	trans	-96.9	-22	-174.1	-72.2	-76.4	0	0	0	114.1	F97 T98	F97-H101 AromaticContact CD2-CD2 3.52Å; F97-H101 AromaticContact CD2-NE2 3.83Å; F97-H101 AromaticContact CE1-CD2 3.94Å; F97-H101 AromaticContact CE2-CD2 3.29Å; F97-H101 WeakPolarHBondContact CE2-CD2 3.43Å; F97-H101 AromaticContact CE2-NE2 3.4Å; F97-H101 WeakPolarHBondContact CE2-NE2 3.4Å; F97-H101 AromaticContact CG-CD2 3.94Å; F97-H101 AromaticContact CZ-CD2 3.52Å; F97-H101 AromaticContact CZ-NE2 3.93Å; F97-H101 PolarHBondContact O-CD2 2.94Å; F97-H101 PolarHBondContact O-N 3.21Å; T98-H101 PolarHBondContact O-N 3.22Å
102	Y	45.2	Very low	50.3	Low	158 Å²	158	132.9 Å²	132.9	62%	0.62	65%	0.649	S	S	*	*			trans	-117.6	69.9	177.7	-67.4	-92.8	0	0	0	108.9	T98 P104	T98-Y102 WeakPolarHBondContact O-CA 3.13Å; T98-Y102 WeakPolarHBondContact O-CB 3.39Å; T98-Y102 PolarHBondContact O-N 3.47Å; Y102-P104 VanDerWaalsContact O-CD 3.29Å; Y102-P104 WeakPolarHBondContact O-CD 3.29Å; Y102-P104 VanDerWaalsContact O-N 3.16Å
103	R	38.1	Very low	48.6	Very low	221 Å²	221	133.3 Å²	133.3	83%	0.834	66%	0.658	S	S	*	*			trans	-59.7	117.1	158.7	-156.1	-178.9	-151.8	-170.9	5.3	105.5	V105	R103-V105 PolarHBondContact O-N 2.94Å
104	P	40.9	Very low	47.2	Very low	113 Å²	113	136.7 Å²	136.7	73%	0.734	68%	0.677	S	S	*	*			trans	-57	119.7	177.2	22.1	-30.4	0	0	0	107.1	Y102 S106	Y102-P104 VanDerWaalsContact O-CD 3.29Å; Y102-P104 WeakPolarHBondContact O-CD 3.29Å; Y102-P104 VanDerWaalsContact O-N 3.16Å; P104-S106 VanDerWaalsContact C-N 3.34Å; P104-S106 PolarHBondContact O-N 3.2Å
105	V	34.8	Very low	45.4	Very low	140 Å²	140	138.3 Å²	138.3	85%	0.848	70%	0.695	S	S	*	*			trans	-59.6	101.8	176.9	175.1	0	0	0	0	106.5	R103 T107	R103-V105 PolarHBondContact O-N 2.94Å; V105-T107 PolarHBondContact O-N 2.89Å; V105-T107 VanDerWaalsContact O-N 3.15Å
106	S	38.8	Very low	43.6	Very low	100 Å²	100	139.3 Å²	139.3	70%	0.699	71%	0.706	S	S	*	*			trans	-60.5	112.5	168.8	47.1	0	0	0	0	107.4	P104 E108	P104-S106 VanDerWaalsContact C-N 3.34Å; P104-S106 PolarHBondContact O-N 3.2Å; S106-E108 VanDerWaalsContact C-N 3.35Å; S106-E108 PolarHBondContact O-N 3.38Å
107	T	32	Very low	41.8	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	71%	0.709	S	S	*	*			trans	-59.1	91	168.2	43.5	0	0	0	0	110.1	V105	V105-T107 PolarHBondContact O-N 2.89Å; V105-T107 VanDerWaalsContact O-N 3.15Å
108	E	36.7	Very low	40.5	Very low	183 Å²	183	144.2 Å²	144.2	86%	0.855	73%	0.729	S	S	*	*			trans	-142.4	131.2	162.3	-108.1	173.2	179.2	0	0	109.1	S106	S106-E108 VanDerWaalsContact C-N 3.35Å; S106-E108 PolarHBondContact O-N 3.38Å
109	N	33	Very low	39.4	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	76%	0.756	S	S	*	*			trans	-91	148.2	-153.7	-71.1	-68.3	0	0	0	114.6
110	K	32.1	Very low	37.9	Very low	168 Å²	168	149.6 Å²	149.6	73%	0.73	76%	0.761	S	S	*	*			trans	64.7	144.3	146.4	-78.4	-171.5	170.3	-156.6	0	118.8	E112	K110-E112 IonicContact NZ-OE1 3.13Å; K110-E112 PolarHBondContact NZ-OE1 3.31Å; K110-E112 VanDerWaalsContact NZ-OE1 3.13Å
111	P	39.6	Very low	36.3	Very low	117 Å²	117	149.2 Å²	149.2	76%	0.76	76%	0.762	S	S	*	*				-140.9	159	65.2	34.9	-13.1	0	0	0	113.4
112	E	33.4	Very low	35.3	Very low	142 Å²	142	152.9 Å²	152.9	66%	0.664	78%	0.779	S	S	*	*				51.3	132.7	71.2	-78.4	166.9	-138.1	0	0	114	K110	K110-E112 IonicContact NZ-OE1 3.13Å; K110-E112 PolarHBondContact NZ-OE1 3.31Å; K110-E112 VanDerWaalsContact NZ-OE1 3.13Å
113	D	37.9	Very low	34.3	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	79%	0.785	S	S	*	*			trans	85.4	108.4	173.3	-56.6	-27.3	0	0	0	119.5
114	I	42.2	Very low	33.8	Very low	162 Å²	162	149.4 Å²	149.4	83%	0.831	79%	0.786	S	S	*	*				158.9	105.6	113.7	-73.9	152.1	0	0	0	110
115	N	32.6	Very low	33.2	Very low	155 Å²	155	153.7 Å²	153.7	83%	0.829	80%	0.796	S	S	*	*			trans	-70.9	137.9	157.3	-81.2	-64	0	0	0	109.9
116	L	33.8	Very low	32.8	Very low	157 Å²	157	150.1 Å²	150.1	82%	0.822	79%	0.788	S	S	*	*			trans	-165.3	104.4	139.2	-129	98.3	0	0	0	113.8
117	K	35.5	Very low	32.2	Very low	173 Å²	173	151.2 Å²	151.2	75%	0.752	79%	0.79	S	S	*	*			trans	42.4	117.4	131.8	-66.3	-178.9	177.2	179.4	0	121.9
118	Q	32	Very low	32.1	Very low	167 Å²	167	150.3 Å²	150.3	78%	0.78	79%	0.79	S	S	*	*				68.7	101.6	123.6	-68.3	176.2	-42.8	0	0	120.1
119	S	34.3	Very low	31.8	Very low	124 Å²	124	146.7 Å²	146.7	87%	0.867	78%	0.78	S	S	*	*			trans	-139.3	113.5	132.9	57.7	0	0	0	0	108.5
120	H	29.3	Very low	31.6	Very low	148 Å²	148	144.6 Å²	144.6	69%	0.685	77%	0.773	S	S	*	*			trans	-69.5	160	-178.1	-121.2	-110.7	0	0	0	112.1
121	E	29.6	Very low	31.6	Very low	163 Å²	163	140.1 Å²	140.1	76%	0.762	76%	0.759	S	S	*	*			trans	73	85.5	149	-79.8	154	-157.5	0	0	119.5
122	Q	30.2	Very low	31.2	Very low	188 Å²	188	142.1 Å²	142.1	88%	0.879	76%	0.759	S	S	*	*				-169.9	119.8	117.9	-108.5	174	-6.7	0	0	111.4
123	C	24.6	Very low	31.2	Very low	110 Å²	110	137.3 Å²	137.3	74%	0.743	75%	0.747	S	S	*	*			trans	36.6	115.4	136.7	-78.3	0	0	0	0	120.6
124	K	27.5	Very low	30.9	Very low	195 Å²	195	136.8 Å²	136.8	85%	0.848	74%	0.74	S	S	*	*			trans	95	129.5	139.9	-62.3	176.3	179.6	-178.8	0	117.9	G126	K124-G126 PolarHBondContact O-N 2.93Å
125	E	27.2	Very low	30.5	Very low	204 Å²	204	136.8 Å²	136.8	95%	0.953	73%	0.73	S	S	*	*			trans	-39.1	103.8	168.6	-69.4	166	142.2	0	0	111.4
126	G	27.4	Very low	30.7	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	71%	0.714	S	S	*	*			trans	-113	86.7	173.9	0	0	0	0	0	108.7	K124 S128	K124-G126 PolarHBondContact O-N 2.93Å; G126-S128 PolarHBondContact O-N 2.96Å
127	T	26.4	Very low	30.7	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	71%	0.707	S	S	*	*			trans	-34	107.7	152.2	33.6	0	0	0	0	109.4	T129	T127-T129 PolarHBondContact O-N 3.23Å
128	S	29.7	Very low	30.7	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	71%	0.705	S	S	*	*			trans	-70.5	88.2	167.1	66.7	0	0	0	0	106.7	G126 V130	G126-S128 PolarHBondContact O-N 2.96Å; S128-V130 VanDerWaalsContact C-N 3.29Å; S128-V130 PolarHBondContact O-N 3.25Å
129	T	30.1	Very low	31.3	Very low	107 Å²	107	128.3 Å²	128.3	66%	0.656	69%	0.689	S	S	*	*			trans	-55.5	93	168	46.3	0	0	0	0	107.8	T127 T131	T127-T129 PolarHBondContact O-N 3.23Å; T129-T131 PolarHBondContact O-N 3.48Å
130	V	28.6	Very low	31.6	Very low	105 Å²	105	125.5 Å²	125.5	64%	0.636	66%	0.664	S	S	*	*			trans	-61.1	98	152.2	176.7	0	0	0	0	104.2	S128 E132 Y135	S128-V130 VanDerWaalsContact C-N 3.29Å; S128-V130 PolarHBondContact O-N 3.25Å; V130-E132 PolarHBondContact O-N 3.16Å; V130-E132 VanDerWaalsContact O-N 3.15Å; V130-Y135 HydrophobicContact CG1-CD2 4.12Å; V130-Y135 HydrophobicContact CG1-CE2 3.63Å
131	T	31	Very low	32.5	Very low	73 Å²	73	123.5 Å²	123.5	45%	0.448	66%	0.658	S	S	.	*			trans	-61.8	118.4	-178.2	38.9	0	0	0	0	107.4	T129 G133 Q134	T129-T131 PolarHBondContact O-N 3.48Å; T131-G133 PolarHBondContact O-N 3.34Å; T131-Q134 PolarHBondContact O-N 3.18Å; T131-Q134 VanDerWaalsContact O-N 3.08Å
132	E	32.8	Very low	33.4	Very low	160 Å²	160	118.1 Å²	118.1	75%	0.748	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-3.9	171.2	-84.1	-174.3	136.4	0	0	113.5	V130 K136	V130-E132 PolarHBondContact O-N 3.16Å; V130-E132 VanDerWaalsContact O-N 3.15Å; E132-K136 WeakPolarHBondContact O-CG 3.39Å
133	G	32.6	Very low	34.2	Very low	41 Å²	41	110.2 Å²	110.2	42%	0.423	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76	-39.1	171.9	0	0	0	0	0	114.6	T131 Y135 K136	T131-G133 PolarHBondContact O-N 3.34Å; G133-Y135 PolarHBondContact O-N 2.93Å; G133-K136 PolarHBondContact O-N 3.4Å; G133-K136 VanDerWaalsContact O-N 3.17Å
134	Q	32.1	Very low	35.4	Very low	138 Å²	138	107.5 Å²	107.5	65%	0.645	58%	0.579	S	S	*	*	H	α-helix	trans	-74.5	-26.1	-174.8	-97.8	166.7	-32.3	0	0	113.6	T131 K136	T131-Q134 PolarHBondContact O-N 3.18Å; T131-Q134 VanDerWaalsContact O-N 3.08Å; Q134-K136 VanDerWaalsContact C-N 3.29Å; Q134-K136 PolarHBondContact O-N 3.37Å
135	Y	32.3	Very low	36.5	Very low	161 Å²	161	102.1 Å²	102.1	63%	0.631	56%	0.56	S	S	*	*	H	α-helix	trans	-76.3	-15.5	172.2	-81.8	-86.2	0	0	0	113.6	V130 G133	V130-Y135 HydrophobicContact CG1-CD2 4.12Å; V130-Y135 HydrophobicContact CG1-CE2 3.63Å; G133-Y135 PolarHBondContact O-N 2.93Å
136	K	37.5	Very low	37.4	Very low	113 Å²	113	95.2 Å²	95.2	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-75.6	-43	-179.2	-78.3	176.2	-177.2	175.1	0	110.9	E132 G133 Q134 I140	E132-K136 WeakPolarHBondContact O-CG 3.39Å; G133-K136 PolarHBondContact O-N 3.4Å; G133-K136 VanDerWaalsContact O-N 3.17Å; Q134-K136 VanDerWaalsContact C-N 3.29Å; Q134-K136 PolarHBondContact O-N 3.37Å; K136-I140 HydrophobicContact CB-CD1 4.48Å; K136-I140 WeakPolarHBondContact O-CD1 3.39Å; K136-I140 WeakPolarHBondContact O-CG1 3.39Å; K136-I140 PolarHBondContact O-N 3.06Å
137	E	34.9	Very low	38.5	Very low	144 Å²	144	92.9 Å²	92.9	67%	0.673	51%	0.506	S	S	*	.	H	α-helix	trans	-71.2	-42.7	-175.1	-73.2	165.9	174.8	0	0	112.3	L139 I140	E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.48Å; E137-I140 PolarHBondContact O-N 2.89Å
138	D	35.8	Very low	39.4	Very low	131 Å²	131	89.6 Å²	89.6	70%	0.701	49%	0.486	S	S	*	.	H	α-helix	trans	-69.6	-22.4	-179.5	-76.6	-16.2	0	0	0	114.4
139	L	42.6	Very low	40.1	Very low	86 Å²	86	92.5 Å²	92.5	45%	0.45	48%	0.481	S	S	.	.	H	α-helix	trans	-87.4	-20.5	173.9	-101.2	91.3	0	0	0	113.4	E137 P142 V143 M199	E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.48Å; L139-P142 WeakPolarHBondContact O-CD 3.48Å; L139-V143 WeakPolarHBondContact O-CG2 3.28Å; L139-M199 HydrophobicContact CD2-SD 3.8Å
140	I	42.2	Very low	40.8	Very low	65 Å²	65	92.9 Å²	92.9	33%	0.333	48%	0.475	S	S	.	.	H	α-helix	trans	-73.4	-39.3	-176.2	-75.4	163	0	0	0	110.6	K136 E137 V143 L144	K136-I140 HydrophobicContact CB-CD1 4.48Å; K136-I140 WeakPolarHBondContact O-CD1 3.39Å; K136-I140 WeakPolarHBondContact O-CG1 3.39Å; K136-I140 PolarHBondContact O-N 3.06Å; E137-I140 PolarHBondContact O-N 2.89Å; I140-V143 PolarHBondContact O-N 2.65Å; I140-V143 VanDerWaalsContact O-N 3.17Å; I140-L144 HydrophobicContact CG2-CD1 3.72Å; I140-L144 WeakPolarHBondContact O-CB 3.35Å; I140-L144 PolarHBondContact O-N 3.46Å
141	D	48.2	Very low	41.8	Very low	107 Å²	107	88.6 Å²	88.6	57%	0.572	45%	0.448	S	S	*	.	H	α-helix	trans	-57.1	-46.3	-177.8	-94.2	-6.7	0	0	0	116	V143 N145	D141-V143 VanDerWaalsContact C-N 3.35Å; D141-N145 WeakPolarHBondContact O-CB 3.42Å; D141-N145 PolarHBondContact O-N 3.41Å; D141-N145 VanDerWaalsContact O-N 3.1Å; D141-N145 PolarHBondContact O-ND2 2.92Å; D141-N145 VanDerWaalsContact O-ND2 3.09Å
142	P	47.5	Very low	42.7	Very low	50 Å²	50	89.2 Å²	89.2	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-70.9	-30.7	176.8	22.8	-30.1	0	0	0	112.5	L139 N145 C146	L139-P142 WeakPolarHBondContact O-CD 3.48Å; P142-N145 PolarHBondContact O-N 3.19Å; P142-C146 PolarHBondContact O-N 3.14Å; P142-C146 PolarHBondContact O-SG 3.37Å
143	V	48.1	Very low	43.3	Very low	22 Å²	22	86.9 Å²	86.9	13%	0.133	43%	0.43	C	S	.	.	H	α-helix	trans	-73.6	-41.5	177.8	177.5	0	0	0	0	111	L139 I140 D141 N145 C146 L147 M192 M199	L139-V143 WeakPolarHBondContact O-CG2 3.28Å; I140-V143 PolarHBondContact O-N 2.65Å; I140-V143 VanDerWaalsContact O-N 3.17Å; D141-V143 VanDerWaalsContact C-N 3.35Å; V143-N145 PolarHBondContact O-N 3.28Å; V143-C146 WeakPolarHBondContact O-CB 3.29Å; V143-C146 PolarHBondContact O-N 2.93Å; V143-L147 PolarHBondContact O-N 3.43Å; V143-M192 HydrophobicContact CG1-CE 4.47Å; V143-M192 HydrophobicContact CG1-SD 4.1Å; V143-M199 HydrophobicContact CG2-CE 3.77Å
144	L	48.8	Very low	43.8	Very low	52 Å²	52	88.8 Å²	88.8	27%	0.272	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-37	173.1	-122.7	81.8	0	0	0	111.2	I140 C146 L147 R152	I140-L144 HydrophobicContact CG2-CD1 3.72Å; I140-L144 WeakPolarHBondContact O-CB 3.35Å; I140-L144 PolarHBondContact O-N 3.46Å; L144-C146 PolarHBondContact O-N 3.32Å; L144-L147 HydrophobicContact CD1-CD1 4.39Å; L144-L147 HydrophobicContact CG-CD1 4.4Å; L144-L147 PolarHBondContact O-N 3.38Å; L144-R152 PolarHBondContact O-NE 3.2Å
145	N	51.4	Low	44.3	Very low	82 Å²	82	84.1 Å²	84.1	44%	0.439	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.1	174.6	-82.3	-46.3	0	0	0	114.3	D141 P142 V143 R152	D141-N145 WeakPolarHBondContact O-CB 3.42Å; D141-N145 PolarHBondContact O-N 3.41Å; D141-N145 VanDerWaalsContact O-N 3.1Å; D141-N145 PolarHBondContact O-ND2 2.92Å; D141-N145 VanDerWaalsContact O-ND2 3.09Å; P142-N145 PolarHBondContact O-N 3.19Å; V143-N145 PolarHBondContact O-N 3.28Å; N145-R152 PolarHBondContact O-NH2 2.99Å; N145-R152 PolarHBondContact OD1-NH1 3.4Å; N145-R152 PolarHBondContact OD1-NH2 2.87Å
146	C	45.6	Very low	44.5	Very low	59 Å²	59	79.5 Å²	79.5	40%	0.399	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-10	173.2	-65.7	0	0	0	0	113.1	P142 V143 L144	P142-C146 PolarHBondContact O-N 3.14Å; P142-C146 PolarHBondContact O-SG 3.37Å; V143-C146 WeakPolarHBondContact O-CB 3.29Å; V143-C146 PolarHBondContact O-N 2.93Å; L144-C146 PolarHBondContact O-N 3.32Å
147	L	50.1	Low	44.4	Very low	17 Å²	17	77.3 Å²	77.3	9%	0.089	39%	0.391	C	S	.	.	S	Bend	trans	-76.6	139.1	-179	-71.4	167.2	0	0	0	111.6	V143 L144 L151 R152 L155 Y191	V143-L147 PolarHBondContact O-N 3.43Å; L144-L147 HydrophobicContact CD1-CD1 4.39Å; L144-L147 HydrophobicContact CG-CD1 4.4Å; L144-L147 PolarHBondContact O-N 3.38Å; L147-L151 HydrophobicContact CB-CB 4.15Å; L147-L151 HydrophobicContact CD2-CB 4.19Å; L147-L151 HydrophobicContact CD2-CD1 4.1Å; L147-R152 HydrophobicContact CB-CG 3.93Å; L147-R152 PolarHBondContact O-NE 3.01Å; L147-R152 VanDerWaalsContact O-NE 3.1Å; L147-L155 HydrophobicContact CD1-CD1 3.37Å; L147-Y191 HydrophobicContact CD2-CE1 4.43Å
148	P	45.3	Very low	44.5	Very low	53 Å²	53	72.4 Å²	72.4	34%	0.344	37%	0.371	S	S	.	.			trans	-50.7	148.3	167.3	-26.4	33.8	0	0	0	112.3	H150 L151 R152	P148-H150 WeakPolarHBondContact CB-CE1 3.45Å; P148-H150 PolarHBondContact O-N 2.92Å; P148-H150 VanDerWaalsContact O-N 3.09Å; P148-L151 HydrophobicContact CG-CD1 4.14Å; P148-L151 PolarHBondContact O-N 3.12Å; P148-R152 PolarHBondContact O-N 3.28Å
149	Y	44.4	Very low	44.6	Very low	177 Å²	177	70.2 Å²	70.2	69%	0.694	36%	0.362	S	S	*	.	H	α-helix	trans	-52.6	-36.9	-175.7	177.4	-98.4	0	0	0	113.7	R152 K153	Y149-R152 PolarHBondContact O-N 2.93Å; Y149-K153 HydrophobicContact CE1-CD 4.24Å; Y149-K153 VanDerWaalsContact O-CB 3.3Å; Y149-K153 WeakPolarHBondContact O-CB 3.34Å; Y149-K153 PolarHBondContact O-N 2.84Å
150	H	45.8	Very low	44.3	Very low	115 Å²	115	72.4 Å²	72.4	53%	0.532	37%	0.37	S	S	.	.	H	α-helix	trans	-67	-39.4	178	58.7	-92.3	0	0	0	112.6	P148 K153 L154	P148-H150 WeakPolarHBondContact CB-CE1 3.45Å; P148-H150 PolarHBondContact O-N 2.92Å; P148-H150 VanDerWaalsContact O-N 3.09Å; H150-K153 PolarHBondContact O-N 3Å; H150-L154 WeakPolarHBondContact O-CG 3.26Å; H150-L154 PolarHBondContact O-N 3.45Å
151	L	48.8	Very low	44.1	Very low	14 Å²	14	72.7 Å²	72.7	7%	0.073	37%	0.372	C	S	.	.	H	α-helix	trans	-71.4	-38.6	175.2	-81.3	163.3	0	0	0	111.3	L147 P148 K153 L154 L155 W187	L147-L151 HydrophobicContact CB-CB 4.15Å; L147-L151 HydrophobicContact CD2-CB 4.19Å; L147-L151 HydrophobicContact CD2-CD1 4.1Å; P148-L151 HydrophobicContact CG-CD1 4.14Å; P148-L151 PolarHBondContact O-N 3.12Å; L151-K153 VanDerWaalsContact C-N 3.31Å; L151-K153 PolarHBondContact O-N 3.41Å; L151-L154 PolarHBondContact O-N 2.77Å; L151-L155 WeakPolarHBondContact O-CB 3.34Å; L151-L155 WeakPolarHBondContact O-CD1 3.32Å; L151-L155 PolarHBondContact O-N 2.99Å; L151-W187 HydrophobicContact CD1-CH2 4.27Å; L151-W187 HydrophobicContact CD1-CZ3 4.3Å; L151-W187 HydrophobicContact CD2-CH2 4.47Å; L151-W187 HydrophobicContact CD2-CZ3 3.73Å
152	R	49.3	Very low	43.5	Very low	87 Å²	87	74.1 Å²	74.1	33%	0.328	38%	0.38	S	S	.	.	H	α-helix	trans	-58.4	-46.9	169.7	-69.2	-169.9	-165.9	-158.3	8.6	110.7	L144 N145 L147 P148 Y149 L154 L155 T156	L144-R152 PolarHBondContact O-NE 3.2Å; N145-R152 PolarHBondContact O-NH2 2.99Å; N145-R152 PolarHBondContact OD1-NH1 3.4Å; N145-R152 PolarHBondContact OD1-NH2 2.87Å; L147-R152 HydrophobicContact CB-CG 3.93Å; L147-R152 PolarHBondContact O-NE 3.01Å; L147-R152 VanDerWaalsContact O-NE 3.1Å; P148-R152 PolarHBondContact O-N 3.28Å; Y149-R152 PolarHBondContact O-N 2.93Å; R152-L154 PolarHBondContact O-N 3.45Å; R152-L155 CarbonylContact O-C 3.2Å; R152-L155 PolarHBondContact O-N 3.47Å; R152-T156 WeakPolarHBondContact O-CB 3.32Å; R152-T156 PolarHBondContact O-N 3.43Å; R152-T156 PolarHBondContact O-OG1 2.86Å
153	K	45.8	Very low	43	Very low	111 Å²	111	80.9 Å²	80.9	48%	0.483	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-43	-179.7	-164.9	178.7	-179.5	-177	0	111.5	Y149 H150 L151 T156 I157	Y149-K153 HydrophobicContact CE1-CD 4.24Å; Y149-K153 VanDerWaalsContact O-CB 3.3Å; Y149-K153 WeakPolarHBondContact O-CB 3.34Å; Y149-K153 PolarHBondContact O-N 2.84Å; H150-K153 PolarHBondContact O-N 3Å; L151-K153 VanDerWaalsContact C-N 3.31Å; L151-K153 PolarHBondContact O-N 3.41Å; K153-T156 PolarHBondContact O-N 3.06Å; K153-I157 HydrophobicContact CG-CD1 3.88Å; K153-I157 HydrophobicContact CG-CG1 4.4Å; K153-I157 WeakPolarHBondContact O-CB 3.27Å; K153-I157 WeakPolarHBondContact O-CD1 3.43Å; K153-I157 WeakPolarHBondContact O-CG1 3.46Å; K153-I157 PolarHBondContact O-N 3.22Å
154	L	42.3	Very low	42.5	Very low	81 Å²	81	82.8 Å²	82.8	42%	0.424	42%	0.422	S	S	.	.	H	α-helix	trans	-60.1	-44.7	173.2	-77.9	160.7	0	0	0	112.1	H150 L151 R152 T156 T158	H150-L154 WeakPolarHBondContact O-CG 3.26Å; H150-L154 PolarHBondContact O-N 3.45Å; L151-L154 PolarHBondContact O-N 2.77Å; R152-L154 PolarHBondContact O-N 3.45Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 3.48Å; L154-T158 WeakPolarHBondContact O-CG2 3.35Å; L154-T158 PolarHBondContact O-N 3.47Å; L154-T158 VanDerWaalsContact O-N 3.14Å; L154-T158 PolarHBondContact O-OG1 2.97Å
155	L	43.1	Very low	41.9	Very low	40 Å²	40	86.8 Å²	86.8	21%	0.209	44%	0.443	C	S	.	.	H	α-helix	trans	-67.6	-29.7	175.7	-89.5	142.4	0	0	0	113.7	L147 L151 R152 T158 T159	L147-L155 HydrophobicContact CD1-CD1 3.37Å; L151-L155 WeakPolarHBondContact O-CB 3.34Å; L151-L155 WeakPolarHBondContact O-CD1 3.32Å; L151-L155 PolarHBondContact O-N 2.99Å; R152-L155 CarbonylContact O-C 3.2Å; R152-L155 PolarHBondContact O-N 3.47Å; L155-T158 WeakPolarHBondContact CA-OG1 3.13Å; L155-T158 PolarHBondContact O-OG1 3.38Å; L155-T159 WeakPolarHBondContact O-CG2 3.47Å; L155-T159 PolarHBondContact O-N 2.86Å; L155-T159 PolarHBondContact O-OG1 3.48Å
156	T	37.4	Very low	41.2	Very low	64 Å²	64	90.8 Å²	90.8	39%	0.393	46%	0.464	S	S	.	.	H	α-helix	trans	-79.4	-39.6	179.3	-39.7	0	0	0	0	110.6	R152 K153 L154 T158 T159 E160	R152-T156 WeakPolarHBondContact O-CB 3.32Å; R152-T156 PolarHBondContact O-N 3.43Å; R152-T156 PolarHBondContact O-OG1 2.86Å; K153-T156 PolarHBondContact O-N 3.06Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 3.48Å; T156-T158 VanDerWaalsContact C-N 3.33Å; T156-T158 PolarHBondContact O-N 2.84Å; T156-T159 WeakPolarHBondContact CA-OG1 3.45Å; T156-T159 PolarHBondContact O-N 3.45Å; T156-T159 VanDerWaalsContact O-N 3.15Å; T156-T159 PolarHBondContact O-OG1 3.11Å; T156-E160 PolarHBondContact O-N 2.9Å; T156-E160 VanDerWaalsContact O-N 3.11Å
157	I	35.6	Very low	40.7	Very low	67 Å²	67	95.5 Å²	95.5	34%	0.344	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-46.1	174	-70.1	164.7	0	0	0	109.6	K153 T159 E160 D161	K153-I157 HydrophobicContact CG-CD1 3.88Å; K153-I157 HydrophobicContact CG-CG1 4.4Å; K153-I157 WeakPolarHBondContact O-CB 3.27Å; K153-I157 WeakPolarHBondContact O-CD1 3.43Å; K153-I157 WeakPolarHBondContact O-CG1 3.46Å; K153-I157 PolarHBondContact O-N 3.22Å; I157-T159 PolarHBondContact O-N 3.37Å; I157-E160 PolarHBondContact O-N 3.36Å; I157-D161 VanDerWaalsContact CG2-OD2 3.29Å; I157-D161 WeakPolarHBondContact CG2-OD2 3.36Å; I157-D161 WeakPolarHBondContact O-CB 3.38Å; I157-D161 PolarHBondContact O-N 3.08Å
158	T	37.3	Very low	40	Very low	40 Å²	40	101.1 Å²	101.1	25%	0.245	52%	0.516	C	S	.	.	H	α-helix	trans	-63	-27.8	177.7	51.5	0	0	0	0	113.6	L154 L155 T156 D162	L154-T158 WeakPolarHBondContact O-CG2 3.35Å; L154-T158 PolarHBondContact O-N 3.47Å; L154-T158 VanDerWaalsContact O-N 3.14Å; L154-T158 PolarHBondContact O-OG1 2.97Å; L155-T158 WeakPolarHBondContact CA-OG1 3.13Å; L155-T158 PolarHBondContact O-OG1 3.38Å; T156-T158 VanDerWaalsContact C-N 3.33Å; T156-T158 PolarHBondContact O-N 2.84Å; T158-D162 VanDerWaalsContact O-CB 3.28Å; T158-D162 WeakPolarHBondContact O-CB 3.45Å; T158-D162 PolarHBondContact O-N 3.25Å
159	T	38	Very low	39.3	Very low	85 Å²	85	106.2 Å²	106.2	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-86	-22.3	179.2	51.8	0	0	0	0	114.6	L155 T156 I157	L155-T159 WeakPolarHBondContact O-CG2 3.47Å; L155-T159 PolarHBondContact O-N 2.86Å; L155-T159 PolarHBondContact O-OG1 3.48Å; T156-T159 WeakPolarHBondContact CA-OG1 3.45Å; T156-T159 PolarHBondContact O-N 3.45Å; T156-T159 VanDerWaalsContact O-N 3.15Å; T156-T159 PolarHBondContact O-OG1 3.11Å; I157-T159 PolarHBondContact O-N 3.37Å
160	E	36.1	Very low	38.9	Very low	133 Å²	133	103.7 Å²	103.7	62%	0.621	54%	0.544	S	S	*	.	H	α-helix	trans	-90.6	-37.3	177.2	-74.3	-176.6	158.1	0	0	111.3	T156 I157 K163 A164	T156-E160 PolarHBondContact O-N 2.9Å; T156-E160 VanDerWaalsContact O-N 3.11Å; I157-E160 PolarHBondContact O-N 3.36Å; E160-K163 PolarHBondContact O-N 2.96Å; E160-A164 PolarHBondContact O-N 2.93Å
161	D	38	Very low	38.3	Very low	71 Å²	71	106.9 Å²	106.9	38%	0.38	56%	0.558	S	S	.	*	H	α-helix	trans	-74.9	-29.1	177.4	-73.4	-25.7	0	0	0	112.4	I157 K163 A164 L165	I157-D161 VanDerWaalsContact CG2-OD2 3.29Å; I157-D161 WeakPolarHBondContact CG2-OD2 3.36Å; I157-D161 WeakPolarHBondContact O-CB 3.38Å; I157-D161 PolarHBondContact O-N 3.08Å; D161-K163 PolarHBondContact O-N 2.97Å; D161-K163 VanDerWaalsContact O-N 3.12Å; D161-A164 PolarHBondContact O-N 3.32Å; D161-L165 HydrophobicContact CB-CD1 3.82Å; D161-L165 WeakPolarHBondContact O-CB 3.3Å; D161-L165 PolarHBondContact O-N 3.47Å
162	D	34.4	Very low	38	Very low	137 Å²	137	112.2 Å²	112.2	73%	0.733	60%	0.597	S	S	*	*	H	α-helix	trans	-64.9	-14.1	169.6	-84.1	-13.9	0	0	0	113.4	T158	T158-D162 VanDerWaalsContact O-CB 3.28Å; T158-D162 WeakPolarHBondContact O-CB 3.45Å; T158-D162 PolarHBondContact O-N 3.25Å
163	K	37.7	Very low	37.4	Very low	192 Å²	192	112.8 Å²	112.8	84%	0.835	61%	0.61	S	S	*	*	H	α-helix	trans	-98.5	-15.3	170.8	-79.6	-178.9	178.2	174.8	0	113.6	E160 D161	E160-K163 PolarHBondContact O-N 2.96Å; D161-K163 PolarHBondContact O-N 2.97Å; D161-K163 VanDerWaalsContact O-N 3.12Å
164	A	37.6	Very low	36.9	Very low	61 Å²	61	109.1 Å²	109.1	50%	0.504	60%	0.604	S	S	.	*	H	α-helix	trans	-111.5	-14.9	-174.5	0	0	0	0	0	114.3	E160 D161 N166	E160-A164 PolarHBondContact O-N 2.93Å; D161-A164 PolarHBondContact O-N 3.32Å; A164-N166 PolarHBondContact O-N 3.33Å; A164-N166 VanDerWaalsContact O-N 3.11Å
165	L	36.7	Very low	36.5	Very low	136 Å²	136	113 Å²	113	71%	0.712	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	12.5	-175.6	-116.8	102.9	0	0	0	116.1	D161 E167	D161-L165 HydrophobicContact CB-CD1 3.82Å; D161-L165 WeakPolarHBondContact O-CB 3.3Å; D161-L165 PolarHBondContact O-N 3.47Å; L165-E167 VanDerWaalsContact C-N 3.32Å
166	N	36	Very low	36.2	Very low	166 Å²	166	117.6 Å²	117.6	89%	0.888	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-0.9	172.6	-92.6	-17.3	0	0	0	113.9	A164	A164-N166 PolarHBondContact O-N 3.33Å; A164-N166 VanDerWaalsContact O-N 3.11Å
167	E	34.4	Very low	36	Very low	159 Å²	159	118.6 Å²	118.6	74%	0.743	65%	0.645	S	S	*	*	S	Bend	trans	-136.7	127.5	-177.3	-67.2	-177	171.9	0	0	111.3	L165	L165-E167 VanDerWaalsContact C-N 3.32Å
168	T	36.4	Very low	36.1	Very low	135 Å²	135	120.9 Å²	120.9	83%	0.828	65%	0.654	S	S	*	*			trans	87.6	104.6	162.3	63.5	0	0	0	0	119.2	T170	T168-T170 PolarHBondContact O-N 3.49Å
169	N	30.2	Very low	35.8	Very low	159 Å²	159	124.4 Å²	124.4	85%	0.85	67%	0.671	S	S	*	*			trans	-48.4	116.9	162.7	-59.4	-35.9	0	0	0	112.4
170	T	37.2	Very low	35.8	Very low	125 Å²	125	127 Å²	127	77%	0.767	68%	0.677	S	S	*	*			trans	-137.7	91.5	154.4	30.4	0	0	0	0	109	T168	T168-T170 PolarHBondContact O-N 3.49Å
171	E	32.2	Very low	35.8	Very low	181 Å²	181	124.1 Å²	124.1	85%	0.846	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	149.3	172.4	-67.8	170.5	149	0	0	110.9
172	S	41.7	Very low	35.9	Very low	126 Å²	126	125.7 Å²	125.7	88%	0.881	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	98.6	-9	165	83.3	0	0	0	0	119.9
173	T	37	Very low	36.2	Very low	100 Å²	100	126.1 Å²	126.1	61%	0.613	67%	0.669	S	S	*	*	S	Bend	trans	-115.3	-9.7	170.6	-1.4	0	0	0	0	113.8	I177	T173-I177 WeakPolarHBondContact O-CD1 3.45Å; T173-I177 WeakPolarHBondContact O-CG1 3.31Å
174	G	35.1	Very low	36.6	Very low	33 Å²	33	118.8 Å²	118.8	34%	0.34	64%	0.642	S	S	.	*	H	α-helix	trans	-74.7	-26.8	-172.2	0	0	0	0	0	116.2	I177 Q178	G174-I177 PolarHBondContact O-N 2.86Å; G174-Q178 VanDerWaalsContact O-CB 3.31Å; G174-Q178 WeakPolarHBondContact O-CB 3.49Å; G174-Q178 VanDerWaalsContact O-CG 3.28Å; G174-Q178 WeakPolarHBondContact O-CG 3.28Å; G174-Q178 PolarHBondContact O-N 3.05Å
175	E	33.9	Very low	37.1	Very low	162 Å²	162	120 Å²	120	76%	0.757	64%	0.637	S	S	*	*	H	α-helix	trans	-73.4	-34.7	-172.4	-74.9	-176.3	156.7	0	0	113.9	L179	E175-L179 PolarHBondContact O-N 3.49Å
176	I	37.3	Very low	37.8	Very low	137 Å²	137	117.2 Å²	117.2	70%	0.703	63%	0.629	S	S	*	*	H	α-helix	trans	-76.7	-34.6	178.1	-59.3	175.3	0	0	0	110.3	Q180	I176-Q180 PolarHBondContact O-N 3.3Å
177	I	34.2	Very low	38.6	Very low	86 Å²	86	114 Å²	114	44%	0.441	60%	0.604	S	S	.	*	H	α-helix	trans	-71.3	-41.9	178	-60.7	173.6	0	0	0	110.1	T173 G174 L179 Q180 E181	T173-I177 WeakPolarHBondContact O-CD1 3.45Å; T173-I177 WeakPolarHBondContact O-CG1 3.31Å; G174-I177 PolarHBondContact O-N 2.86Å; I177-L179 PolarHBondContact O-N 3.44Å; I177-Q180 PolarHBondContact O-N 3.36Å; I177-E181 HydrophobicContact CG2-CG 4.34Å; I177-E181 WeakPolarHBondContact O-CB 3.39Å; I177-E181 WeakPolarHBondContact O-CG 3.41Å; I177-E181 PolarHBondContact O-N 3.46Å
178	Q	35.7	Very low	39.6	Very low	114 Å²	114	107.7 Å²	107.7	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-62.9	-40.9	176.4	-80.5	-177.2	-2.7	0	0	113.1	G174 Q180 E181 I182	G174-Q178 VanDerWaalsContact O-CB 3.31Å; G174-Q178 WeakPolarHBondContact O-CB 3.49Å; G174-Q178 VanDerWaalsContact O-CG 3.28Å; G174-Q178 WeakPolarHBondContact O-CG 3.28Å; G174-Q178 PolarHBondContact O-N 3.05Å; Q178-Q180 VanDerWaalsContact C-N 3.35Å; Q178-Q180 PolarHBondContact O-N 2.85Å; Q178-E181 PolarHBondContact O-N 2.78Å; Q178-I182 WeakPolarHBondContact O-CB 3.22Å; Q178-I182 WeakPolarHBondContact O-CD1 3.31Å; Q178-I182 WeakPolarHBondContact O-CG1 3.32Å; Q178-I182 PolarHBondContact O-N 3.06Å
179	L	32.9	Very low	40.5	Very low	115 Å²	115	106.3 Å²	106.3	60%	0.602	56%	0.563	S	S	*	*	H	α-helix	trans	-64.7	-39.9	177.1	-92.2	155.7	0	0	0	112.2	E175 I177 I182 E183	E175-L179 PolarHBondContact O-N 3.49Å; I177-L179 PolarHBondContact O-N 3.44Å; L179-I182 PolarHBondContact O-N 3.38Å; L179-E183 PolarHBondContact O-N 3.24Å
180	Q	36.4	Very low	42.1	Very low	139 Å²	139	103 Å²	103	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-72.7	-31.7	177.6	-155.1	170.3	8.1	0	0	112	I176 I177 Q178 S184	I176-Q180 PolarHBondContact O-N 3.3Å; I177-Q180 PolarHBondContact O-N 3.36Å; Q178-Q180 VanDerWaalsContact C-N 3.35Å; Q178-Q180 PolarHBondContact O-N 2.85Å; Q180-S184 VanDerWaalsContact O-CB 3.26Å; Q180-S184 WeakPolarHBondContact O-CB 3.39Å; Q180-S184 PolarHBondContact O-N 3.04Å; Q180-S184 PolarHBondContact O-OG 3.36Å
181	E	37.6	Very low	43	Very low	73 Å²	73	99.5 Å²	99.5	34%	0.341	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-41.3	170.5	-79.8	173.6	171.3	0	0	112.4	I177 Q178 S184 Q185	I177-E181 HydrophobicContact CG2-CG 4.34Å; I177-E181 WeakPolarHBondContact O-CB 3.39Å; I177-E181 WeakPolarHBondContact O-CG 3.41Å; I177-E181 PolarHBondContact O-N 3.46Å; Q178-E181 PolarHBondContact O-N 2.78Å; E181-S184 WeakPolarHBondContact CA-OG 3.18Å; E181-S184 PolarHBondContact O-N 2.97Å; E181-S184 PolarHBondContact O-OG 3.49Å; E181-Q185 VanDerWaalsContact O-CB 3.27Å; E181-Q185 WeakPolarHBondContact O-CB 3.36Å; E181-Q185 VanDerWaalsContact O-CG 3.32Å; E181-Q185 WeakPolarHBondContact O-CG 3.06Å; E181-Q185 PolarHBondContact O-N 2.9Å
182	I	39.7	Very low	44.2	Very low	104 Å²	104	93.2 Å²	93.2	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-44	178.4	-68.2	161.5	0	0	0	111.1	Q178 L179 Q185 S186	Q178-I182 WeakPolarHBondContact O-CB 3.22Å; Q178-I182 WeakPolarHBondContact O-CD1 3.31Å; Q178-I182 WeakPolarHBondContact O-CG1 3.32Å; Q178-I182 PolarHBondContact O-N 3.06Å; L179-I182 PolarHBondContact O-N 3.38Å; I182-Q185 PolarHBondContact O-N 3.1Å; I182-S186 WeakPolarHBondContact O-CB 3.39Å; I182-S186 PolarHBondContact O-N 3.3Å
183	E	40.6	Very low	45	Very low	145 Å²	145	90.1 Å²	90.1	68%	0.678	47%	0.465	S	S	*	.	H	α-helix	trans	-65.1	-41.6	176.4	-78.6	-171.9	162.1	0	0	111.8	L179 S186 W187	L179-E183 PolarHBondContact O-N 3.24Å; E183-S186 PolarHBondContact O-N 3.37Å; E183-W187 PolarHBondContact O-N 3.3Å; E183-W187 VanDerWaalsContact O-N 3.08Å
184	S	45.3	Very low	46.1	Very low	39 Å²	39	89.9 Å²	89.9	27%	0.273	45%	0.453	S	S	.	.	H	α-helix	trans	-68.5	-37.3	177	59.3	0	0	0	0	112.5	Q180 E181 W187 I188	Q180-S184 VanDerWaalsContact O-CB 3.26Å; Q180-S184 WeakPolarHBondContact O-CB 3.39Å; Q180-S184 PolarHBondContact O-N 3.04Å; Q180-S184 PolarHBondContact O-OG 3.36Å; E181-S184 WeakPolarHBondContact CA-OG 3.18Å; E181-S184 PolarHBondContact O-N 2.97Å; E181-S184 PolarHBondContact O-OG 3.49Å; S184-W187 PolarHBondContact O-N 3.04Å; S184-I188 WeakPolarHBondContact O-CB 3.25Å; S184-I188 WeakPolarHBondContact O-CD1 3.48Å; S184-I188 WeakPolarHBondContact O-CG1 3.06Å; S184-I188 PolarHBondContact O-N 3.44Å
185	Q	48.1	Very low	47.1	Very low	86 Å²	86	89 Å²	89	40%	0.402	44%	0.441	S	S	.	.	H	α-helix	trans	-67	-40.3	174.4	-82.3	170	-11.9	0	0	112.7	E181 I182 W187 I188 N189	E181-Q185 VanDerWaalsContact O-CB 3.27Å; E181-Q185 WeakPolarHBondContact O-CB 3.36Å; E181-Q185 VanDerWaalsContact O-CG 3.32Å; E181-Q185 WeakPolarHBondContact O-CG 3.06Å; E181-Q185 PolarHBondContact O-N 2.9Å; I182-Q185 PolarHBondContact O-N 3.1Å; Q185-W187 VanDerWaalsContact C-N 3.32Å; Q185-W187 PolarHBondContact O-N 3.03Å; Q185-I188 PolarHBondContact O-N 3.18Å; Q185-N189 VanDerWaalsContact O-CB 3.28Å; Q185-N189 WeakPolarHBondContact O-CB 3.33Å; Q185-N189 VanDerWaalsContact O-CG 3.24Å; Q185-N189 PolarHBondContact O-N 3.19Å; Q185-N189 PolarHBondContact O-ND2 3.29Å
186	S	52.1	Low	48.2	Very low	78 Å²	78	87.3 Å²	87.3	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-57.9	-47.8	173.3	-177.2	0	0	0	0	110.7	I182 E183 N189 E190	I182-S186 WeakPolarHBondContact O-CB 3.39Å; I182-S186 PolarHBondContact O-N 3.3Å; E183-S186 PolarHBondContact O-N 3.37Å; S186-N189 PolarHBondContact O-N 3.33Å; S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 3.12Å
187	W	53	Low	49.4	Very low	97 Å²	97	84.3 Å²	84.3	37%	0.367	42%	0.416	S	S	.	.	H	α-helix	trans	-64.9	-43	178.5	-176.3	86.3	0	0	0	112.8	L151 E183 S184 Q185 E190 Y191	L151-W187 HydrophobicContact CD1-CH2 4.27Å; L151-W187 HydrophobicContact CD1-CZ3 4.3Å; L151-W187 HydrophobicContact CD2-CH2 4.47Å; L151-W187 HydrophobicContact CD2-CZ3 3.73Å; E183-W187 PolarHBondContact O-N 3.3Å; E183-W187 VanDerWaalsContact O-N 3.08Å; S184-W187 PolarHBondContact O-N 3.04Å; Q185-W187 VanDerWaalsContact C-N 3.32Å; Q185-W187 PolarHBondContact O-N 3.03Å; W187-E190 PolarHBondContact O-N 2.83Å; W187-Y191 WeakPolarHBondContact O-CB 3.46Å; W187-Y191 PolarHBondContact O-N 3.43Å
188	I	54.3	Low	50.5	Low	28 Å²	28	80.4 Å²	80.4	14%	0.144	40%	0.396	C	S	.	.	H	α-helix	trans	-62.1	-44.6	176.3	-70.3	164.3	0	0	0	110.5	S184 Q185 E190 Y191 M192	S184-I188 WeakPolarHBondContact O-CB 3.25Å; S184-I188 WeakPolarHBondContact O-CD1 3.48Å; S184-I188 WeakPolarHBondContact O-CG1 3.06Å; S184-I188 PolarHBondContact O-N 3.44Å; Q185-I188 PolarHBondContact O-N 3.18Å; I188-E190 VanDerWaalsContact C-N 3.34Å; I188-E190 PolarHBondContact O-N 3.31Å; I188-Y191 PolarHBondContact O-N 3.32Å; I188-M192 HydrophobicContact CG2-CG 4.26Å; I188-M192 WeakPolarHBondContact O-CB 3.41Å; I188-M192 VanDerWaalsContact O-CG 3.28Å; I188-M192 WeakPolarHBondContact O-CG 3.48Å; I188-M192 PolarHBondContact O-N 3.5Å
189	N	57	Low	51.4	Low	105 Å²	105	77.4 Å²	77.4	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-64.8	-38.9	178.7	-76.9	-30.4	0	0	0	112	Q185 S186 S193	Q185-N189 VanDerWaalsContact O-CB 3.28Å; Q185-N189 WeakPolarHBondContact O-CB 3.33Å; Q185-N189 VanDerWaalsContact O-CG 3.24Å; Q185-N189 PolarHBondContact O-N 3.19Å; Q185-N189 PolarHBondContact O-ND2 3.29Å; S186-N189 PolarHBondContact O-N 3.33Å; N189-S193 VanDerWaalsContact O-CB 3.24Å; N189-S193 WeakPolarHBondContact O-CB 3.25Å; N189-S193 PolarHBondContact O-N 3.23Å; N189-S193 PolarHBondContact O-OG 2.67Å
190	E	62.9	Low	52.8	Low	91 Å²	91	78.2 Å²	78.2	43%	0.425	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-47.9	173.9	-167.9	-174.9	170.5	0	0	111.2	S186 W187 I188 S193 R194	S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 3.12Å; W187-E190 PolarHBondContact O-N 2.83Å; I188-E190 VanDerWaalsContact C-N 3.34Å; I188-E190 PolarHBondContact O-N 3.31Å; E190-S193 WeakPolarHBondContact O-CB 3.31Å; E190-S193 PolarHBondContact O-N 3.15Å; E190-R194 WeakPolarHBondContact O-CG 3.26Å; E190-R194 PolarHBondContact O-N 3.27Å; E190-R194 IonicContact OE1-CZ 3.74Å; E190-R194 IonicContact OE1-NE 2.59Å; E190-R194 PolarHBondContact OE1-NE 2.93Å; E190-R194 VanDerWaalsContact OE1-NE 3.08Å; E190-R194 IonicContact OE1-NH2 3.21Å; E190-R194 PolarHBondContact OE1-NH2 2.91Å
191	Y	55.9	Low	53.7	Low	51 Å²	51	76.7 Å²	76.7	20%	0.2	37%	0.37	C	S	.	.	H	α-helix	trans	-59.1	-50.4	177.8	-179.7	-96.8	0	0	0	111.3	L147 W187 I188 S193 R194 V195 L219	L147-Y191 HydrophobicContact CD2-CE1 4.43Å; W187-Y191 WeakPolarHBondContact O-CB 3.46Å; W187-Y191 PolarHBondContact O-N 3.43Å; I188-Y191 PolarHBondContact O-N 3.32Å; Y191-S193 VanDerWaalsContact C-N 3.27Å; Y191-S193 PolarHBondContact O-N 3.36Å; Y191-R194 PolarHBondContact O-N 3.41Å; Y191-R194 VanDerWaalsContact O-N 3.15Å; Y191-V195 HydrophobicContact CD1-CG2 4.01Å; Y191-V195 HydrophobicContact CE1-CG2 3.63Å; Y191-V195 HydrophobicContact CE2-CG2 4.38Å; Y191-V195 VanDerWaalsContact O-CG2 3.32Å; Y191-V195 WeakPolarHBondContact O-CG2 3.37Å; Y191-V195 PolarHBondContact O-N 3.17Å; Y191-L219 HydrophobicContact CD2-CD2 4.45Å; Y191-L219 HydrophobicContact CE2-CD2 3.94Å
192	M	58	Low	54.3	Low	48 Å²	48	73.7 Å²	73.7	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-35.6	177.6	-72	-63.6	-79.6	0	0	112.1	V143 I188 R196	V143-M192 HydrophobicContact CG1-CE 4.47Å; V143-M192 HydrophobicContact CG1-SD 4.1Å; I188-M192 HydrophobicContact CG2-CG 4.26Å; I188-M192 WeakPolarHBondContact O-CB 3.41Å; I188-M192 VanDerWaalsContact O-CG 3.28Å; I188-M192 WeakPolarHBondContact O-CG 3.48Å; I188-M192 PolarHBondContact O-N 3.5Å; M192-R196 VanDerWaalsContact O-CB 3.32Å; M192-R196 WeakPolarHBondContact O-CB 3.34Å; M192-R196 PolarHBondContact O-N 3.33Å
193	S	58.5	Low	54.9	Low	61 Å²	61	71.9 Å²	71.9	43%	0.427	36%	0.358	S	S	.	.	H	α-helix	trans	-66	-44.1	174.3	-65.1	0	0	0	0	111.8	N189 E190 Y191 R196 V197	N189-S193 VanDerWaalsContact O-CB 3.24Å; N189-S193 WeakPolarHBondContact O-CB 3.25Å; N189-S193 PolarHBondContact O-N 3.23Å; N189-S193 PolarHBondContact O-OG 2.67Å; E190-S193 WeakPolarHBondContact O-CB 3.31Å; E190-S193 PolarHBondContact O-N 3.15Å; Y191-S193 VanDerWaalsContact C-N 3.27Å; Y191-S193 PolarHBondContact O-N 3.36Å; S193-R196 PolarHBondContact O-N 2.77Å; S193-V197 WeakPolarHBondContact O-CG2 3.35Å; S193-V197 PolarHBondContact O-N 3.01Å
194	R	59.2	Low	55.5	Low	96 Å²	96	72.9 Å²	72.9	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-63.8	-43.9	176	-70.9	176.4	179.7	-142.5	2	111.7	E190 Y191 R196 V197 A198 L219	E190-R194 WeakPolarHBondContact O-CG 3.26Å; E190-R194 PolarHBondContact O-N 3.27Å; E190-R194 IonicContact OE1-CZ 3.74Å; E190-R194 IonicContact OE1-NE 2.59Å; E190-R194 PolarHBondContact OE1-NE 2.93Å; E190-R194 VanDerWaalsContact OE1-NE 3.08Å; E190-R194 IonicContact OE1-NH2 3.21Å; E190-R194 PolarHBondContact OE1-NH2 2.91Å; Y191-R194 PolarHBondContact O-N 3.41Å; Y191-R194 VanDerWaalsContact O-N 3.15Å; R194-R196 VanDerWaalsContact C-N 3.33Å; R194-R196 PolarHBondContact O-N 3.25Å; R194-V197 PolarHBondContact O-N 3.11Å; R194-A198 WeakPolarHBondContact O-CB 3.5Å; R194-A198 PolarHBondContact O-N 3.35Å; R194-L219 HydrophobicContact CB-CD2 4.48Å
195	V	56.9	Low	55.5	Low	15 Å²	15	72.7 Å²	72.7	9%	0.091	36%	0.359	C	S	.	.	H	α-helix	trans	-57.5	-46.4	173.2	173.3	0	0	0	0	110.4	Y191 V197 A198 M199 L219	Y191-V195 HydrophobicContact CD1-CG2 4.01Å; Y191-V195 HydrophobicContact CE1-CG2 3.63Å; Y191-V195 HydrophobicContact CE2-CG2 4.38Å; Y191-V195 VanDerWaalsContact O-CG2 3.32Å; Y191-V195 WeakPolarHBondContact O-CG2 3.37Å; Y191-V195 PolarHBondContact O-N 3.17Å; V195-V197 PolarHBondContact O-N 3.42Å; V195-A198 PolarHBondContact O-N 2.82Å; V195-M199 HydrophobicContact CG1-CE 3.98Å; V195-M199 HydrophobicContact CG1-CG 4.44Å; V195-M199 HydrophobicContact CG1-SD 4.21Å; V195-M199 WeakPolarHBondContact O-CB 3.31Å; V195-M199 WeakPolarHBondContact O-CG 3.4Å; V195-M199 PolarHBondContact O-N 3.3Å; V195-L219 HydrophobicContact CB-CD2 4.35Å; V195-L219 HydrophobicContact CG2-CD2 3.39Å
196	R	57.7	Low	55.2	Low	126 Å²	126	74.6 Å²	74.6	48%	0.475	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-38.7	179.4	-165.9	-176.3	-64.8	157.1	1.3	112.3	M192 S193 R194 K200	M192-R196 VanDerWaalsContact O-CB 3.32Å; M192-R196 WeakPolarHBondContact O-CB 3.34Å; M192-R196 PolarHBondContact O-N 3.33Å; S193-R196 PolarHBondContact O-N 2.77Å; R194-R196 VanDerWaalsContact C-N 3.33Å; R194-R196 PolarHBondContact O-N 3.25Å; R196-K200 WeakPolarHBondContact O-CB 3.39Å; R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.19Å
197	V	60.7	Low	54.9	Low	73 Å²	73	80.4 Å²	80.4	44%	0.442	38%	0.383	S	S	.	.	H	α-helix	trans	-66.8	-45.7	174.9	171.7	0	0	0	0	111	S193 R194 V195 M199 K200 R201	S193-V197 WeakPolarHBondContact O-CG2 3.35Å; S193-V197 PolarHBondContact O-N 3.01Å; R194-V197 PolarHBondContact O-N 3.11Å; V195-V197 PolarHBondContact O-N 3.42Å; V197-M199 VanDerWaalsContact C-N 3.32Å; V197-M199 PolarHBondContact O-N 3.31Å; V197-K200 PolarHBondContact O-N 3.16Å; V197-R201 WeakPolarHBondContact O-CG 3.38Å; V197-R201 PolarHBondContact O-N 3.42Å
198	A	57.1	Low	54.2	Low	4 Å²	4	79.5 Å²	79.5	3%	0.033	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-41	176.8	0	0	0	0	0	111.5	R194 V195 R201 A202 L219	R194-A198 WeakPolarHBondContact O-CB 3.5Å; R194-A198 PolarHBondContact O-N 3.35Å; V195-A198 PolarHBondContact O-N 2.82Å; A198-R201 PolarHBondContact O-N 2.96Å; A198-A202 WeakPolarHBondContact O-CB 3.4Å; A198-A202 PolarHBondContact O-N 2.87Å; A198-L219 HydrophobicContact CB-CD1 4.19Å
199	M	56.4	Low	53.6	Low	51 Å²	51	88.6 Å²	88.6	25%	0.251	43%	0.427	S	S	.	.	H	α-helix	trans	-64	-45.7	173.5	-76.1	-176	172.2	0	0	112.3	L139 V143 V195 V197 R201 A202 A203	L139-M199 HydrophobicContact CD2-SD 3.8Å; V143-M199 HydrophobicContact CG2-CE 3.77Å; V195-M199 HydrophobicContact CG1-CE 3.98Å; V195-M199 HydrophobicContact CG1-CG 4.44Å; V195-M199 HydrophobicContact CG1-SD 4.21Å; V195-M199 WeakPolarHBondContact O-CB 3.31Å; V195-M199 WeakPolarHBondContact O-CG 3.4Å; V195-M199 PolarHBondContact O-N 3.3Å; V197-M199 VanDerWaalsContact C-N 3.32Å; V197-M199 PolarHBondContact O-N 3.31Å; M199-R201 VanDerWaalsContact C-N 3.29Å; M199-R201 PolarHBondContact O-N 3.48Å; M199-A202 PolarHBondContact O-N 2.83Å; M199-A203 WeakPolarHBondContact O-CB 3.23Å; M199-A203 PolarHBondContact O-N 3.39Å
200	K	61.3	Low	52.7	Low	133 Å²	133	91.9 Å²	91.9	58%	0.578	44%	0.436	S	S	*	.	H	α-helix	trans	-61.3	-37.2	175.2	-78.8	-176.3	178.1	-174.5	0	111.9	R196 V197 K204	R196-K200 WeakPolarHBondContact O-CB 3.39Å; R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.19Å; V197-K200 PolarHBondContact O-N 3.16Å; K200-K204 WeakPolarHBondContact O-CG 3.41Å; K200-K204 PolarHBondContact O-N 3.4Å; K200-K204 VanDerWaalsContact O-N 3.13Å
201	R	54.8	Low	51.7	Low	106 Å²	106	93.1 Å²	93.1	40%	0.4	44%	0.438	S	S	.	.	H	α-helix	trans	-68.3	-46.3	174.4	-76.7	-177	177.7	174.8	1.8	111.4	V197 A198 M199 A203 K204 C205 E215	V197-R201 WeakPolarHBondContact O-CG 3.38Å; V197-R201 PolarHBondContact O-N 3.42Å; A198-R201 PolarHBondContact O-N 2.96Å; M199-R201 VanDerWaalsContact C-N 3.29Å; M199-R201 PolarHBondContact O-N 3.48Å; R201-A203 VanDerWaalsContact C-N 3.34Å; R201-A203 PolarHBondContact O-N 2.92Å; R201-K204 PolarHBondContact O-N 2.99Å; R201-K204 VanDerWaalsContact O-N 3.15Å; R201-C205 VanDerWaalsContact O-CB 3.31Å; R201-C205 WeakPolarHBondContact O-CB 3.49Å; R201-C205 PolarHBondContact O-N 3.47Å; R201-C205 PolarHBondContact O-SG 3.42Å; R201-C205 VanDerWaalsContact O-SG 3.34Å; R201-E215 WeakPolarHBondContact CD-OE2 3.39Å; R201-E215 IonicContact CZ-OE1 3.47Å; R201-E215 IonicContact NH1-OE1 3.06Å; R201-E215 PolarHBondContact NH1-OE1 2.88Å; R201-E215 IonicContact NH1-OE2 3.08Å; R201-E215 PolarHBondContact NH1-OE2 3.37Å
202	A	51.7	Low	51.3	Low	10 Å²	10	92.2 Å²	92.2	8%	0.083	44%	0.439	C	S	.	.	H	α-helix	trans	-59.8	-41.6	176.5	0	0	0	0	0	112.4	A198 M199 C205 Q206 Y211	A198-A202 WeakPolarHBondContact O-CB 3.4Å; A198-A202 PolarHBondContact O-N 2.87Å; M199-A202 PolarHBondContact O-N 2.83Å; A202-C205 CarbonylContact O-C 3.59Å; A202-C205 PolarHBondContact O-N 3.49Å; A202-Q206 PolarHBondContact O-N 3.02Å; A202-Y211 HydrophobicContact CB-CE1 4.23Å
203	A	51	Low	50.8	Low	67 Å²	67	99.2 Å²	99.2	55%	0.554	46%	0.462	S	S	*	.	H	α-helix	trans	-65.3	-36.9	175.4	0	0	0	0	0	112.7	M199 R201	M199-A203 WeakPolarHBondContact O-CB 3.23Å; M199-A203 PolarHBondContact O-N 3.39Å; R201-A203 VanDerWaalsContact C-N 3.34Å; R201-A203 PolarHBondContact O-N 2.92Å
204	K	52.7	Low	50.2	Low	166 Å²	166	104.6 Å²	104.6	72%	0.722	48%	0.481	S	S	*	.	H	α-helix	trans	-71.7	-39	173	-77	-177.3	178.9	-177	0	112.2	K200 R201 Q206 K207	K200-K204 WeakPolarHBondContact O-CG 3.41Å; K200-K204 PolarHBondContact O-N 3.4Å; K200-K204 VanDerWaalsContact O-N 3.13Å; R201-K204 PolarHBondContact O-N 2.99Å; R201-K204 VanDerWaalsContact O-N 3.15Å; K204-Q206 VanDerWaalsContact C-N 3.28Å; K204-Q206 PolarHBondContact O-N 3.47Å; K204-K207 PolarHBondContact O-N 3.04Å
205	C	47.1	Very low	49.7	Very low	34 Å²	34	103.1 Å²	103.1	23%	0.23	48%	0.478	C	S	.	.	H	α-helix	trans	-71.5	-16.4	177.8	-72.2	0	0	0	0	112.5	R201 A202 K207 T208	R201-C205 VanDerWaalsContact O-CB 3.31Å; R201-C205 WeakPolarHBondContact O-CB 3.49Å; R201-C205 PolarHBondContact O-N 3.47Å; R201-C205 PolarHBondContact O-SG 3.42Å; R201-C205 VanDerWaalsContact O-SG 3.34Å; A202-C205 CarbonylContact O-C 3.59Å; A202-C205 PolarHBondContact O-N 3.49Å; C205-K207 PolarHBondContact O-N 3.21Å; C205-T208 CarbonylContact O-C 3.58Å; C205-T208 WeakPolarHBondContact O-CA 3.36Å; C205-T208 PolarHBondContact O-N 3.2Å; C205-T208 PolarHBondContact O-OG1 2.98Å; C205-T208 VanDerWaalsContact O-OG1 3.12Å
206	Q	40.9	Very low	49.2	Very low	127 Å²	127	106.6 Å²	106.6	59%	0.593	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.5	170.7	-104.6	-178.8	-6.6	0	0	113.8	A202 K204 T208	A202-Q206 PolarHBondContact O-N 3.02Å; K204-Q206 VanDerWaalsContact C-N 3.28Å; K204-Q206 PolarHBondContact O-N 3.47Å; Q206-T208 VanDerWaalsContact C-N 3.3Å
207	K	45.2	Very low	48.5	Very low	199 Å²	199	105.1 Å²	105.1	87%	0.865	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-13	169.5	-71	-173.7	175.9	-176.9	0	114.1	K204 C205	K204-K207 PolarHBondContact O-N 3.04Å; C205-K207 PolarHBondContact O-N 3.21Å
208	T	38.8	Very low	47.7	Very low	79 Å²	79	107 Å²	107	49%	0.485	49%	0.493	S	S	.	.	S	Bend	trans	-133.9	111	-177.3	49.1	0	0	0	0	107.9	C205 Q206 F210	C205-T208 CarbonylContact O-C 3.58Å; C205-T208 WeakPolarHBondContact O-CA 3.36Å; C205-T208 PolarHBondContact O-N 3.2Å; C205-T208 PolarHBondContact O-OG1 2.98Å; C205-T208 VanDerWaalsContact O-OG1 3.12Å; Q206-T208 VanDerWaalsContact C-N 3.3Å; T208-F210 PolarHBondContact O-N 3.47Å
209	K	42.5	Very low	47	Very low	218 Å²	218	107.9 Å²	107.9	95%	0.948	50%	0.498	S	S	*	.	S	Bend	trans	-50	7.8	-173.7	-69.9	178.5	175.3	178	0	118.6
210	F	37.2	Very low	46.3	Very low	174 Å²	174	108.8 Å²	108.8	76%	0.763	51%	0.506	S	S	*	.			trans	-95	106.5	170	-72.8	-86	0	0	0	111.8	T208	T208-F210 PolarHBondContact O-N 3.47Å
211	Y	42.9	Very low	45.2	Very low	118 Å²	118	105.4 Å²	105.4	46%	0.463	50%	0.498	S	S	.	.			trans	-77	135.1	163.3	-102.4	-100.4	0	0	0	109.5	A202 W213	A202-Y211 HydrophobicContact CB-CE1 4.23Å; Y211-W213 VanDerWaalsContact C-N 3.31Å; Y211-W213 PolarHBondContact O-N 3.12Å
212	P	47.7	Very low	44.5	Very low	32 Å²	32	106.1 Å²	106.1	21%	0.208	50%	0.502	C	S	.	.			trans	-76.6	80.6	174.5	29.9	-31.4	0	0	0	110.3	E214	P212-E214 PolarHBondContact O-N 3.47Å
213	W	45.7	Very low	44	Very low	195 Å²	195	108.9 Å²	108.9	74%	0.739	52%	0.515	S	S	*	.	H	α-helix	trans	-61.9	-26.8	179.2	-83.4	51.2	0	0	0	113.2	Y211 W216 N217	Y211-W213 VanDerWaalsContact C-N 3.31Å; Y211-W213 PolarHBondContact O-N 3.12Å; W213-W216 PolarHBondContact O-N 3.11Å; W213-N217 PolarHBondContact O-N 2.81Å; W213-N217 VanDerWaalsContact O-N 3.11Å
214	E	47.5	Very low	43.4	Very low	174 Å²	174	111.6 Å²	111.6	81%	0.813	52%	0.516	S	S	*	.	H	α-helix	trans	-69.4	-38.1	-176.5	-66.2	175.5	168.4	0	0	112.8	P212 F218	P212-E214 PolarHBondContact O-N 3.47Å; E214-F218 PolarHBondContact O-N 2.98Å
215	E	47.4	Very low	42.7	Very low	65 Å²	65	109.1 Å²	109.1	30%	0.304	51%	0.511	S	S	.	.	H	α-helix	trans	-71.1	-34.6	177.6	-73.8	179.7	-174.8	0	0	112.1	R201 F218 L219	R201-E215 WeakPolarHBondContact CD-OE2 3.39Å; R201-E215 IonicContact CZ-OE1 3.47Å; R201-E215 IonicContact NH1-OE1 3.06Å; R201-E215 PolarHBondContact NH1-OE1 2.88Å; R201-E215 IonicContact NH1-OE2 3.08Å; R201-E215 PolarHBondContact NH1-OE2 3.37Å; E215-F218 PolarHBondContact O-N 3.07Å; E215-L219 WeakPolarHBondContact O-CD1 3.5Å; E215-L219 PolarHBondContact O-N 2.93Å
216	W	47.7	Very low	42.1	Very low	87 Å²	87	110.6 Å²	110.6	33%	0.33	53%	0.532	S	S	.	.	H	α-helix	trans	-70	-39.8	177	-80.2	91.6	0	0	0	112.3	W213 F218 L219 V220	W213-W216 PolarHBondContact O-N 3.11Å; W216-F218 PolarHBondContact O-N 3.16Å; W216-L219 PolarHBondContact O-N 2.79Å; W216-V220 WeakPolarHBondContact O-CG2 3.09Å; W216-V220 PolarHBondContact O-N 2.87Å
217	N	42.6	Very low	41.6	Very low	96 Å²	96	110.1 Å²	110.1	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-34.3	173.1	-82.4	-22.1	0	0	0	111.8	W213 V220 C221	W213-N217 PolarHBondContact O-N 2.81Å; W213-N217 VanDerWaalsContact O-N 3.11Å; N217-V220 PolarHBondContact O-N 3.46Å; N217-C221 VanDerWaalsContact O-CB 3.24Å; N217-C221 WeakPolarHBondContact O-CB 3.43Å; N217-C221 PolarHBondContact O-N 2.87Å; N217-C221 PolarHBondContact O-SG 2.72Å
218	F	42.6	Very low	41.1	Very low	111 Å²	111	108.4 Å²	108.4	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-67.2	-41.3	176.5	-157.8	-100.9	0	0	0	112.2	E214 E215 W216 Y222	E214-F218 PolarHBondContact O-N 2.98Å; E215-F218 PolarHBondContact O-N 3.07Å; W216-F218 PolarHBondContact O-N 3.16Å; F218-Y222 AromaticContact CD1-CD2 3.7Å; F218-Y222 HydrophobicContact CD1-CD2 3.7Å; F218-Y222 AromaticContact CD1-CE2 3.58Å; F218-Y222 HydrophobicContact CD1-CE2 3.58Å; F218-Y222 HydrophobicContact CD2-CE2 4.3Å; F218-Y222 AromaticContact CE1-CD2 3.64Å; F218-Y222 HydrophobicContact CE1-CD2 3.64Å; F218-Y222 AromaticContact CE1-CE2 3Å; F218-Y222 HydrophobicContact CE1-CE2 3Å; F218-Y222 AromaticContact CE1-CZ 3.62Å; F218-Y222 AromaticContact CE2-CE2 3.81Å; F218-Y222 HydrophobicContact CE2-CE2 3.81Å; F218-Y222 HydrophobicContact CG-CD2 4.22Å; F218-Y222 HydrophobicContact CG-CE2 4.22Å; F218-Y222 HydrophobicContact CZ-CD2 4.09Å; F218-Y222 AromaticContact CZ-CE2 3.16Å; F218-Y222 HydrophobicContact CZ-CE2 3.16Å; F218-Y222 AromaticContact CZ-CZ 3.81Å; F218-Y222 WeakPolarHBondContact O-CB 2.94Å; F218-Y222 VanDerWaalsContact O-CD2 3.32Å; F218-Y222 WeakPolarHBondContact O-CD2 3.27Å; F218-Y222 PolarHBondContact O-N 2.78Å; F218-Y222 VanDerWaalsContact O-N 3.13Å
219	L	44.1	Very low	40.6	Very low	24 Å²	24	110.8 Å²	110.8	13%	0.126	54%	0.543	C	S	.	.	H	α-helix	trans	-68.5	-34.3	176.2	-95.5	114.7	0	0	0	113.4	Y191 R194 V195 A198 E215 W216	Y191-L219 HydrophobicContact CD2-CD2 4.45Å; Y191-L219 HydrophobicContact CE2-CD2 3.94Å; R194-L219 HydrophobicContact CB-CD2 4.48Å; V195-L219 HydrophobicContact CB-CD2 4.35Å; V195-L219 HydrophobicContact CG2-CD2 3.39Å; A198-L219 HydrophobicContact CB-CD1 4.19Å; E215-L219 WeakPolarHBondContact O-CD1 3.5Å; E215-L219 PolarHBondContact O-N 2.93Å; W216-L219 PolarHBondContact O-N 2.79Å
220	V	42	Very low	40	Very low	69 Å²	69	104.8 Å²	104.8	42%	0.418	52%	0.521	S	S	.	.	H	α-helix	trans	-77.4	-32.7	178.7	175	0	0	0	0	111.7	W216 N217	W216-V220 WeakPolarHBondContact O-CG2 3.09Å; W216-V220 PolarHBondContact O-N 2.87Å; N217-V220 PolarHBondContact O-N 3.46Å
221	C	37.9	Very low	39.7	Very low	62 Å²	62	104.8 Å²	104.8	42%	0.419	52%	0.524	S	S	.	.	H	α-helix	trans	-86.8	-13.6	-179.8	-65	0	0	0	0	114.4	N217 N223 E224	N217-C221 VanDerWaalsContact O-CB 3.24Å; N217-C221 WeakPolarHBondContact O-CB 3.43Å; N217-C221 PolarHBondContact O-N 2.87Å; N217-C221 PolarHBondContact O-SG 2.72Å; C221-N223 PolarHBondContact O-N 3.36Å; C221-N223 VanDerWaalsContact O-N 3.16Å; C221-E224 PolarHBondContact O-N 3.47Å
222	Y	39.3	Very low	39	Very low	122 Å²	122	102.5 Å²	102.5	48%	0.478	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.4	178.9	-114.2	-107.2	0	0	0	114.3	F218	F218-Y222 AromaticContact CD1-CD2 3.7Å; F218-Y222 HydrophobicContact CD1-CD2 3.7Å; F218-Y222 AromaticContact CD1-CE2 3.58Å; F218-Y222 HydrophobicContact CD1-CE2 3.58Å; F218-Y222 HydrophobicContact CD2-CE2 4.3Å; F218-Y222 AromaticContact CE1-CD2 3.64Å; F218-Y222 HydrophobicContact CE1-CD2 3.64Å; F218-Y222 AromaticContact CE1-CE2 3Å; F218-Y222 HydrophobicContact CE1-CE2 3Å; F218-Y222 AromaticContact CE1-CZ 3.62Å; F218-Y222 AromaticContact CE2-CE2 3.81Å; F218-Y222 HydrophobicContact CE2-CE2 3.81Å; F218-Y222 HydrophobicContact CG-CD2 4.22Å; F218-Y222 HydrophobicContact CG-CE2 4.22Å; F218-Y222 HydrophobicContact CZ-CD2 4.09Å; F218-Y222 AromaticContact CZ-CE2 3.16Å; F218-Y222 HydrophobicContact CZ-CE2 3.16Å; F218-Y222 AromaticContact CZ-CZ 3.81Å; F218-Y222 WeakPolarHBondContact O-CB 2.94Å; F218-Y222 VanDerWaalsContact O-CD2 3.32Å; F218-Y222 WeakPolarHBondContact O-CD2 3.27Å; F218-Y222 PolarHBondContact O-N 2.78Å; F218-Y222 VanDerWaalsContact O-N 3.13Å
223	N	40.9	Very low	38	Very low	67 Å²	67	110.1 Å²	110.1	36%	0.358	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-5	178.6	-71.4	-17.6	0	0	0	114.1	C221	C221-N223 PolarHBondContact O-N 3.36Å; C221-N223 VanDerWaalsContact O-N 3.16Å
224	E	39.4	Very low	37.3	Very low	125 Å²	125	110.3 Å²	110.3	58%	0.584	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-16	-178.5	-72.1	-173.5	169	0	0	113.4	C83 C221	C83-E224 PolarHBondContact SG-OE1 2.92Å; C221-E224 PolarHBondContact O-N 3.47Å
225	D	37	Very low	36.4	Very low	113 Å²	113	108.2 Å²	108.2	60%	0.604	57%	0.569	S	S	*	*	S	Bend	trans	-98.5	11.5	176.2	-90.4	-28.3	0	0	0	113.1	N227 K307	D225-N227 PolarHBondContact O-N 3.48Å; D225-K307 IonicContact OD1-NZ 2.9Å; D225-K307 PolarHBondContact OD1-NZ 2.9Å; D225-K307 IonicContact OD2-NZ 2.65Å; D225-K307 PolarHBondContact OD2-NZ 3.38Å
226	G	34.8	Very low	35.6	Very low	65 Å²	65	111 Å²	111	67%	0.67	59%	0.593	S	S	*	*			trans	-73.2	53.1	169	0	0	0	0	0	112.5	D228	G226-D228 VanDerWaalsContact C-N 3.35Å; G226-D228 PolarHBondContact O-N 3.2Å
227	N	31.5	Very low	34.8	Very low	117 Å²	117	113.7 Å²	113.7	63%	0.626	61%	0.614	S	S	*	*			trans	-85.7	85.1	171.7	-135.8	-14.1	0	0	0	107.1	D225 L229	D225-N227 PolarHBondContact O-N 3.48Å; N227-L229 PolarHBondContact O-N 3.1Å
228	D	33	Very low	34.3	Very low	164 Å²	164	114.4 Å²	114.4	88%	0.877	63%	0.626	S	S	*	*			trans	-61.3	76.6	162.3	-80.3	-31.2	0	0	0	109.3	G226	G226-D228 VanDerWaalsContact C-N 3.35Å; G226-D228 PolarHBondContact O-N 3.2Å
229	L	29.2	Very low	33.5	Very low	128 Å²	128	119.1 Å²	119.1	67%	0.67	65%	0.646	S	S	*	*			trans	-123.9	67.6	167	-91	166.1	0	0	0	106.5	N227	N227-L229 PolarHBondContact O-N 3.1Å
230	N	29.4	Very low	32.9	Very low	93 Å²	93	127.1 Å²	127.1	50%	0.497	68%	0.68	S	S	.	*			trans	-172.8	67.1	155.5	-82.6	-45.3	0	0	0	112.4	N301	N230-N301 PolarHBondContact ND2-ND2 3.29Å; N230-N301 VanDerWaalsContact ND2-ND2 3.18Å
231	E	31.2	Very low	32.3	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	70%	0.702	S	S	*	*			trans	-153.9	64.8	143.3	-115.9	161	-149.3	0	0	113.1	Q233	E231-Q233 PolarHBondContact O-N 3.45Å
232	G	28	Very low	31.9	Very low	70 Å²	70	136.6 Å²	136.6	72%	0.722	72%	0.723	S	S	*	*			trans	-63	113.7	152.1	0	0	0	0	0	110
233	Q	26.5	Very low	31.4	Very low	191 Å²	191	138 Å²	138	89%	0.893	74%	0.739	S	S	*	*			trans	51	92.1	145.5	-68.6	177	-30.4	0	0	116.9	E231	E231-Q233 PolarHBondContact O-N 3.45Å
234	K	31	Very low	30.7	Very low	199 Å²	199	140 Å²	140	87%	0.865	76%	0.758	S	S	*	*			trans	-123.7	101.3	148.2	-80.7	-171.5	177.2	-178.4	0	110.7
235	N	28.9	Very low	30.3	Very low	130 Å²	130	139.2 Å²	139.2	70%	0.695	77%	0.766	S	S	*	*			trans	0.8	123.4	160.5	-148.7	3.6	0	0	0	118.4	N237	N235-N237 PolarHBondContact O-N 3.15Å
236	P	29.6	Very low	30	Very low	123 Å²	123	142.6 Å²	142.6	80%	0.799	78%	0.779	S	S	*	*	S	Bend	trans	-80	25	-174.4	33.2	-35.7	0	0	0	115.7
237	N	31.1	Very low	29.5	Very low	144 Å²	144	148.2 Å²	148.2	77%	0.77	79%	0.789	S	S	*	*			trans	-123.5	38	-168.8	-83	-19.6	0	0	0	115.4	N235	N235-N237 PolarHBondContact O-N 3.15Å
238	S	32.9	Very low	29.2	Very low	111 Å²	111	151.4 Å²	151.4	78%	0.776	80%	0.798	S	S	*	*			trans	-119.6	81.5	166.5	66.6	0	0	0	0	111.7	K240	S238-K240 PolarHBondContact O-N 2.65Å
239	K	26.8	Very low	28.8	Very low	210 Å²	210	150.5 Å²	150.5	91%	0.913	80%	0.799	S	S	*	*			trans	-56.8	111.1	155.7	-81.3	179	172.9	-179.6	0	108.4
240	K	31.4	Very low	28.7	Very low	193 Å²	193	151.9 Å²	151.9	84%	0.839	80%	0.802	S	S	*	*			trans	-139.2	113.4	150.2	-89.1	-166.4	173.9	-176.3	0	108.8	S238	S238-K240 PolarHBondContact O-N 2.65Å
241	E	29.4	Very low	28.5	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	82%	0.818	S	S	*	*			trans	-13.2	117.2	169.1	-72.4	154.8	150.7	0	0	115.9	D243	E241-D243 PolarHBondContact O-N 3.38Å
242	V	28.5	Very low	28.3	Very low	141 Å²	141	151.6 Å²	151.6	86%	0.855	81%	0.808	S	S	*	*			trans	-78.5	107	155.8	174.1	0	0	0	0	106.2
243	D	29.3	Very low	28.2	Very low	152 Å²	152	155.2 Å²	155.2	81%	0.813	81%	0.811	S	S	*	*			trans	-84.4	112.9	165.6	-136.9	-3.8	0	0	0	107.6	E241 S245	E241-D243 PolarHBondContact O-N 3.38Å; D243-S245 PolarHBondContact O-N 3.2Å
244	S	26	Very low	28.3	Very low	109 Å²	109	152.1 Å²	152.1	76%	0.762	80%	0.8	S	S	*	*			trans	-72.2	115	175.1	57.8	0	0	0	0	109.4
245	S	31.6	Very low	28.2	Very low	107 Å²	107	150.7 Å²	150.7	75%	0.748	80%	0.802	S	S	*	*			trans	-130.4	104.8	157.2	57.9	0	0	0	0	111.1	D243	D243-S245 PolarHBondContact O-N 3.2Å
246	E	30.4	Very low	28.4	Very low	185 Å²	185	153.5 Å²	153.5	86%	0.864	81%	0.811	S	S	*	*			trans	51.9	88.6	135.6	-63.9	-174.9	144.5	0	0	119.3
247	M	23.1	Very low	28.5	Very low	182 Å²	182	156.6 Å²	156.6	90%	0.897	81%	0.812	S	S	*	*				16.5	120.9	115.1	-148.4	-179.9	-157.7	0	0	117.9
248	K	25.7	Very low	28.6	Very low	184 Å²	184	156.6 Å²	156.6	80%	0.8	81%	0.812	S	S	*	*				178.4	110.4	129	-98.8	162.1	-172.6	172.7	0	111.1
249	T	25.4	Very low	28.7	Very low	146 Å²	146	158.4 Å²	158.4	90%	0.896	81%	0.813	S	S	*	*			trans	-126.9	106	149.4	-6.4	0	0	0	0	107.2	L251	T249-L251 PolarHBondContact O-N 2.8Å
250	Q	26	Very low	28.9	Very low	157 Å²	157	156.7 Å²	156.7	73%	0.734	81%	0.805	S	S	*	*			trans	-64.8	118.5	175.7	-72	170.6	-18.6	0	0	109	V252	Q250-V252 HydrophobicContact CB-CG2 4.23Å; Q250-V252 PolarHBondContact O-N 3.06Å
251	L	25.7	Very low	29.1	Very low	160 Å²	160	154.1 Å²	154.1	84%	0.838	80%	0.801	S	S	*	*			trans	-71.7	104.6	151.3	-100.3	110.2	0	0	0	106.6	T249 D253	T249-L251 PolarHBondContact O-N 2.8Å; L251-D253 PolarHBondContact O-N 2.85Å
252	V	26.3	Very low	29.2	Very low	101 Å²	101	151.8 Å²	151.8	61%	0.612	80%	0.795	S	S	*	*			trans	-83.8	91.5	167.4	178.2	0	0	0	0	106.9	Q250 N254	Q250-V252 HydrophobicContact CB-CG2 4.23Å; Q250-V252 PolarHBondContact O-N 3.06Å; V252-N254 HydrophobicContact CG1-CB 4.36Å; V252-N254 WeakPolarHBondContact CG1-ND2 3.45Å; V252-N254 PolarHBondContact O-N 3.44Å
253	D	26.9	Very low	29.2	Very low	145 Å²	145	153.2 Å²	153.2	78%	0.775	79%	0.792	S	S	*	*			trans	-72.2	101.7	158.3	-87.6	-28.3	0	0	0	107.7	L251	L251-D253 PolarHBondContact O-N 2.85Å
254	N	28.7	Very low	29.1	Very low	126 Å²	126	155.5 Å²	155.5	67%	0.674	80%	0.795	S	S	*	*			trans	-124.8	107.2	160.9	-83.1	-31	0	0	0	106.8	V252	V252-N254 HydrophobicContact CG1-CB 4.36Å; V252-N254 WeakPolarHBondContact CG1-ND2 3.45Å; V252-N254 PolarHBondContact O-N 3.44Å
255	D	29.6	Very low	29.2	Very low	169 Å²	169	162 Å²	162	90%	0.904	80%	0.802	S	S	*	*				-159.5	102.2	116.7	-91.7	-20.9	0	0	0	110.7
256	H	32.7	Very low	29.1	Very low	189 Å²	189	166.6 Å²	166.6	88%	0.875	81%	0.809	S	S	*	*			trans	-79.2	144.2	169.2	-135.3	25.9	0	0	0	109.3
257	K	32.2	Very low	29	Very low	188 Å²	188	163.7 Å²	163.7	82%	0.817	81%	0.806	S	S	*	*	S	Bend	trans	-56.3	147.5	178.8	-71.4	170	174.4	170.9	0	112.5
258	N	32.9	Very low	29.1	Very low	145 Å²	145	161.7 Å²	161.7	78%	0.775	80%	0.798	S	S	*	*			trans	66.2	101	159	-60.5	-18.2	0	0	0	116
259	D	34.3	Very low	29.1	Very low	149 Å²	149	161.2 Å²	161.2	80%	0.797	80%	0.803	S	S	*	*				-164.5	159.7	100.6	-110.4	-35.2	0	0	0	113.2
260	K	31.4	Very low	29.1	Very low	173 Å²	173	161 Å²	161	75%	0.752	79%	0.792	S	S	*	*			trans	-53.8	156.4	-165.6	-65.2	153.7	179.4	169.3	0	116.3
261	N	35.4	Very low	29	Very low	140 Å²	140	161.9 Å²	161.9	75%	0.749	79%	0.794	S	S	*	*			trans	100.4	107.2	152.4	-62.9	-22.2	0	0	0	118.3
262	N	30.1	Very low	29	Very low	140 Å²	140	161.2 Å²	161.2	75%	0.749	79%	0.787	S	S	*	*			trans	74.1	121.8	131	-75.2	-8.2	0	0	0	121.4
263	E	29.9	Very low	28.9	Very low	170 Å²	170	166 Å²	166	79%	0.794	80%	0.8	S	S	*	*			trans	83.1	90.2	139	-70.8	-174.8	139.2	0	0	119.9
264	K	27.8	Very low	28.9	Very low	201 Å²	201	168 Å²	168	87%	0.874	80%	0.801	S	S	*	*				35.9	96.8	126.7	-68.5	179.4	177.8	172.2	0	116.8
265	R	27.8	Very low	29.1	Very low	246 Å²	246	170.7 Å²	170.7	93%	0.928	81%	0.81	S	S	*	*			trans	-150.1	127.6	138.6	-70.8	-161.5	176.5	-178.5	-1.7	111.7
266	K	28.1	Very low	29	Very low	202 Å²	202	169.4 Å²	169.4	88%	0.878	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.5	144.8	170.6	-66	174	175.7	177.8	0	110.2
267	P	28.9	Very low	28.8	Very low	125 Å²	125	164 Å²	164	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-101.4	129.8	160.4	13.9	4.8	0	0	0	112
268	L	24.4	Very low	28.4	Very low	139 Å²	139	164.1 Å²	164.1	73%	0.728	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-55.8	140.4	167.3	-83.6	82.3	0	0	0	111.4	E270	L268-E270 HydrophobicContact CD2-CG 4.24Å
269	L	26.4	Very low	28.1	Very low	174 Å²	174	161.6 Å²	161.6	91%	0.911	80%	0.801	S	S	*	*			trans	-96.6	86.5	154.7	-106.9	142.6	0	0	0	107.5
270	E	24.9	Very low	27.7	Very low	141 Å²	141	165.6 Å²	165.6	66%	0.659	81%	0.807	S	S	*	*			trans	-75.2	121.5	170.1	-125.6	171.6	-173.1	0	0	108.6	L268 Q272	L268-E270 HydrophobicContact CD2-CG 4.24Å; E270-Q272 PolarHBondContact O-N 2.95Å
271	F	24	Very low	27.5	Very low	177 Å²	177	161.1 Å²	161.1	78%	0.776	81%	0.81	S	S	*	*			trans	-74	104.6	165.6	-78.6	-91.2	0	0	0	107.8
272	Q	25.3	Very low	27	Very low	145 Å²	145	164.1 Å²	164.1	68%	0.678	82%	0.816	S	S	*	*			trans	-109.4	107.4	172.8	-139	179.7	33.3	0	0	109.7	E270 K274	E270-Q272 PolarHBondContact O-N 2.95Å; Q272-K274 PolarHBondContact O-N 2.96Å
273	F	24.7	Very low	26.8	Very low	202 Å²	202	165.5 Å²	165.5	89%	0.886	82%	0.823	S	S	*	*			trans	-62.5	122.4	162.3	-77.9	-95.3	0	0	0	108.3
274	K	27.8	Very low	26.6	Very low	187 Å²	187	163.1 Å²	163.1	81%	0.813	82%	0.822	S	S	*	*			trans	-115.2	86.1	168.3	-87.8	-175.4	175.7	178.4	0	109	Q272	Q272-K274 PolarHBondContact O-N 2.96Å
275	E	31.7	Very low	26.5	Very low	183 Å²	183	157.3 Å²	157.3	86%	0.855	82%	0.819	S	S	*	*			trans	-102.8	97.3	155.6	-89.9	-176.2	161.9	0	0	107.8	G277	E275-G277 PolarHBondContact O-N 3.46Å
276	T	28.8	Very low	26.5	Very low	141 Å²	141	152.3 Å²	152.3	87%	0.865	82%	0.816	S	S	*	*			trans	29.5	83.1	153.5	53	0	0	0	0	117.2
277	G	27.2	Very low	26.4	Very low	77 Å²	77	147.5 Å²	147.5	79%	0.794	81%	0.808	S	S	*	*			trans	-77.3	142.4	158.1	0	0	0	0	0	111.9	E275	E275-G277 PolarHBondContact O-N 3.46Å
278	E	25.4	Very low	26.2	Very low	189 Å²	189	150.5 Å²	150.5	88%	0.883	81%	0.811	S	S	*	*			trans	-47.1	141.7	168.9	-59.7	164	153.7	0	0	112
279	S	25.5	Very low	26.3	Very low	93 Å²	93	151.9 Å²	151.9	65%	0.65	81%	0.814	S	S	*	*				161.1	142.3	115.1	75	0	0	0	0	117.3
280	Y	25.1	Very low	26.3	Very low	232 Å²	232	149.7 Å²	149.7	91%	0.91	80%	0.803	S	S	*	*			trans	62.2	121.5	153.2	-54.6	-61.3	0	0	0	123.8
281	G	27.9	Very low	26.3	Very low	79 Å²	79	150 Å²	150	81%	0.814	81%	0.809	S	S	*	*			trans	176.3	77.8	155.9	0	0	0	0	0	113.7
282	K	25	Very low	26.5	Very low	204 Å²	204	150.1 Å²	150.1	89%	0.887	82%	0.816	S	S	*	*			trans	-58	148.3	175.8	-78	174.1	173	175.8	0	112.7
283	L	25.5	Very low	26.5	Very low	169 Å²	169	148.6 Å²	148.6	89%	0.885	82%	0.816	S	S	*	*				-175.7	158.9	124.6	-93.5	162.6	0	0	0	109.4
284	P	26.8	Very low	26.8	Very low	120 Å²	120	144 Å²	144	78%	0.779	81%	0.807	S	S	*	*			trans	-108.9	158.8	-130.5	39.4	-28.4	0	0	0	112.6
285	G	26.1	Very low	26.7	Very low	78 Å²	78	142.7 Å²	142.7	80%	0.804	81%	0.807	S	S	*	*			trans	176.7	74.6	175.3	0	0	0	0	0	112.9	S287	G285-S287 PolarHBondContact O-N 3.43Å
286	T	25.9	Very low	26.4	Very low	141 Å²	141	138.5 Å²	138.5	87%	0.865	80%	0.798	S	S	*	*			trans	-58.9	123.3	164.6	44.7	0	0	0	0	110.6
287	S	26.3	Very low	26.5	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	80%	0.797	S	S	*	*				170.5	119.9	113.2	59.1	0	0	0	0	108.4	G285 Q289	G285-S287 PolarHBondContact O-N 3.43Å; S287-Q289 PolarHBondContact O-N 2.65Å; S287-Q289 VanDerWaalsContact O-N 3.16Å
288	E	25	Very low	26.6	Very low	187 Å²	187	145.7 Å²	145.7	87%	0.874	80%	0.798	S	S	*	*			trans	-39.2	118.2	153.8	-61.5	170.6	142.8	0	0	109.7
289	Q	27	Very low	26.8	Very low	168 Å²	168	146.2 Å²	146.2	79%	0.785	80%	0.797	S	S	*	*			trans	179.4	133.7	146.2	-101.3	159.4	34.8	0	0	111.1	S287	S287-Q289 PolarHBondContact O-N 2.65Å; S287-Q289 VanDerWaalsContact O-N 3.16Å
290	N	27.3	Very low	27.1	Very low	128 Å²	128	150.4 Å²	150.4	68%	0.684	80%	0.799	S	S	*	*			trans	92.8	84.2	151.3	-53.5	-24.7	0	0	0	118.2
291	L	24.9	Very low	27.5	Very low	149 Å²	149	143.5 Å²	143.5	78%	0.78	78%	0.778	S	S	*	*				46.7	92.6	112	-79.9	150	0	0	0	116.3	V293	L291-V293 HydrophobicContact CD2-CG2 4.43Å
292	L	26.7	Very low	27.9	Very low	178 Å²	178	149.4 Å²	149.4	93%	0.932	78%	0.781	S	S	*	*			trans	-138.4	90.7	143.2	-92.7	158.2	0	0	0	107.9
293	V	25.3	Very low	28.2	Very low	113 Å²	113	149.7 Å²	149.7	69%	0.685	78%	0.776	S	S	*	*			trans	-94.3	164.8	166.3	-173.8	0	0	0	0	106.1	L291	L291-V293 HydrophobicContact CD2-CG2 4.43Å
294	P	30.9	Very low	28.6	Very low	107 Å²	107	149.9 Å²	149.9	70%	0.695	77%	0.766	S	S	*	*			cis	-127.1	159.4	-47.6	36.6	-22.7	0	0	0	111.9
295	I	26.6	Very low	29	Very low	159 Å²	159	151.8 Å²	151.8	82%	0.815	77%	0.765	S	S	*	*			trans	-142.6	123.3	149.4	-59.1	-176.5	0	0	0	110.8
296	S	25.8	Very low	29.4	Very low	94 Å²	94	151.1 Å²	151.1	66%	0.657	75%	0.748	S	S	*	*			trans	-65	140	178	59.5	0	0	0	0	114.4
297	H	30.1	Very low	29.8	Very low	182 Å²	182	151 Å²	151	84%	0.843	74%	0.736	S	S	*	*			trans	-145.4	101.8	145.9	-85.4	-68	0	0	0	113
298	K	30.5	Very low	30.4	Very low	188 Å²	188	154.5 Å²	154.5	82%	0.817	74%	0.741	S	S	*	*			trans	-2.8	132	150.3	-76.1	168.4	171.7	171.3	0	119.2
299	K	28.6	Very low	30.7	Very low	199 Å²	199	155.5 Å²	155.5	87%	0.865	74%	0.736	S	S	*	*			trans	49.7	101.1	137.8	-65.8	-176.3	176.8	-177.4	0	117.8
300	R	31.9	Very low	31	Very low	182 Å²	182	153.8 Å²	153.8	69%	0.687	73%	0.732	S	S	*	*			trans	-140.1	113.6	147.4	-92.1	-175.1	175	177	-5.7	112
301	N	33.3	Very low	31.3	Very low	86 Å²	86	156.5 Å²	156.5	46%	0.46	74%	0.743	S	S	.	*			trans	40	89.1	149.4	-72.4	-25.8	0	0	0	120.5	N230 R303	N230-N301 PolarHBondContact ND2-ND2 3.29Å; N230-N301 VanDerWaalsContact ND2-ND2 3.18Å; N301-R303 PolarHBondContact O-N 3.28Å
302	K	35.8	Very low	31.9	Very low	204 Å²	204	158.4 Å²	158.4	89%	0.887	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-72.1	14.7	153.2	-75.3	-173.6	175.1	-178.4	0	113.8
303	R	32.8	Very low	32.1	Very low	210 Å²	210	158.4 Å²	158.4	79%	0.792	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-86.5	-7.6	-171.8	-134.7	178.5	-167.1	-172.9	2.4	115	N301	N301-R303 PolarHBondContact O-N 3.28Å
304	Y	33.1	Very low	32.4	Very low	172 Å²	172	160.6 Å²	160.6	68%	0.675	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-100.7	-2.1	-176.9	-84.7	-88.6	0	0	0	115.7
305	Q	36	Very low	32.4	Very low	160 Å²	160	166.1 Å²	166.1	75%	0.748	75%	0.753	S	S	*	*	S	Bend	trans	-93.3	-3.1	177.4	-79.8	-175.6	-12.5	0	0	114.8
306	S	34.3	Very low	32.6	Very low	65 Å²	65	163.4 Å²	163.4	46%	0.455	75%	0.745	S	S	.	*	S	Bend	trans	-89.8	-29.5	-177.8	53.7	0	0	0	0	114.5	Q308 R309	S306-Q308 PolarHBondContact O-N 3.15Å; S306-R309 PolarHBondContact O-N 2.84Å
307	K	34.5	Very low	32.8	Very low	138 Å²	138	167 Å²	167	60%	0.6	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-34	179.7	-90.2	-175.3	172.3	-177.1	0	113	D225 R309	D225-K307 IonicContact OD1-NZ 2.9Å; D225-K307 PolarHBondContact OD1-NZ 2.9Å; D225-K307 IonicContact OD2-NZ 2.65Å; D225-K307 PolarHBondContact OD2-NZ 3.38Å; K307-R309 VanDerWaalsContact C-N 3.35Å; K307-R309 PolarHBondContact O-N 3.01Å
308	Q	37.4	Very low	33	Very low	176 Å²	176	168.4 Å²	168.4	82%	0.822	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-14.3	178.2	-80.4	-178.9	-10	0	0	114.6	S306	S306-Q308 PolarHBondContact O-N 3.15Å
309	R	32.1	Very low	32.8	Very low	207 Å²	207	166.9 Å²	166.9	78%	0.781	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-17	175.2	-78.5	-174.8	173.9	-176.1	-1.2	113.7	S306 K307	S306-R309 PolarHBondContact O-N 2.84Å; K307-R309 VanDerWaalsContact C-N 3.35Å; K307-R309 PolarHBondContact O-N 3.01Å
310	L	32.8	Very low	33.1	Very low	133 Å²	133	164.4 Å²	164.4	70%	0.696	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-80.9	-13.6	-177.5	-106.3	119	0	0	0	114.8	K312	L310-K312 VanDerWaalsContact C-N 3.31Å; L310-K312 PolarHBondContact O-N 2.91Å
311	M	33.8	Very low	33.1	Very low	184 Å²	184	161.9 Å²	161.9	91%	0.906	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-83.1	1.2	177.3	-88.3	178.3	162.6	0	0	114.9
312	K	38.2	Very low	33.3	Very low	189 Å²	189	170.8 Å²	170.8	82%	0.822	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-97.9	4.1	-179.3	-93.4	-175.9	176.2	-179.4	0	116.1	L310	L310-K312 VanDerWaalsContact C-N 3.31Å; L310-K312 PolarHBondContact O-N 2.91Å
313	F	30.2	Very low	33.1	Very low	178 Å²	178	169.1 Å²	169.1	78%	0.781	80%	0.797	S	S	*	*			trans	-116.8	4	-170.9	-86.5	-80.2	0	0	0	117.7	R315	F313-R315 PolarHBondContact O-N 3.04Å
314	N	32	Very low	33.2	Very low	160 Å²	160	166.9 Å²	166.9	86%	0.856	80%	0.797	S	S	*	*			trans	-100.3	48.3	178.5	-73.3	-11.2	0	0	0	113.6
315	R	31.8	Very low	33.2	Very low	223 Å²	223	166.7 Å²	166.7	84%	0.842	80%	0.804	S	S	*	*			trans	-91.2	128.5	158.9	-98.6	-173.2	-179.6	-176.4	0.5	108.5	F313 L317	F313-R315 PolarHBondContact O-N 3.04Å; R315-L317 PolarHBondContact O-N 3.29Å
316	P	29	Very low	33	Very low	102 Å²	102	167.1 Å²	167.1	66%	0.662	81%	0.807	S	S	*	*			trans	-70.5	103.1	173.4	28.9	-29.7	0	0	0	108.1	Y318	P316-Y318 PolarHBondContact O-N 3.37Å
317	L	31.6	Very low	32.9	Very low	170 Å²	170	173.4 Å²	173.4	89%	0.89	83%	0.829	S	S	*	*			trans	-84.9	106.8	167.5	-89.8	157.9	0	0	0	107.6	R315	R315-L317 PolarHBondContact O-N 3.29Å
318	Y	33.1	Very low	32.8	Very low	210 Å²	210	175.8 Å²	175.8	82%	0.824	85%	0.845	S	S	*	*			trans	-57.9	144.4	173.6	-73.7	-96.7	0	0	0	111.2	P316	P316-Y318 PolarHBondContact O-N 3.37Å
319	L	26.3	Very low	32.5	Very low	156 Å²	156	175.8 Å²	175.8	82%	0.817	85%	0.846	S	S	*	*			trans	-51	146.2	175.4	-75.3	130.2	0	0	0	113.7
320	T	34.8	Very low	32.5	Very low	148 Å²	148	173.4 Å²	173.4	91%	0.908	85%	0.851	S	S	*	*				-160.8	123.9	128.8	29.6	0	0	0	0	109.1
321	T	32.8	Very low	32.5	Very low	129 Å²	129	176.8 Å²	176.8	79%	0.791	86%	0.864	S	S	*	*			trans	-95.8	130.2	171.7	41.8	0	0	0	0	110.1
322	E	36.3	Very low	32.4	Very low	272 Å²	272	176.1 Å²	176.1	100%	1.271	86%	0.86	S	S	*	*			trans	-131.8	0	141	-83.8	-171	165.8	0	0	107.9

Retrieved 322 of 322 residues in 72.4 ms (Link to these results)

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