A0A077Z063_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z063, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 445 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	35.2	Very low	35.5	Very low	146 Å²	146	80.3 Å²	80.3	72%	0.719	44%	0.438	S	S	*	.				0	114.1	0	-142.7	167.2	170.3	0	0	107.2	A8 V10 I29 F314	M1-A8 HydrophobicContact CE-CB 3.62Å; M1-V10 HydrophobicContact CE-CG2 3.71Å; M1-V10 HydrophobicContact CG-CG2 3.91Å; M1-V10 HydrophobicContact SD-CG2 4.25Å; M1-I29 HydrophobicContact CE-CD1 3.63Å; M1-F314 HydrophobicContact CE-CD2 3.73Å; M1-F314 HydrophobicContact CE-CE2 3.85Å
2	K	28.9	Very low	35.7	Very low	144 Å²	144	76.5 Å²	76.5	63%	0.626	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.5	174.1	-88.3	-177.2	176.2	174.9	0	107.5	L61	K2-L61 HydrophobicContact CD-CD2 4.31Å
3	T	31	Very low	35.9	Very low	62 Å²	62	82.8 Å²	82.8	38%	0.38	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.5	172.2	41.5	0	0	0	0	108.6	A8	T3-A8 HydrophobicContact CG2-CB 4.36Å
4	V	31.1	Very low	35.9	Very low	78 Å²	78	81.1 Å²	81.1	47%	0.473	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	98.6	173	-178.6	0	0	0	0	105.4	E7	V4-E7 PolarHBondContact N-O 3.43Å
5	G	37.7	Very low	35.3	Very low	62 Å²	62	81.1 Å²	81.1	64%	0.639	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-170.8	-166.5	0	0	0	0	0	112.4	E7	G5-E7 PolarHBondContact O-N 2.89Å
6	D	37.7	Very low	34.7	Very low	116 Å²	116	85.8 Å²	85.8	62%	0.62	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-12.6	179.5	-75.1	-32.8	0	0	0	112.8	K31	D6-K31 WeakPolarHBondContact O-CB 2.88Å; D6-K31 WeakPolarHBondContact O-CD 2.85Å; D6-K31 WeakPolarHBondContact O-CG 3.44Å
7	E	34.7	Very low	34.3	Very low	74 Å²	74	91.8 Å²	91.8	35%	0.346	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.9	178	-62.2	175.7	-174.8	0	0	111.8	V4 G5 F9	V4-E7 PolarHBondContact N-O 3.43Å; G5-E7 PolarHBondContact O-N 2.89Å; E7-F9 HydrophobicContact CB-CD2 4.44Å; E7-F9 HydrophobicContact CB-CE2 3.64Å; E7-F9 HydrophobicContact CB-CZ 3.75Å; E7-F9 WeakPolarHBondContact OE2-CZ 3.23Å
8	A	38.5	Very low	34.2	Very low	0 Å²	0	94.3 Å²	94.3	0%	0	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.6	171.1	0	0	0	0	0	109.4	M1 T3 I29	M1-A8 HydrophobicContact CE-CB 3.62Å; T3-A8 HydrophobicContact CG2-CB 4.36Å; A8-I29 HydrophobicContact CB-CB 4.36Å; A8-I29 PolarHBondContact N-O 2.95Å; A8-I29 VanDerWaalsContact O-CB 3.3Å; A8-I29 WeakPolarHBondContact O-CB 3.43Å; A8-I29 PolarHBondContact O-N 3.14Å
9	F	37.3	Very low	34.2	Very low	72 Å²	72	93.5 Å²	93.5	32%	0.316	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.8	178.2	-59.9	-85.7	0	0	0	109.8	E7 V28	E7-F9 HydrophobicContact CB-CD2 4.44Å; E7-F9 HydrophobicContact CB-CE2 3.64Å; E7-F9 HydrophobicContact CB-CZ 3.75Å; E7-F9 WeakPolarHBondContact OE2-CZ 3.23Å; F9-V28 HydrophobicContact CD1-CG1 4.15Å; F9-V28 HydrophobicContact CD1-CG2 4.36Å; F9-V28 HydrophobicContact CE1-CG1 3.86Å
10	V	40.6	Very low	34.4	Very low	30 Å²	30	92.2 Å²	92.2	18%	0.182	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	97.6	168.1	-172.4	0	0	0	0	107.3	M1 L12 V27 I29 V310	M1-V10 HydrophobicContact CE-CG2 3.71Å; M1-V10 HydrophobicContact CG-CG2 3.91Å; M1-V10 HydrophobicContact SD-CG2 4.25Å; V10-L12 HydrophobicContact CG1-CD2 3.93Å; V10-L12 HydrophobicContact CG1-CG 4Å; V10-L12 PolarHBondContact O-N 2.64Å; V10-V27 CarbonylContact C-O 3.59Å; V10-V27 PolarHBondContact N-O 3.16Å; V10-V27 VanDerWaalsContact N-O 3.13Å; V10-V27 PolarHBondContact O-N 3.17Å; V10-I29 HydrophobicContact CG2-CD1 4.22Å; V10-V310 HydrophobicContact CG1-CG1 4.42Å
11	L	38.1	Very low	34.6	Very low	99 Å²	99	91.9 Å²	91.9	52%	0.518	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	111.6	170.4	-137.9	98.7	0	0	0	107.7	F24 Q26	L11-F24 HydrophobicContact CD1-CZ 4.02Å; L11-F24 HydrophobicContact CD2-CE2 3.72Å; L11-F24 HydrophobicContact CD2-CZ 3.67Å; L11-F24 HydrophobicContact CG-CE2 4.06Å; L11-F24 HydrophobicContact CG-CZ 3.68Å; L11-Q26 HydrophobicContact CD1-CG 4Å
12	L	37.6	Very low	34.9	Very low	35 Å²	35	88.7 Å²	88.7	18%	0.183	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	94	172.6	-64.7	168.8	0	0	0	107.8	V10 F14 V27 V310	V10-L12 HydrophobicContact CG1-CD2 3.93Å; V10-L12 HydrophobicContact CG1-CG 4Å; V10-L12 PolarHBondContact O-N 2.64Å; L12-F14 HydrophobicContact CB-CD2 4.16Å; L12-F14 HydrophobicContact CB-CE2 3.46Å; L12-F14 VanDerWaalsContact CB-CE2 3.46Å; L12-F14 HydrophobicContact CB-CZ 3.87Å; L12-F14 HydrophobicContact CD1-CE2 4.13Å; L12-F14 HydrophobicContact CD1-CZ 4.18Å; L12-F14 HydrophobicContact CG-CE2 4.36Å; L12-F14 HydrophobicContact CG-CZ 4.44Å; L12-F14 PolarHBondContact O-N 3.44Å; L12-V27 HydrophobicContact CD1-CG2 3.81Å; L12-V310 HydrophobicContact CD1-CB 4.11Å; L12-V310 HydrophobicContact CD1-CG1 4.29Å; L12-V310 HydrophobicContact CD1-CG2 3.62Å; L12-V310 HydrophobicContact CD2-CG2 4.13Å; L12-V310 HydrophobicContact CG-CG2 4.47Å
13	R	37.8	Very low	35.6	Very low	159 Å²	159	84.9 Å²	84.9	60%	0.6	47%	0.471	S	S	*	.			trans	-76.5	107.2	173.1	-171.6	173.5	174.9	161.5	-2.2	108.3
14	F	35.8	Very low	36.5	Very low	58 Å²	58	83.3 Å²	83.3	25%	0.254	46%	0.459	S	S	.	.			trans	-95.5	122.4	167	-63.3	-74.4	0	0	0	108	L12 T23 T306	L12-F14 HydrophobicContact CB-CD2 4.16Å; L12-F14 HydrophobicContact CB-CE2 3.46Å; L12-F14 VanDerWaalsContact CB-CE2 3.46Å; L12-F14 HydrophobicContact CB-CZ 3.87Å; L12-F14 HydrophobicContact CD1-CE2 4.13Å; L12-F14 HydrophobicContact CD1-CZ 4.18Å; L12-F14 HydrophobicContact CG-CE2 4.36Å; L12-F14 HydrophobicContact CG-CZ 4.44Å; L12-F14 PolarHBondContact O-N 3.44Å; F14-T23 VanDerWaalsContact O-O 3.13Å; F14-T306 HydrophobicContact CE1-CG2 3.87Å; F14-T306 VanDerWaalsContact CZ-CB 3.46Å; F14-T306 HydrophobicContact CZ-CG2 4.09Å; F14-T306 WeakPolarHBondContact CZ-OG1 3.49Å
15	S	27	Very low	37.3	Very low	81 Å²	81	79.9 Å²	79.9	57%	0.566	44%	0.438	S	S	*	.			trans	-115.4	102.3	169	-22.1	0	0	0	0	104.5
16	F	26.8	Very low	38	Very low	156 Å²	156	77.8 Å²	77.8	68%	0.684	41%	0.412	S	S	*	.			trans	-141.3	121.8	174	-83.8	-76.8	0	0	0	111.9
17	Y	27.3	Very low	38.5	Very low	189 Å²	189	72.3 Å²	72.3	74%	0.741	38%	0.382	S	S	*	.			trans	98.7	130.7	167	-67.3	-83	0	0	0	118.6	S19	Y17-S19 PolarHBondContact O-N 3.39Å
18	P	32.6	Very low	39.2	Very low	136 Å²	136	69.5 Å²	69.5	88%	0.883	37%	0.371	S	S	*	.	S	Bend	trans	-76.1	37.6	-179.6	36.4	-39	0	0	0	112.4
19	S	34.6	Very low	39.8	Very low	80 Å²	80	69.6 Å²	69.6	56%	0.559	37%	0.371	S	S	*	.	S	Bend	trans	-131.1	84.4	-177.2	62.5	0	0	0	0	110.2	Y17 N21	Y17-S19 PolarHBondContact O-N 3.39Å; S19-N21 PolarHBondContact O-N 3.44Å
20	A	37.1	Very low	40.3	Very low	67 Å²	67	67.9 Å²	67.9	55%	0.554	37%	0.365	S	S	*	.	S	Bend	trans	46.1	-10.1	162	0	0	0	0	0	121.2	V45	A20-V45 PolarHBondContact O-N 3.44Å; A20-V45 VanDerWaalsContact O-O 3.14Å
21	N	39.1	Very low	40.7	Very low	85 Å²	85	67.8 Å²	67.8	46%	0.455	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	108.6	-171.9	-70.3	-7	0	0	0	109.2	S19 V44	S19-N21 PolarHBondContact O-N 3.44Å; N21-V44 WeakPolarHBondContact OD1-CG1 3.21Å
22	C	41.4	Very low	40.6	Very low	79 Å²	79	66.6 Å²	66.6	53%	0.534	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	114.1	172.1	-74.1	0	0	0	0	109	G43	C22-G43 PolarHBondContact N-O 3.45Å; C22-G43 VanDerWaalsContact N-O 3.13Å; C22-G43 PolarHBondContact O-N 3.32Å; C22-G43 VanDerWaalsContact O-N 3.13Å
23	T	44.7	Very low	40.8	Very low	65 Å²	65	66.3 Å²	66.3	40%	0.399	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.8	174.3	53.1	0	0	0	0	110.5	F14 E42	F14-T23 VanDerWaalsContact O-O 3.13Å; T23-E42 HydrophobicContact CG2-CB 4.23Å; T23-E42 HydrophobicContact CG2-CG 3.82Å
24	F	48.9	Very low	41.5	Very low	28 Å²	28	65.5 Å²	65.5	12%	0.123	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.1	179.8	175.2	-99.5	0	0	0	110.3	L11 Q26 V41 F271	L11-F24 HydrophobicContact CD1-CZ 4.02Å; L11-F24 HydrophobicContact CD2-CE2 3.72Å; L11-F24 HydrophobicContact CD2-CZ 3.67Å; L11-F24 HydrophobicContact CG-CE2 4.06Å; L11-F24 HydrophobicContact CG-CZ 3.68Å; F24-Q26 HydrophobicContact CE1-CB 3.79Å; F24-Q26 HydrophobicContact CZ-CB 4.24Å; F24-V41 HydrophobicContact CD1-CB 4.42Å; F24-V41 PolarHBondContact N-O 3.16Å; F24-V41 PolarHBondContact O-N 3.19Å; F24-V41 VanDerWaalsContact O-O 3.04Å; F24-F271 HydrophobicContact CD1-CZ 4.41Å
25	S	47.9	Very low	42.3	Very low	7 Å²	7	68.1 Å²	68.1	5%	0.049	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.2	175.8	-68.5	0	0	0	0	110.8	R40 E307	S25-R40 WeakPolarHBondContact OG-CD 3.39Å; S25-R40 WeakPolarHBondContact OG-CG 3.45Å; S25-E307 VanDerWaalsContact CB-OE1 3.26Å; S25-E307 WeakPolarHBondContact CB-OE1 3.4Å; S25-E307 PolarHBondContact OG-OE1 2.84Å
26	Q	51.4	Low	43.6	Very low	17 Å²	17	64.3 Å²	64.3	8%	0.079	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.5	169.9	-174	174.1	-3.7	0	0	110.2	L11 F24 V28 R39	L11-Q26 HydrophobicContact CD1-CG 4Å; F24-Q26 HydrophobicContact CE1-CB 3.79Å; F24-Q26 HydrophobicContact CZ-CB 4.24Å; Q26-V28 HydrophobicContact CG-CG2 3.94Å; Q26-R39 PolarHBondContact N-O 3.34Å; Q26-R39 PolarHBondContact O-N 2.68Å; Q26-R39 VanDerWaalsContact O-O 3.14Å
27	V	48.5	Very low	45	Very low	1 Å²	1	57.7 Å²	57.7	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.3	171.9	-177.4	0	0	0	0	108.5	V10 L12 I29 I36 I38 E307	V10-V27 CarbonylContact C-O 3.59Å; V10-V27 PolarHBondContact N-O 3.16Å; V10-V27 VanDerWaalsContact N-O 3.13Å; V10-V27 PolarHBondContact O-N 3.17Å; L12-V27 HydrophobicContact CD1-CG2 3.81Å; V27-I29 HydrophobicContact CG1-CG1 4.29Å; V27-I36 HydrophobicContact CG1-CG2 4.05Å; V27-I38 HydrophobicContact CG1-CG1 4.33Å; V27-I38 HydrophobicContact CG2-CG1 4.32Å; V27-I38 HydrophobicContact CG2-CG2 4.25Å; V27-E307 HydrophobicContact CG2-CG 4.46Å
28	V	50.8	Low	46.3	Very low	16 Å²	16	48.7 Å²	48.7	10%	0.097	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.1	176.1	-177.7	0	0	0	0	108.5	F9 Q26 T37	F9-V28 HydrophobicContact CD1-CG1 4.15Å; F9-V28 HydrophobicContact CD1-CG2 4.36Å; F9-V28 HydrophobicContact CE1-CG1 3.86Å; Q26-V28 HydrophobicContact CG-CG2 3.94Å; V28-T37 PolarHBondContact N-O 3.43Å; V28-T37 PolarHBondContact O-N 2.95Å
29	I	49.6	Very low	47.3	Very low	2 Å²	2	46.3 Å²	46.3	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	99.6	174.9	-58.1	163.8	0	0	0	107.5	M1 A8 V10 V27 K31 I36 W287 F314	M1-I29 HydrophobicContact CE-CD1 3.63Å; A8-I29 HydrophobicContact CB-CB 4.36Å; A8-I29 PolarHBondContact N-O 2.95Å; A8-I29 VanDerWaalsContact O-CB 3.3Å; A8-I29 WeakPolarHBondContact O-CB 3.43Å; A8-I29 PolarHBondContact O-N 3.14Å; V10-I29 HydrophobicContact CG2-CD1 4.22Å; V27-I29 HydrophobicContact CG1-CG1 4.29Å; I29-K31 HydrophobicContact CG2-CG 4.39Å; I29-K31 PolarHBondContact O-N 3.21Å; I29-I36 HydrophobicContact CG1-CG1 4.39Å; I29-I36 HydrophobicContact CG1-CG2 3.96Å; I29-I36 HydrophobicContact CG2-CG1 4.27Å; I29-W287 HydrophobicContact CG2-CZ2 3.96Å; I29-F314 HydrophobicContact CD1-CD2 3.75Å; I29-F314 HydrophobicContact CD1-CE2 4.01Å; I29-F314 HydrophobicContact CD1-CG 4.05Å; I29-F314 HydrophobicContact CG2-CE1 3.95Å; I29-F314 HydrophobicContact CG2-CE2 4.04Å; I29-F314 HydrophobicContact CG2-CZ 3.62Å
30	D	49	Very low	48.1	Very low	35 Å²	35	44.4 Å²	44.4	19%	0.187	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	105.3	172.9	-178.5	-10.4	0	0	0	108.9	S32 A33 R35	D30-S32 WeakPolarHBondContact OD1-CB 3.39Å; D30-S32 PolarHBondContact OD1-N 3.12Å; D30-S32 PolarHBondContact OD1-OG 3.22Å; D30-A33 HydrophobicContact CB-CB 4.4Å; D30-A33 PolarHBondContact OD1-N 2.72Å; D30-A33 VanDerWaalsContact OD1-N 3.08Å; D30-A33 WeakPolarHBondContact OD2-CB 3.44Å; D30-R35 PolarHBondContact N-O 3.14Å; D30-R35 VanDerWaalsContact N-O 3.1Å; D30-R35 PolarHBondContact O-N 2.71Å
31	K	48.2	Very low	48.6	Very low	29 Å²	29	42.1 Å²	42.1	13%	0.126	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-25.6	-179.1	-54.6	-176.2	-160.3	146.5	0	113.7	D6 I29 W287 H413	D6-K31 WeakPolarHBondContact O-CB 2.88Å; D6-K31 WeakPolarHBondContact O-CD 2.85Å; D6-K31 WeakPolarHBondContact O-CG 3.44Å; I29-K31 HydrophobicContact CG2-CG 4.39Å; I29-K31 PolarHBondContact O-N 3.21Å; K31-W287 HydrophobicContact CB-CH2 3.55Å; K31-W287 HydrophobicContact CB-CZ2 4.27Å; K31-W287 HydrophobicContact CB-CZ3 4.41Å; K31-W287 HydrophobicContact CG-CH2 3.85Å; K31-W287 HydrophobicContact CG-CZ2 4.2Å; K31-W287 WeakPolarHBondContact O-CH2 3.39Å; K31-W287 VanDerWaalsContact O-CZ3 3.27Å; K31-W287 WeakPolarHBondContact O-CZ3 3.39Å; K31-H413 PolarHBondContact NZ-CE1 2.8Å; K31-H413 VanDerWaalsContact NZ-CE1 3.3Å
32	S	36.9	Very low	48.9	Very low	73 Å²	73	41.8 Å²	41.8	51%	0.51	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-38.7	-176.9	73.7	0	0	0	0	111.1	D30 R34	D30-S32 WeakPolarHBondContact OD1-CB 3.39Å; D30-S32 PolarHBondContact OD1-N 3.12Å; D30-S32 PolarHBondContact OD1-OG 3.22Å; S32-R34 VanDerWaalsContact C-N 3.32Å; S32-R34 PolarHBondContact O-N 2.84Å
33	A	42.4	Very low	48.8	Very low	29 Å²	29	38.3 Å²	38.3	24%	0.24	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	7.3	-177.3	0	0	0	0	0	114.1	D30 R35	D30-A33 HydrophobicContact CB-CB 4.4Å; D30-A33 PolarHBondContact OD1-N 2.72Å; D30-A33 VanDerWaalsContact OD1-N 3.08Å; D30-A33 WeakPolarHBondContact OD2-CB 3.44Å; A33-R35 VanDerWaalsContact C-N 3.32Å; A33-R35 WeakPolarHBondContact O-CG 3.42Å; A33-R35 PolarHBondContact O-N 3.34Å; A33-R35 PolarHBondContact O-NE 3.02Å
34	R	52.3	Low	48.4	Very low	142 Å²	142	36.8 Å²	36.8	54%	0.536	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	43.8	-175.5	-62	-171.3	173.4	-174	-3.5	114.3	S32 W287 E288	S32-R34 VanDerWaalsContact C-N 3.32Å; S32-R34 PolarHBondContact O-N 2.84Å; R34-W287 VanDerWaalsContact CA-CD2 3.44Å; R34-W287 HydrophobicContact CB-CB 4.03Å; R34-W287 HydrophobicContact CB-CD2 3.98Å; R34-W287 HydrophobicContact CB-CE3 3.46Å; R34-W287 VanDerWaalsContact CB-CE3 3.46Å; R34-W287 HydrophobicContact CB-CG 4.24Å; R34-W287 HydrophobicContact CB-CZ3 4.18Å; R34-W287 HydrophobicContact CG-CE3 3.63Å; R34-W287 HydrophobicContact CG-CZ3 4.05Å; R34-W287 WeakPolarHBondContact O-CB 3.45Å; R34-W287 PolarHBondContact O-N 3.32Å; R34-E288 IonicContact NH1-OE1 3.09Å; R34-E288 PolarHBondContact NH1-OE1 3.37Å
35	R	51.8	Low	47.8	Very low	114 Å²	114	38.9 Å²	38.9	43%	0.43	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.2	-170.8	-81.8	176.2	-90.8	178.8	-3.7	112.1	D30 A33 V284 F285 N286	D30-R35 PolarHBondContact N-O 3.14Å; D30-R35 VanDerWaalsContact N-O 3.1Å; D30-R35 PolarHBondContact O-N 2.71Å; A33-R35 VanDerWaalsContact C-N 3.32Å; A33-R35 WeakPolarHBondContact O-CG 3.42Å; A33-R35 PolarHBondContact O-N 3.34Å; A33-R35 PolarHBondContact O-NE 3.02Å; R35-V284 HydrophobicContact CB-CG1 4.32Å; R35-V284 HydrophobicContact CG-CG1 4.12Å; R35-F285 CarbonylContact C-O 3.57Å; R35-F285 WeakPolarHBondContact CA-O 3.49Å; R35-N286 WeakPolarHBondContact CD-OD1 3.28Å; R35-N286 WeakPolarHBondContact CG-OD1 3.4Å
36	I	54	Low	47.1	Very low	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.7	166.3	-53.3	175.9	0	0	0	107.4	V27 I29 F285 L290 V311 F314	V27-I36 HydrophobicContact CG1-CG2 4.05Å; I29-I36 HydrophobicContact CG1-CG1 4.39Å; I29-I36 HydrophobicContact CG1-CG2 3.96Å; I29-I36 HydrophobicContact CG2-CG1 4.27Å; I36-F285 HydrophobicContact CB-CB 4.23Å; I36-F285 PolarHBondContact N-O 3.42Å; I36-F285 PolarHBondContact O-N 2.94Å; I36-L290 HydrophobicContact CD1-CD1 3.79Å; I36-L290 HydrophobicContact CG1-CD1 4.41Å; I36-V311 HydrophobicContact CD1-CG1 4.05Å; I36-V311 HydrophobicContact CD1-CG2 4.5Å; I36-V311 HydrophobicContact CG2-CG2 4.21Å; I36-F314 HydrophobicContact CD1-CD1 3.79Å; I36-F314 HydrophobicContact CD1-CE1 4.3Å
37	T	56	Low	46.2	Very low	16 Å²	16	45.5 Å²	45.5	10%	0.098	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.2	-179.3	-60.8	0	0	0	0	109.2	V28 R39 E282 V284	V28-T37 PolarHBondContact N-O 3.43Å; V28-T37 PolarHBondContact O-N 2.95Å; T37-R39 HydrophobicContact CG2-CG 3.98Å; T37-E282 HydrophobicContact CG2-CG 3.48Å; T37-E282 VanDerWaalsContact CG2-CG 3.48Å; T37-E282 WeakPolarHBondContact CG2-OE1 3.38Å; T37-V284 HydrophobicContact CG2-CG2 4.22Å
38	I	55.6	Low	45.1	Very low	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	116.7	173.3	-53	-167.1	0	0	0	107.5	V27 E282 T283 F285 E307 V311	V27-I38 HydrophobicContact CG1-CG1 4.33Å; V27-I38 HydrophobicContact CG2-CG1 4.32Å; V27-I38 HydrophobicContact CG2-CG2 4.25Å; I38-E282 CarbonylContact O-C 3.55Å; I38-E282 WeakPolarHBondContact O-CA 3.33Å; I38-T283 PolarHBondContact N-O 2.81Å; I38-T283 PolarHBondContact O-N 2.97Å; I38-F285 HydrophobicContact CD1-CD2 4.29Å; I38-F285 HydrophobicContact CD1-CE2 3.73Å; I38-F285 HydrophobicContact CG1-CD2 4.32Å; I38-F285 HydrophobicContact CG1-CE2 4.13Å; I38-E307 HydrophobicContact CD1-CB 3.78Å; I38-E307 HydrophobicContact CD1-CG 4.13Å; I38-E307 HydrophobicContact CG2-CG 3.98Å; I38-V311 HydrophobicContact CD1-CG2 4.06Å
39	R	53.8	Low	44	Very low	87 Å²	87	57 Å²	57	33%	0.328	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.8	175.4	-67.4	-177.4	178.5	171.5	-0.9	108.9	Q26 T37 E282	Q26-R39 PolarHBondContact N-O 3.34Å; Q26-R39 PolarHBondContact O-N 2.68Å; Q26-R39 VanDerWaalsContact O-O 3.14Å; T37-R39 HydrophobicContact CG2-CG 3.98Å; R39-E282 HydrophobicContact CG-CG 4.05Å; R39-E282 IonicContact CZ-OE1 2.82Å; R39-E282 VanDerWaalsContact CZ-OE1 3.3Å; R39-E282 IonicContact NE-OE1 2.8Å; R39-E282 PolarHBondContact NE-OE1 3.13Å; R39-E282 IonicContact NH2-OE1 3.66Å; R39-E282 PolarHBondContact NH2-OE1 3.44Å
40	R	50.3	Low	43.1	Very low	40 Å²	40	64.4 Å²	64.4	15%	0.151	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.2	169	-62.8	-152.7	-168.2	133.6	14.7	110.2	S25 R281 A302 C303 T304 E307	S25-R40 WeakPolarHBondContact OG-CD 3.39Å; S25-R40 WeakPolarHBondContact OG-CG 3.45Å; R40-R281 PolarHBondContact N-O 3.17Å; R40-R281 PolarHBondContact O-N 3.18Å; R40-R281 VanDerWaalsContact O-N 3.14Å; R40-A302 VanDerWaalsContact CZ-O 3.32Å; R40-A302 PolarHBondContact NH1-O 3.46Å; R40-A302 PolarHBondContact NH2-O 2.82Å; R40-C303 VanDerWaalsContact NH2-C 3.27Å; R40-C303 VanDerWaalsContact NH2-CA 3.27Å; R40-T304 VanDerWaalsContact NH2-CG2 3.28Å; R40-E307 IonicContact CZ-OE1 3.69Å; R40-E307 IonicContact CZ-OE2 3.35Å; R40-E307 IonicContact NE-OE1 2.63Å; R40-E307 PolarHBondContact NE-OE1 3.35Å; R40-E307 IonicContact NE-OE2 2.89Å; R40-E307 PolarHBondContact NE-OE2 3.44Å; R40-E307 IonicContact NH2-OE1 3.36Å; R40-E307 IonicContact NH2-OE2 3.26Å; R40-E307 PolarHBondContact NH2-OE2 3.49Å
41	V	47.5	Very low	42.3	Very low	18 Å²	18	68.3 Å²	68.3	11%	0.109	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	109.6	169.5	-172.7	0	0	0	0	106.7	F24 F271 L277	F24-V41 HydrophobicContact CD1-CB 4.42Å; F24-V41 PolarHBondContact N-O 3.16Å; F24-V41 PolarHBondContact O-N 3.19Å; F24-V41 VanDerWaalsContact O-O 3.04Å; V41-F271 HydrophobicContact CB-CE2 4.43Å; V41-F271 HydrophobicContact CB-CZ 3.99Å; V41-F271 HydrophobicContact CG1-CE1 4.28Å; V41-F271 HydrophobicContact CG1-CE2 3.78Å; V41-F271 HydrophobicContact CG1-CZ 3.52Å; V41-L277 HydrophobicContact CG1-CD2 3.86Å
42	E	45	Very low	41.4	Very low	78 Å²	78	73.4 Å²	73.4	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	110.5	173.8	-61.8	-172.2	168.9	0	0	107.7	T23 C278	T23-E42 HydrophobicContact CG2-CB 4.23Å; T23-E42 HydrophobicContact CG2-CG 3.82Å; E42-C278 HydrophobicContact CB-CB 4.41Å; E42-C278 WeakPolarHBondContact O-CB 3.46Å; E42-C278 PolarHBondContact O-N 3.41Å; E42-C278 VanDerWaalsContact O-N 3.11Å
43	G	39.4	Very low	41.2	Very low	6 Å²	6	78.5 Å²	78.5	6%	0.062	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.8	174.7	0	0	0	0	0	110	C22 V45	C22-G43 PolarHBondContact N-O 3.45Å; C22-G43 VanDerWaalsContact N-O 3.13Å; C22-G43 PolarHBondContact O-N 3.32Å; C22-G43 VanDerWaalsContact O-N 3.13Å; G43-V45 PolarHBondContact O-N 3.39Å
44	V	36.9	Very low	40.4	Very low	34 Å²	34	81.8 Å²	81.8	21%	0.206	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	109.2	166.4	177.4	0	0	0	0	106.6	N21 N46 D276	N21-V44 WeakPolarHBondContact OD1-CG1 3.21Å; V44-N46 WeakPolarHBondContact CG1-OD1 3.35Å; V44-N46 PolarHBondContact O-N 2.95Å; V44-D276 PolarHBondContact N-O 3.36Å
45	V	35.9	Very low	39.2	Very low	72 Å²	72	83.5 Å²	83.5	44%	0.436	46%	0.461	S	S	.	.			trans	-88.7	90.7	173.2	-175	0	0	0	0	106.1	A20 G43 G47	A20-V45 PolarHBondContact O-N 3.44Å; A20-V45 VanDerWaalsContact O-O 3.14Å; G43-V45 PolarHBondContact O-N 3.39Å; V45-G47 PolarHBondContact O-N 3.36Å
46	N	32.8	Very low	38.4	Very low	122 Å²	122	84 Å²	84	65%	0.652	47%	0.472	S	S	*	.			trans	-69.3	83.1	170.5	-80.7	-28.1	0	0	0	109.1	V44	V44-N46 WeakPolarHBondContact CG1-OD1 3.35Å; V44-N46 PolarHBondContact O-N 2.95Å
47	G	32.9	Very low	37.2	Very low	41 Å²	41	88.9 Å²	88.9	42%	0.423	50%	0.504	S	S	.	.			trans	-172.9	115.1	175.1	0	0	0	0	0	110.2	V45 N49	V45-G47 PolarHBondContact O-N 3.36Å; G47-N49 PolarHBondContact O-N 3.38Å
48	S	25.7	Very low	35.8	Very low	122 Å²	122	91 Å²	91	85%	0.853	53%	0.528	S	S	*	.			trans	-68.3	73.6	168.4	59	0	0	0	0	109.6
49	N	28.4	Very low	34.3	Very low	135 Å²	135	97 Å²	97	72%	0.722	56%	0.564	S	S	*	*			trans	-120.2	115.5	169.8	-77.1	-10.3	0	0	0	107.4	G47 C51	G47-N49 PolarHBondContact O-N 3.38Å; N49-C51 PolarHBondContact O-N 3.26Å
50	D	29.4	Very low	33.2	Very low	158 Å²	158	101.8 Å²	101.8	85%	0.845	59%	0.588	S	S	*	*			trans	-45.5	109.6	160.2	-70.7	-48.9	0	0	0	107.8	D52	D50-D52 PolarHBondContact O-N 3.3Å
51	C	32.5	Very low	32	Very low	118 Å²	118	104.4 Å²	104.4	80%	0.797	61%	0.605	S	S	*	*			trans	-73.4	83.4	170	-69.9	0	0	0	0	106.8	N49 D53	N49-C51 PolarHBondContact O-N 3.26Å; C51-D53 PolarHBondContact O-N 3.28Å
52	D	29.3	Very low	31.1	Very low	135 Å²	135	108.2 Å²	108.2	72%	0.722	64%	0.638	S	S	*	*			trans	-57.4	132.3	161.8	-86.3	-29	0	0	0	107.9	D50 S54	D50-D52 PolarHBondContact O-N 3.3Å; D52-S54 PolarHBondContact O-N 2.94Å
53	D	33	Very low	30.3	Very low	181 Å²	181	113 Å²	113	97%	0.968	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	13.9	-170	-87.9	-37.2	0	0	0	116.3	C51	C51-D53 PolarHBondContact O-N 3.28Å
54	S	26.8	Very low	29.7	Very low	98 Å²	98	122.1 Å²	122.1	69%	0.685	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	-0.4	-159.9	56.4	0	0	0	0	118.4	D52	D52-S54 PolarHBondContact O-N 2.94Å
55	E	27.1	Very low	29.4	Very low	178 Å²	178	125.7 Å²	125.7	83%	0.832	73%	0.732	S	S	*	*			trans	-141.6	69.8	179.4	-66.8	-166.2	170.5	0	0	115.4
56	L	33.4	Very low	29	Very low	123 Å²	123	132.5 Å²	132.5	64%	0.644	75%	0.75	S	S	*	*			trans	-131.4	118.6	153.3	-82	167.9	0	0	0	109.4	G58	L56-G58 PolarHBondContact O-N 3.48Å
57	P	29.3	Very low	28.7	Very low	105 Å²	105	136 Å²	136	68%	0.682	76%	0.76	S	S	*	*			trans	-62.7	117.1	-177.1	24.7	-30.8	0	0	0	109.4
58	G	26.5	Very low	28.5	Very low	59 Å²	59	138.6 Å²	138.6	61%	0.608	78%	0.777	S	S	*	*			trans	-62.8	144.6	174.9	0	0	0	0	0	111.9	L56	L56-G58 PolarHBondContact O-N 3.48Å
59	V	24.9	Very low	28.6	Very low	126 Å²	126	142.3 Å²	142.3	76%	0.764	78%	0.778	S	S	*	*			trans	63.5	89.7	156	-166.9	0	0	0	0	115.1	L61	V59-L61 HydrophobicContact CG1-CG 4.45Å
60	F	29.3	Very low	28.4	Very low	189 Å²	189	147.5 Å²	147.5	83%	0.829	79%	0.787	S	S	*	*			trans	-99.1	108.4	155.4	-78.6	-80.6	0	0	0	110.5
61	L	25.7	Very low	28.4	Very low	95 Å²	95	147.5 Å²	147.5	50%	0.497	79%	0.787	S	S	.	*			trans	-73.7	123.5	162.7	-75.6	160.6	0	0	0	107.7	K2 V59 K63	K2-L61 HydrophobicContact CD-CD2 4.31Å; V59-L61 HydrophobicContact CG1-CG 4.45Å; L61-K63 VanDerWaalsContact C-N 3.28Å; L61-K63 PolarHBondContact O-N 2.9Å
62	A	28.6	Very low	28	Very low	98 Å²	98	147.7 Å²	147.7	81%	0.81	79%	0.788	S	S	*	*			trans	-65.3	89	169.8	0	0	0	0	0	109.7
63	K	28.1	Very low	27.8	Very low	178 Å²	178	148 Å²	148	77%	0.774	80%	0.796	S	S	*	*			trans	-96.6	131.2	163.9	-82.5	-174	175.8	-179.8	0	107.9	L61	L61-K63 VanDerWaalsContact C-N 3.28Å; L61-K63 PolarHBondContact O-N 2.9Å
64	Q	26.6	Very low	27.6	Very low	197 Å²	197	148.4 Å²	148.4	92%	0.921	80%	0.796	S	S	*	*			trans	82.1	95.2	164	-60.1	177.4	-10	0	0	117.8
65	A	31.9	Very low	27.5	Very low	109 Å²	109	147.3 Å²	147.3	90%	0.901	80%	0.801	S	S	*	*			trans	-147.2	85.6	137.4	0	0	0	0	0	109.3
66	R	27	Very low	27.5	Very low	216 Å²	216	149 Å²	149	82%	0.815	81%	0.805	S	S	*	*			trans	-104.1	140	156.9	-73.4	-174.8	172.1	179.9	-2.7	106.8
67	F	26.9	Very low	27.1	Very low	196 Å²	196	149.3 Å²	149.3	86%	0.86	81%	0.812	S	S	*	*			trans	74.1	135.9	173.1	-44.9	-77.4	0	0	0	113.8
68	A	27.4	Very low	27	Very low	95 Å²	95	149.8 Å²	149.8	79%	0.785	82%	0.818	S	S	*	*			cis	-158.6	155.8	23.2	0	0	0	0	0	111.9
69	K	28.2	Very low	27	Very low	200 Å²	200	155.8 Å²	155.8	87%	0.87	83%	0.83	S	S	*	*			trans	-54.3	135.5	161.3	-67.3	172.5	173.8	178.2	0	110.4
70	R	25.2	Very low	27.3	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	83%	0.832	S	S	*	*			trans	171.8	148.2	133.5	-92.4	158.5	-170.4	178.6	3.7	113.6
71	N	29.1	Very low	27.3	Very low	159 Å²	159	153 Å²	153	85%	0.85	83%	0.833	S	S	*	*			trans	-55.8	145.7	-175.1	-58.9	-24	0	0	0	115.2
72	C	24.6	Very low	27.7	Very low	121 Å²	121	157.9 Å²	157.9	82%	0.818	85%	0.851	S	S	*	*			trans	-135.1	135.6	159.9	-83.2	0	0	0	0	111.9
73	T	25.1	Very low	27.5	Very low	143 Å²	143	161.9 Å²	161.9	88%	0.877	85%	0.853	S	S	*	*			trans	-89.7	145.7	-177.6	32.2	0	0	0	0	111.9
74	L	27.3	Very low	27.8	Very low	188 Å²	188	162.6 Å²	162.6	98%	0.984	86%	0.856	S	S	*	*			trans	-62	130.9	176.7	-84.6	150.7	0	0	0	112.8
75	G	24.4	Very low	27.8	Very low	76 Å²	76	160.7 Å²	160.7	78%	0.784	85%	0.852	S	S	*	*			trans	-147.1	95.7	176.7	0	0	0	0	0	113.6
76	K	27.6	Very low	27.9	Very low	212 Å²	212	162.2 Å²	162.2	92%	0.922	85%	0.85	S	S	*	*			trans	22.6	125.7	156	-64.6	-179.8	179.3	178.1	0	121.7
77	V	26.2	Very low	27.9	Very low	130 Å²	130	155.8 Å²	155.8	79%	0.788	84%	0.843	S	S	*	*			trans	-67.5	140.1	165.2	179.9	0	0	0	0	112
78	S	26.5	Very low	28.1	Very low	115 Å²	115	154.3 Å²	154.3	80%	0.804	84%	0.844	S	S	*	*			trans	-141.2	123.8	157.2	62.4	0	0	0	0	111.2
79	H	26.3	Very low	27.9	Very low	185 Å²	185	153.3 Å²	153.3	86%	0.856	84%	0.844	S	S	*	*			trans	-72.6	138.7	170.5	-75.1	-88.1	0	0	0	110.9
80	S	31	Very low	28	Very low	117 Å²	117	150 Å²	150	82%	0.818	84%	0.84	S	S	*	*			trans	-124.1	118.7	162.4	72.5	0	0	0	0	111.2
81	T	29.3	Very low	28	Very low	139 Å²	139	147.4 Å²	147.4	85%	0.853	84%	0.838	S	S	*	*			trans	-63.8	132.4	167.1	37.5	0	0	0	0	111.4
82	K	33.9	Very low	28.2	Very low	198 Å²	198	151 Å²	151	86%	0.861	84%	0.84	S	S	*	*			trans	-160.5	113.2	151.6	-109.4	172.9	-171.2	-175	0	110.2
83	E	25.9	Very low	28.4	Very low	183 Å²	183	155 Å²	155	86%	0.855	84%	0.843	S	S	*	*			trans	-60	137.3	169.4	-62.7	167	150.6	0	0	110.6
84	F	33.8	Very low	28.7	Very low	193 Å²	193	151.9 Å²	151.9	85%	0.846	84%	0.839	S	S	*	*			trans	-131.3	110.1	157.4	-101.4	-84.8	0	0	0	108.9
85	N	26.9	Very low	28.8	Very low	156 Å²	156	151.6 Å²	151.6	83%	0.834	83%	0.83	S	S	*	*			trans	-72.2	125.4	165	-76.8	-40.3	0	0	0	109.6
86	V	33	Very low	28.9	Very low	141 Å²	141	157 Å²	157	86%	0.855	84%	0.835	S	S	*	*			trans	-135.4	113.3	149.7	-178.5	0	0	0	0	108
87	A	28.1	Very low	28.9	Very low	81 Å²	81	154.2 Å²	154.2	67%	0.669	83%	0.828	S	S	*	*			trans	-82	128.6	174	0	0	0	0	0	110.4
88	N	29.9	Very low	29.1	Very low	165 Å²	165	152.5 Å²	152.5	88%	0.882	82%	0.822	S	S	*	*				171	123.9	123.5	-89.4	-21.1	0	0	0	110.9
89	G	24.9	Very low	29	Very low	75 Å²	75	156 Å²	156	77%	0.773	83%	0.831	S	S	*	*	S	Bend	trans	99.4	86.4	147.4	0	0	0	0	0	117.4
90	V	28.5	Very low	29.1	Very low	130 Å²	130	152.3 Å²	152.3	79%	0.788	83%	0.826	S	S	*	*			trans	139.2	97.8	134.6	175.6	0	0	0	0	109.6	R92	V90-R92 HydrophobicContact CG1-CG 4.34Å; V90-R92 PolarHBondContact O-N 3.27Å
91	E	26.1	Very low	29	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.883	83%	0.834	S	S	*	*			trans	-59.9	118.6	161	-68.5	-171.6	150.1	0	0	109.6
92	R	33.9	Very low	28.9	Very low	233 Å²	233	155.5 Å²	155.5	88%	0.879	82%	0.823	S	S	*	*			trans	-133.3	112.7	147.8	-78.7	-166	174.3	-177.3	-0.3	109.5	V90 G94	V90-R92 HydrophobicContact CG1-CG 4.34Å; V90-R92 PolarHBondContact O-N 3.27Å; R92-G94 PolarHBondContact O-N 3.06Å
93	K	28.1	Very low	28.8	Very low	207 Å²	207	154.2 Å²	154.2	90%	0.9	83%	0.826	S	S	*	*			trans	-58.5	94.5	167	-69.9	-171.9	175.8	-178.8	0	109.7	K95	K93-K95 PolarHBondContact O-N 2.96Å
94	G	31.3	Very low	28.8	Very low	76 Å²	76	152 Å²	152	78%	0.784	82%	0.824	S	S	*	*			trans	-83.9	93.8	165.1	0	0	0	0	0	109.7	R92 Q96	R92-G94 PolarHBondContact O-N 3.06Å; G94-Q96 PolarHBondContact O-N 3.17Å
95	K	29.5	Very low	28.5	Very low	182 Å²	182	148.7 Å²	148.7	79%	0.791	82%	0.82	S	S	*	*			trans	-59.2	130.6	167.3	-74.2	179.5	177.1	179.4	0	108.8	K93 I97	K93-K95 PolarHBondContact O-N 2.96Å; K95-I97 PolarHBondContact O-N 3.18Å
96	Q	27.2	Very low	28.7	Very low	190 Å²	190	152.8 Å²	152.8	89%	0.888	82%	0.824	S	S	*	*			trans	-47.8	121.8	161	-172.5	178.3	7.4	0	0	109.2	G94	G94-Q96 PolarHBondContact O-N 3.17Å
97	I	27.6	Very low	28.7	Very low	154 Å²	154	151.9 Å²	151.9	79%	0.79	82%	0.823	S	S	*	*			trans	-124.5	117.1	168.7	-55.2	177.3	0	0	0	107.8	K95	K95-I97 PolarHBondContact O-N 3.18Å
98	S	29.1	Very low	29	Very low	94 Å²	94	153.9 Å²	153.9	66%	0.657	83%	0.832	S	S	*	*			trans	-57	139.1	175.9	-42.7	0	0	0	0	111.3	S100	S98-S100 PolarHBondContact O-N 2.92Å
99	L	25.8	Very low	29.2	Very low	189 Å²	189	150.7 Å²	150.7	99%	0.99	83%	0.829	S	S	*	*			trans	-66.4	96.4	170.3	-72.4	161	0	0	0	109.5
100	S	28.3	Very low	29.6	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	83%	0.83	S	S	*	*			trans	-114.6	123	163.1	49.8	0	0	0	0	110.6	S98	S98-S100 PolarHBondContact O-N 2.92Å
101	R	28.8	Very low	29.9	Very low	263 Å²	263	155.5 Å²	155.5	99%	0.992	83%	0.833	S	S	*	*			trans	-57.9	124.3	179.6	-167.9	176.8	-172.9	169.8	0.5	111.8
102	G	27.3	Very low	30.3	Very low	60 Å²	60	149.9 Å²	149.9	62%	0.619	83%	0.826	S	S	*	*			trans	125.5	105.1	164.6	0	0	0	0	0	114
103	D	29.8	Very low	30.4	Very low	171 Å²	171	148.3 Å²	148.3	91%	0.914	83%	0.825	S	S	*	*				167.4	92.9	129	-85.2	-15.7	0	0	0	111.1
104	V	27.2	Very low	30.6	Very low	136 Å²	136	144.4 Å²	144.4	82%	0.824	82%	0.819	S	S	*	*			trans	-98.4	111.3	153.6	174.8	0	0	0	0	105.6
105	T	27.6	Very low	30.8	Very low	123 Å²	123	150 Å²	150	76%	0.755	82%	0.824	S	S	*	*			trans	147.1	116.8	140.7	48.6	0	0	0	0	111.5
106	R	30.3	Very low	30.8	Very low	243 Å²	243	147.2 Å²	147.2	92%	0.917	83%	0.828	S	S	*	*				171.1	139	108.1	-95.4	-179.9	165.5	-179.7	-5	111.5
107	S	33.1	Very low	31	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-81.6	152.8	167.6	-49.9	0	0	0	0	110.4
108	S	35.3	Very low	31.2	Very low	123 Å²	123	140.1 Å²	140.1	86%	0.86	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-57.2	151.8	-172.7	34.6	0	0	0	0	116.7
109	A	32.6	Very low	31.3	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-67.9	154.3	-173.7	0	0	0	0	0	115.6
110	D	35	Very low	31.5	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	82%	0.821	S	S	*	*				-160.6	161.6	106.9	-142.8	-5.9	0	0	0	113.3
111	D	34	Very low	31.7	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	83%	0.825	S	S	*	*			trans	-60.6	153.8	-152.2	-77	-39.6	0	0	0	122.9
112	G	35.1	Very low	32	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	80%	0.804	S	S	*	*			trans	136	101.8	135.1	0	0	0	0	0	119.8
113	K	34.7	Very low	32.4	Very low	200 Å²	200	132.4 Å²	132.4	87%	0.87	82%	0.817	S	S	*	*			trans	74.2	106.5	148	-78	179.2	177.4	175.5	0	122.1
114	T	33.6	Very low	32.9	Very low	124 Å²	124	127.5 Å²	127.5	76%	0.761	80%	0.8	S	S	*	*				47.7	106	128.6	56.9	0	0	0	0	119.8
115	Q	35.5	Very low	33.4	Very low	194 Å²	194	125.4 Å²	125.4	91%	0.907	79%	0.785	S	S	*	*				169.2	150.1	104.5	-89.4	-174.1	-5.5	0	0	110.7
116	S	29.1	Very low	34	Very low	124 Å²	124	121.8 Å²	121.8	87%	0.867	77%	0.772	S	S	*	*			trans	-64.7	139.9	-167.6	-27.6	0	0	0	0	115.2
117	A	31.8	Very low	34.8	Very low	91 Å²	91	115 Å²	115	75%	0.752	75%	0.754	S	S	*	*				-176.1	120.6	122.4	0	0	0	0	0	110.2
118	A	30.5	Very low	34.9	Very low	104 Å²	104	112.8 Å²	112.8	86%	0.86	73%	0.732	S	S	*	*			trans	-70.8	124.7	163.2	0	0	0	0	0	109.4
119	S	31.6	Very low	35.3	Very low	100 Å²	100	111.1 Å²	111.1	70%	0.699	72%	0.721	S	S	*	*			trans	-160.5	97.6	149.6	-6.1	0	0	0	0	109.2
120	S	29.9	Very low	35.9	Very low	125 Å²	125	115.6 Å²	115.6	87%	0.874	72%	0.717	S	S	*	*			trans	13.6	107.4	145.2	54.5	0	0	0	0	117.8
121	S	32.4	Very low	36.2	Very low	117 Å²	117	114 Å²	114	82%	0.818	70%	0.703	S	S	*	*			trans	-131.1	125.7	150.4	53.4	0	0	0	0	110.1
122	S	34.7	Very low	36.4	Very low	81 Å²	81	111.2 Å²	111.2	57%	0.566	69%	0.687	S	S	*	*			trans	-64.7	121.1	-174.9	44.2	0	0	0	0	112	A124 D125	S122-A124 PolarHBondContact O-N 3.4Å; S122-D125 WeakPolarHBondContact CB-OD2 3.5Å; S122-D125 PolarHBondContact OG-OD2 2.77Å
123	S	35.7	Very low	36.9	Very low	127 Å²	127	110.3 Å²	110.3	89%	0.888	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	12.8	170.2	55.6	0	0	0	0	113.6
124	A	40.7	Very low	37.2	Very low	68 Å²	68	103 Å²	103	56%	0.562	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-24.2	176.3	0	0	0	0	0	113.5	S122	S122-A124 PolarHBondContact O-N 3.4Å
125	D	37.6	Very low	37.3	Very low	93 Å²	93	101.1 Å²	101.1	50%	0.497	63%	0.629	S	S	.	*	H	α-helix	trans	-81.4	-20.9	-169.7	-65.8	-49.6	0	0	0	114.5	S122 N127	S122-D125 WeakPolarHBondContact CB-OD2 3.5Å; S122-D125 PolarHBondContact OG-OD2 2.77Å; D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 3.2Å
126	G	41	Very low	38	Very low	47 Å²	47	97.4 Å²	97.4	49%	0.485	61%	0.612	S	S	.	*	H	α-helix	trans	-72.8	-12.7	-178.8	0	0	0	0	0	115.4
127	N	46.1	Very low	38.6	Very low	99 Å²	99	99.9 Å²	99.9	53%	0.529	60%	0.602	S	S	.	*	H	α-helix	trans	-100.4	-27.3	-177.9	-138.6	-6.6	0	0	0	112.5	D125 K131	D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 3.2Å; N127-K131 WeakPolarHBondContact O-CG 3.35Å; N127-K131 PolarHBondContact O-N 2.75Å
128	L	36	Very low	39.1	Very low	75 Å²	75	98.6 Å²	98.6	39%	0.393	58%	0.582	S	S	.	*	H	α-helix	trans	-70.3	-43.3	174.2	-77.4	163.2	0	0	0	111.5	R130 K131 L132	L128-R130 VanDerWaalsContact C-N 3.31Å; L128-R130 PolarHBondContact O-N 3.43Å; L128-K131 PolarHBondContact O-N 2.92Å; L128-K131 VanDerWaalsContact O-N 3.17Å; L128-L132 WeakPolarHBondContact O-CB 3.4Å; L128-L132 PolarHBondContact O-N 2.94Å
129	S	43.7	Very low	39.9	Very low	89 Å²	89	102.2 Å²	102.2	62%	0.622	58%	0.578	S	S	*	*	H	α-helix	trans	-60.6	-36.1	178.6	-87	0	0	0	0	113.5	T133	S129-T133 PolarHBondContact O-N 2.95Å; S129-T133 PolarHBondContact O-OG1 3.42Å
130	R	44.4	Very low	40.2	Very low	192 Å²	192	103.5 Å²	103.5	73%	0.725	58%	0.578	S	S	*	*	H	α-helix	trans	-77.9	-25.7	177.5	-82.3	-172	-95.3	-159.8	-6.6	113.9	L128 T133	L128-R130 VanDerWaalsContact C-N 3.31Å; L128-R130 PolarHBondContact O-N 3.43Å; R130-T133 WeakPolarHBondContact CA-OG1 3.33Å; R130-T133 PolarHBondContact O-OG1 3.36Å
131	K	42.5	Very low	40.4	Very low	116 Å²	116	101.5 Å²	101.5	50%	0.504	56%	0.556	S	S	.	*	H	α-helix	trans	-88.7	-35.3	178.4	-73.2	-177	179.5	-174.3	0	112.6	N127 L128 T133 A134 L135	N127-K131 WeakPolarHBondContact O-CG 3.35Å; N127-K131 PolarHBondContact O-N 2.75Å; L128-K131 PolarHBondContact O-N 2.92Å; L128-K131 VanDerWaalsContact O-N 3.17Å; K131-T133 VanDerWaalsContact C-N 3.27Å; K131-T133 PolarHBondContact O-N 3.49Å; K131-A134 WeakPolarHBondContact O-CB 3.48Å; K131-A134 PolarHBondContact O-N 3.19Å; K131-L135 PolarHBondContact O-N 3.28Å; K131-L135 VanDerWaalsContact O-N 3.16Å
132	L	38.6	Very low	40.4	Very low	98 Å²	98	101.3 Å²	101.3	51%	0.513	56%	0.555	S	S	.	*	H	α-helix	trans	-60.5	-37.3	168	-83.4	159.9	0	0	0	111.1	L128 A134 L135 E136	L128-L132 WeakPolarHBondContact O-CB 3.4Å; L128-L132 PolarHBondContact O-N 2.94Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.44Å; L132-L135 PolarHBondContact O-N 3.25Å; L132-E136 WeakPolarHBondContact O-CB 3.43Å; L132-E136 PolarHBondContact O-N 3.45Å
133	T	45.6	Very low	40.2	Very low	53 Å²	53	104.2 Å²	104.2	33%	0.325	56%	0.558	S	S	.	*	H	α-helix	trans	-63.9	-29	172.7	5.6	0	0	0	0	113.2	S129 R130 K131 R137	S129-T133 PolarHBondContact O-N 2.95Å; S129-T133 PolarHBondContact O-OG1 3.42Å; R130-T133 WeakPolarHBondContact CA-OG1 3.33Å; R130-T133 PolarHBondContact O-OG1 3.36Å; K131-T133 VanDerWaalsContact C-N 3.27Å; K131-T133 PolarHBondContact O-N 3.49Å; T133-R137 WeakPolarHBondContact O-CB 3.36Å; T133-R137 VanDerWaalsContact O-CD 3.29Å; T133-R137 WeakPolarHBondContact O-CD 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.39Å; T133-R137 PolarHBondContact O-N 2.91Å
134	A	39.6	Very low	39.9	Very low	45 Å²	45	105.8 Å²	105.8	37%	0.372	56%	0.556	S	S	.	*	H	α-helix	trans	-75.3	-38.4	177.2	0	0	0	0	0	111.8	K131 L132 R137 L138	K131-A134 WeakPolarHBondContact O-CB 3.48Å; K131-A134 PolarHBondContact O-N 3.19Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.44Å; A134-R137 PolarHBondContact O-N 2.8Å; A134-L138 WeakPolarHBondContact O-CG 3.36Å; A134-L138 PolarHBondContact O-N 2.78Å
135	L	37	Very low	39.3	Very low	86 Å²	86	107.8 Å²	107.8	45%	0.45	56%	0.561	S	S	.	*	H	α-helix	trans	-72.3	-37.8	174.6	-75.3	167.4	0	0	0	112.4	K131 L132 L138 K139	K131-L135 PolarHBondContact O-N 3.28Å; K131-L135 VanDerWaalsContact O-N 3.16Å; L132-L135 PolarHBondContact O-N 3.25Å; L135-L138 HydrophobicContact CD2-CD1 4.34Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.31Å; L135-K139 PolarHBondContact O-N 2.91Å
136	E	48.9	Very low	38.9	Very low	116 Å²	116	108.4 Å²	108.4	54%	0.542	57%	0.571	S	S	.	*	H	α-helix	trans	-68	-37	170.5	-79.6	-176.9	141.7	0	0	112.2	L132 L138 K139 N140	L132-E136 WeakPolarHBondContact O-CB 3.43Å; L132-E136 PolarHBondContact O-N 3.45Å; E136-L138 VanDerWaalsContact C-N 3.27Å; E136-L138 PolarHBondContact O-N 3.39Å; E136-K139 WeakPolarHBondContact O-CB 3.41Å; E136-K139 PolarHBondContact O-N 3.12Å; E136-K139 VanDerWaalsContact O-N 3.14Å; E136-N140 PolarHBondContact O-N 2.98Å
137	R	42.3	Very low	38.4	Very low	175 Å²	175	115.1 Å²	115.1	66%	0.66	59%	0.59	S	S	*	*	H	α-helix	trans	-64.7	-31.7	171.6	-78	169.7	-176	-164.8	1	112.2	T133 A134 N140 L141	T133-R137 WeakPolarHBondContact O-CB 3.36Å; T133-R137 VanDerWaalsContact O-CD 3.29Å; T133-R137 WeakPolarHBondContact O-CD 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.39Å; T133-R137 PolarHBondContact O-N 2.91Å; A134-R137 PolarHBondContact O-N 2.8Å; R137-N140 PolarHBondContact O-N 3.43Å; R137-L141 WeakPolarHBondContact O-CG 3.33Å; R137-L141 PolarHBondContact O-N 3Å; R137-L141 VanDerWaalsContact O-N 3.15Å
138	L	43.6	Very low	37.5	Very low	64 Å²	64	114.6 Å²	114.6	34%	0.335	59%	0.59	S	S	.	*	H	α-helix	trans	-69.1	-36	170.7	-81.6	161.5	0	0	0	112.6	A134 L135 E136 N140 L141 A312	A134-L138 WeakPolarHBondContact O-CG 3.36Å; A134-L138 PolarHBondContact O-N 2.78Å; L135-L138 HydrophobicContact CD2-CD1 4.34Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.31Å; E136-L138 VanDerWaalsContact C-N 3.27Å; E136-L138 PolarHBondContact O-N 3.39Å; L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 3.14Å; L138-L141 HydrophobicContact CD2-CD1 4.02Å; L138-L141 PolarHBondContact O-N 3.18Å; L138-A312 HydrophobicContact CD2-CB 3.77Å
139	K	45.9	Very low	37.2	Very low	180 Å²	180	121.9 Å²	121.9	78%	0.783	61%	0.612	S	S	*	*	H	α-helix	trans	-67.4	-30.3	174.7	-160.3	178.4	179.9	-177.6	0	112.5	L135 E136	L135-K139 PolarHBondContact O-N 2.91Å; E136-K139 WeakPolarHBondContact O-CB 3.41Å; E136-K139 PolarHBondContact O-N 3.12Å; E136-K139 VanDerWaalsContact O-N 3.14Å
140	N	39	Very low	36.5	Very low	128 Å²	128	122.2 Å²	122.2	68%	0.684	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	4.4	177.7	-69.4	-16	0	0	0	114.4	E136 R137 L138 S142	E136-N140 PolarHBondContact O-N 2.98Å; R137-N140 PolarHBondContact O-N 3.43Å; L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 3.14Å; N140-S142 PolarHBondContact O-N 3.39Å
141	L	34.4	Very low	35.6	Very low	82 Å²	82	121.3 Å²	121.3	43%	0.429	61%	0.61	S	S	.	*			trans	-76.6	76.4	169.2	-84	166.3	0	0	0	109.5	R137 L138 F143	R137-L141 WeakPolarHBondContact O-CG 3.33Å; R137-L141 PolarHBondContact O-N 3Å; R137-L141 VanDerWaalsContact O-N 3.15Å; L138-L141 HydrophobicContact CD2-CD1 4.02Å; L138-L141 PolarHBondContact O-N 3.18Å; L141-F143 VanDerWaalsContact C-N 3.33Å; L141-F143 HydrophobicContact CB-CD2 4.25Å; L141-F143 HydrophobicContact CB-CE2 3.98Å; L141-F143 HydrophobicContact CD1-CE2 4.21Å; L141-F143 HydrophobicContact CD2-CD2 4.46Å; L141-F143 HydrophobicContact CD2-CE2 3.69Å; L141-F143 HydrophobicContact CD2-CZ 3.79Å; L141-F143 HydrophobicContact CG-CE2 4.17Å; L141-F143 PolarHBondContact O-N 3.2Å; L141-F143 VanDerWaalsContact O-N 3.15Å
142	S	31.5	Very low	35.1	Very low	113 Å²	113	120.2 Å²	120.2	79%	0.79	62%	0.617	S	S	*	*			trans	-72.6	93.8	155.9	58.4	0	0	0	0	107.3	N140	N140-S142 PolarHBondContact O-N 3.39Å
143	F	31.1	Very low	34.7	Very low	143 Å²	143	123.6 Å²	123.6	63%	0.627	64%	0.635	S	S	*	*			trans	-71.2	130.3	157.8	-74.4	-82.2	0	0	0	106.5	L141 T145	L141-F143 VanDerWaalsContact C-N 3.33Å; L141-F143 HydrophobicContact CB-CD2 4.25Å; L141-F143 HydrophobicContact CB-CE2 3.98Å; L141-F143 HydrophobicContact CD1-CE2 4.21Å; L141-F143 HydrophobicContact CD2-CD2 4.46Å; L141-F143 HydrophobicContact CD2-CE2 3.69Å; L141-F143 HydrophobicContact CD2-CZ 3.79Å; L141-F143 HydrophobicContact CG-CE2 4.17Å; L141-F143 PolarHBondContact O-N 3.2Å; L141-F143 VanDerWaalsContact O-N 3.15Å; F143-T145 VanDerWaalsContact C-N 3.27Å; F143-T145 PolarHBondContact O-N 3.04Å
144	D	28.6	Very low	33.9	Very low	160 Å²	160	126.2 Å²	126.2	86%	0.856	65%	0.65	S	S	*	*			trans	-46.7	101.3	166.8	-80.9	-35.6	0	0	0	106.9	P146	D144-P146 VanDerWaalsContact O-CD 3.27Å; D144-P146 WeakPolarHBondContact O-CD 3.38Å
145	T	29.1	Very low	33.6	Very low	109 Å²	109	129.3 Å²	129.3	67%	0.669	67%	0.67	S	S	*	*			trans	-54.6	119	163	20	0	0	0	0	102.9	F143 Q147	F143-T145 VanDerWaalsContact C-N 3.27Å; F143-T145 PolarHBondContact O-N 3.04Å; T145-Q147 VanDerWaalsContact C-N 3.3Å; T145-Q147 PolarHBondContact O-N 2.85Å
146	P	27.9	Very low	33.3	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	68%	0.683	S	S	*	*			trans	-55.5	110.7	171.4	21.8	-29.6	0	0	0	104.5	D144 V148	D144-P146 VanDerWaalsContact O-CD 3.27Å; D144-P146 WeakPolarHBondContact O-CD 3.38Å; P146-V148 HydrophobicContact CB-CG2 4.1Å; P146-V148 HydrophobicContact CG-CG2 4.42Å; P146-V148 PolarHBondContact O-N 3.13Å
147	Q	30.4	Very low	32.5	Very low	188 Å²	188	135.9 Å²	135.9	88%	0.879	70%	0.695	S	S	*	*			trans	-65.2	80.2	168.4	-80.9	-168.9	-3.8	0	0	104.5	T145 R149	T145-Q147 VanDerWaalsContact C-N 3.3Å; T145-Q147 PolarHBondContact O-N 2.85Å; Q147-R149 PolarHBondContact O-N 3Å
148	V	28.4	Very low	31.9	Very low	88 Å²	88	133.7 Å²	133.7	53%	0.533	70%	0.703	S	S	.	*			trans	-72.5	85.8	166.3	-174.8	0	0	0	0	103.2	P146 L150	P146-V148 HydrophobicContact CB-CG2 4.1Å; P146-V148 HydrophobicContact CG-CG2 4.42Å; P146-V148 PolarHBondContact O-N 3.13Å; V148-L150 PolarHBondContact O-N 3.47Å
149	R	28.8	Very low	31.3	Very low	228 Å²	228	138.5 Å²	138.5	86%	0.86	72%	0.724	S	S	*	*			trans	-55.1	97.6	166.6	-168.6	174.3	179.4	130.7	-2.2	104.8	Q147 Q151	Q147-R149 PolarHBondContact O-N 3Å; R149-Q151 VanDerWaalsContact C-N 3.28Å; R149-Q151 PolarHBondContact O-N 3.44Å
150	L	29.2	Very low	30.6	Very low	95 Å²	95	139.7 Å²	139.7	50%	0.497	73%	0.73	S	S	.	*			trans	-59.8	100.6	172.9	-75.2	165.3	0	0	0	104.9	V148 S152	V148-L150 PolarHBondContact O-N 3.47Å; L150-S152 PolarHBondContact O-N 3.45Å; L150-S152 VanDerWaalsContact O-N 3.08Å
151	Q	26.4	Very low	30.1	Very low	174 Å²	174	139 Å²	139	81%	0.813	73%	0.732	S	S	*	*			trans	-59.2	117.3	167.8	-81	-174.9	-4.2	0	0	105.6	R149 L153	R149-Q151 VanDerWaalsContact C-N 3.28Å; R149-Q151 PolarHBondContact O-N 3.44Å; Q151-L153 PolarHBondContact O-N 2.91Å
152	S	30.4	Very low	29.8	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	75%	0.749	S	S	*	*			trans	-50.3	114	170.9	177	0	0	0	0	108.1	L150 V154	L150-S152 PolarHBondContact O-N 3.45Å; L150-S152 VanDerWaalsContact O-N 3.08Å; S152-V154 PolarHBondContact O-N 3.25Å; S152-V154 WeakPolarHBondContact OG-CB 3.48Å; S152-V154 VanDerWaalsContact OG-CG2 3.26Å; S152-V154 WeakPolarHBondContact OG-CG2 3.48Å; S152-V154 PolarHBondContact OG-N 3.16Å
153	L	31.3	Very low	29.8	Very low	169 Å²	169	146.3 Å²	146.3	89%	0.885	75%	0.753	S	S	*	*			trans	-82.1	22.4	169.7	-74.4	169	0	0	0	111	Q151 S155	Q151-L153 PolarHBondContact O-N 2.91Å; L153-S155 PolarHBondContact O-N 3.44Å
154	V	28.2	Very low	29.6	Very low	108 Å²	108	145.7 Å²	145.7	66%	0.655	76%	0.761	S	S	*	*			trans	-65	96.2	152.7	-176.1	0	0	0	0	104.7	S152 E156	S152-V154 PolarHBondContact O-N 3.25Å; S152-V154 WeakPolarHBondContact OG-CB 3.48Å; S152-V154 VanDerWaalsContact OG-CG2 3.26Å; S152-V154 WeakPolarHBondContact OG-CG2 3.48Å; S152-V154 PolarHBondContact OG-N 3.16Å; V154-E156 PolarHBondContact O-N 2.95Å
155	S	33.4	Very low	29.7	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	75%	0.754	S	S	*	*			trans	-49.8	99.8	162.4	180	0	0	0	0	106.4	L153 K157	L153-S155 PolarHBondContact O-N 3.44Å; S155-K157 PolarHBondContact O-N 3.23Å
156	E	29.8	Very low	29.7	Very low	155 Å²	155	143.5 Å²	143.5	72%	0.724	76%	0.755	S	S	*	*			trans	-50.3	127.8	162.6	-74.1	-177.3	156	0	0	106.1	V154	V154-E156 PolarHBondContact O-N 2.95Å
157	K	32.2	Very low	29.8	Very low	184 Å²	184	147.4 Å²	147.4	80%	0.8	76%	0.764	S	S	*	*			trans	-41.9	145.5	164.1	-74.3	172.8	175.2	172.5	0	108.3	S155 Q159	S155-K157 PolarHBondContact O-N 3.23Å; K157-Q159 PolarHBondContact O-N 2.91Å
158	P	30.6	Very low	29.9	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	76%	0.761	S	S	*	*			trans	-62.7	96.6	-173.6	27.3	-33.8	0	0	0	109.9	K160	P158-K160 PolarHBondContact O-N 3.3Å
159	Q	31	Very low	30.3	Very low	166 Å²	166	145.7 Å²	145.7	78%	0.776	77%	0.768	S	S	*	*			trans	-74.3	105.8	161.6	-86.3	-173.7	-9.3	0	0	106	K157 P161	K157-Q159 PolarHBondContact O-N 2.91Å; Q159-P161 VanDerWaalsContact O-CD 3.23Å; Q159-P161 WeakPolarHBondContact O-CD 3.39Å
160	K	30.4	Very low	30.4	Very low	205 Å²	205	140.5 Å²	140.5	89%	0.891	76%	0.762	S	S	*	*			trans	-65.4	130.6	154.7	-74.5	178.1	174.9	178.3	0	107.6	P158	P158-K160 PolarHBondContact O-N 3.3Å
161	P	29.5	Very low	30.4	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	78%	0.778	S	S	*	*			trans	-130.1	106.2	143.1	34.2	-19.8	0	0	0	109	Q159	Q159-P161 VanDerWaalsContact O-CD 3.23Å; Q159-P161 WeakPolarHBondContact O-CD 3.39Å
162	C	27.9	Very low	30.8	Very low	117 Å²	117	137.8 Å²	137.8	79%	0.791	77%	0.77	S	S	*	*			trans	-158.6	112.5	150.5	-115.6	0	0	0	0	112
163	R	30.6	Very low	30.8	Very low	231 Å²	231	140 Å²	140	87%	0.872	78%	0.781	S	S	*	*			trans	78.2	99	148.7	-60.2	-168.5	178	-178.1	-0.8	118.9
164	V	26.7	Very low	30.8	Very low	129 Å²	129	135.7 Å²	135.7	78%	0.782	78%	0.777	S	S	*	*			trans	-50.4	137.6	135.7	-172.6	0	0	0	0	108.9	T166	V164-T166 VanDerWaalsContact CG1-N 3.35Å
165	P	31.1	Very low	30.9	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	79%	0.787	S	S	*	*				-127.7	123.4	101.8	32.5	-20.6	0	0	0	110.2
166	T	29.5	Very low	30.9	Very low	113 Å²	113	141.8 Å²	141.8	69%	0.693	79%	0.788	S	S	*	*				68.2	92.1	100.1	-42.6	0	0	0	0	111.2	V164	V164-T166 VanDerWaalsContact CG1-N 3.35Å
167	E	31.1	Very low	31.3	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	79%	0.789	S	S	*	*				178.8	110.9	122.1	-93.1	177.3	-156.5	0	0	109.5
168	V	30.6	Very low	31.4	Very low	135 Å²	135	138.7 Å²	138.7	82%	0.818	78%	0.784	S	S	*	*			trans	-92	146.4	158.6	-169.2	0	0	0	0	102.6
169	P	37.5	Very low	31.6	Very low	105 Å²	105	141.6 Å²	141.6	68%	0.682	78%	0.784	S	S	*	*				-161.3	167.2	57.6	40.9	-16.4	0	0	0	121.7
170	T	30.3	Very low	31.5	Very low	120 Å²	120	141.9 Å²	141.9	74%	0.736	79%	0.785	S	S	*	*			trans	81.2	120.8	138.9	44.5	0	0	0	0	123.5
171	S	29.6	Very low	31.6	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	78%	0.775	S	S	*	*			trans	72.5	147.6	144	89.3	0	0	0	0	116.4
172	S	34.5	Very low	31.9	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	78%	0.781	S	S	*	*			cis	-162.8	158	12.8	71.8	0	0	0	0	108.2
173	T	30.2	Very low	32.3	Very low	140 Å²	140	141.3 Å²	141.3	86%	0.859	78%	0.784	S	S	*	*			trans	20	128.7	147.2	30.8	0	0	0	0	120.7
174	G	31.7	Very low	32.5	Very low	78 Å²	78	134 Å²	134	80%	0.804	78%	0.78	S	S	*	*			trans	164.2	94.7	151.4	0	0	0	0	0	116.7
175	D	30.3	Very low	32.9	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	79%	0.786	S	S	*	*			trans	-49.4	135.4	150.7	-93.8	-40.7	0	0	0	111.5
176	K	33.5	Very low	33.3	Very low	186 Å²	186	139.8 Å²	139.8	81%	0.809	79%	0.792	S	S	*	*				162.9	114.7	125.6	-87.8	166.9	-175.8	-179.2	0	114
177	L	38.9	Very low	33.7	Very low	142 Å²	142	143.6 Å²	143.6	74%	0.743	80%	0.799	S	S	*	*				59.8	120	125.9	-58	170.4	0	0	0	122.2
178	L	33.9	Very low	33.9	Very low	132 Å²	132	144 Å²	144	69%	0.691	80%	0.801	S	S	*	*				42.9	122	125.6	-52.7	170.7	0	0	0	120.2
179	F	34.5	Very low	34	Very low	190 Å²	190	143.1 Å²	143.1	83%	0.833	80%	0.801	S	S	*	*				170.4	157.4	96.2	-102.1	-76.3	0	0	0	112.8
180	E	30.4	Very low	34	Very low	171 Å²	171	143.6 Å²	143.6	80%	0.799	81%	0.807	S	S	*	*			trans	-83.7	166.2	-171.8	-165.6	172	-165.1	0	0	113.6
181	S	31.7	Very low	34	Very low	97 Å²	97	148.3 Å²	148.3	68%	0.678	81%	0.813	S	S	*	*			trans	95.7	108.5	159.5	-66.4	0	0	0	0	119.4
182	V	35.9	Very low	34.2	Very low	145 Å²	145	153.7 Å²	153.7	88%	0.879	82%	0.815	S	S	*	*			trans	-131.4	101.7	139.6	-178.3	0	0	0	0	109.1
183	H	36.2	Very low	34	Very low	182 Å²	182	160.6 Å²	160.6	84%	0.843	83%	0.827	S	S	*	*			trans	-84.2	121.5	152.5	-95.6	62.8	0	0	0	108.1
184	G	34.9	Very low	33.9	Very low	77 Å²	77	158.8 Å²	158.8	79%	0.794	82%	0.82	S	S	*	*			trans	-117.5	96.2	167.2	0	0	0	0	0	110.4
185	R	35.2	Very low	33.9	Very low	238 Å²	238	161.5 Å²	161.5	90%	0.898	82%	0.816	S	S	*	*			trans	-84.8	137	167.8	-91.2	176.5	149.2	178.6	-5.1	109.6
186	S	38.7	Very low	33.9	Very low	124 Å²	124	160 Å²	160	87%	0.867	81%	0.808	S	S	*	*			trans	-127.4	149.4	148	89.7	0	0	0	0	110.1
187	K	37.3	Very low	34	Very low	193 Å²	193	159.5 Å²	159.5	84%	0.839	81%	0.812	S	S	*	*			trans	-100.5	171.9	-160.1	-67.1	-178.3	174.2	179.4	0	112.7
188	Q	36.9	Very low	33.5	Very low	197 Å²	197	161.6 Å²	161.6	92%	0.921	82%	0.818	S	S	*	*			trans	99.3	126	168	-58	179	-9.9	0	0	113.3
189	S	32.5	Very low	33.5	Very low	117 Å²	117	166.3 Å²	166.3	82%	0.818	83%	0.827	S	S	*	*			cis	-157.9	168.2	11.2	69.3	0	0	0	0	110.2
190	S	36.7	Very low	33.6	Very low	114 Å²	114	161.6 Å²	161.6	80%	0.797	82%	0.817	S	S	*	*			trans	-117.8	107.8	168	56.8	0	0	0	0	111
191	Y	31.4	Very low	33.7	Very low	220 Å²	220	161 Å²	161	86%	0.863	82%	0.818	S	S	*	*			trans	-150.3	141.6	163.6	-143.1	-97.5	0	0	0	111.5
192	R	32.2	Very low	33.9	Very low	230 Å²	230	164 Å²	164	87%	0.868	82%	0.822	S	S	*	*			trans	-51.4	136.9	-176.6	-72.7	175.4	164.6	174.3	-4.8	114.4
193	R	31.8	Very low	33.8	Very low	238 Å²	238	165 Å²	165	90%	0.898	82%	0.822	S	S	*	*			trans	-157.4	114.5	135.1	-108.6	176.6	-176.7	177.5	0.2	110.1
194	S	28.4	Very low	33.6	Very low	102 Å²	102	158.9 Å²	158.9	71%	0.713	80%	0.803	S	S	*	*			trans	-48.8	129.3	149.3	46.1	0	0	0	0	109.7
195	D	31.2	Very low	33.6	Very low	136 Å²	136	166.3 Å²	166.3	73%	0.727	81%	0.807	S	S	*	*			trans	180	114.2	140.4	-87.9	-30.4	0	0	0	110.8
196	N	29.5	Very low	33.6	Very low	129 Å²	129	166.8 Å²	166.8	69%	0.69	81%	0.809	S	S	*	*			trans	56.6	93.9	138.5	-60.4	-38.6	0	0	0	120.8
197	I	35.8	Very low	33.4	Very low	175 Å²	175	169.1 Å²	169.1	90%	0.897	80%	0.799	S	S	*	*				-136.7	64	123.4	-48.3	179.4	0	0	0	109.1
198	H	29.5	Very low	33.1	Very low	187 Å²	187	167.3 Å²	167.3	87%	0.866	80%	0.799	S	S	*	*			trans	-114.1	101.4	149.3	-88.2	-76.6	0	0	0	106.5
199	R	32.9	Very low	32.7	Very low	230 Å²	230	164.5 Å²	164.5	87%	0.868	79%	0.79	S	S	*	*			trans	-144.7	97.7	161.1	-110.5	-176.1	175.9	165.7	-0.5	106
200	S	36.8	Very low	32.7	Very low	91 Å²	91	165.1 Å²	165.1	64%	0.636	78%	0.782	S	S	*	*				83.6	101.1	91.6	68.8	0	0	0	0	109.7
201	L	32.1	Very low	32.5	Very low	158 Å²	158	167.8 Å²	167.8	83%	0.827	78%	0.782	S	S	*	*				36.7	111.3	85.8	-88.1	158.5	0	0	0	110.9
202	Q	36.8	Very low	32.2	Very low	160 Å²	160	161.9 Å²	161.9	75%	0.748	77%	0.773	S	S	*	*			trans	95.7	74.5	179.5	-54.6	-177.3	1.3	0	0	115.6
203	D	32.5	Very low	32.1	Very low	167 Å²	167	156.9 Å²	156.9	89%	0.893	77%	0.768	S	S	*	*			trans	-106.1	75.6	130.1	-136.7	-15.9	0	0	0	107.6	R205	D203-R205 PolarHBondContact O-N 3.28Å
204	A	33.6	Very low	31.9	Very low	53 Å²	53	153.1 Å²	153.1	44%	0.438	77%	0.765	S	S	.	*			trans	-87.1	86.5	166.5	0	0	0	0	0	107.7
205	R	33.9	Very low	31.9	Very low	233 Å²	233	153.1 Å²	153.1	88%	0.879	77%	0.765	S	S	*	*	S	Bend	trans	-131.1	66.1	139.7	-70.5	-165.6	-165.6	-162.4	5.2	108.6	D203	D203-R205 PolarHBondContact O-N 3.28Å
206	R	35.5	Very low	31.9	Very low	248 Å²	248	151.5 Å²	151.5	94%	0.936	76%	0.764	S	S	*	*	S	Bend	trans	171.9	68.4	146.1	-93.6	172.1	-175.6	-164.2	2.2	108.7
207	R	33.7	Very low	32.1	Very low	174 Å²	174	152.3 Å²	152.3	66%	0.657	77%	0.768	S	S	*	*			trans	-92.8	143.8	143.8	-72.9	-176.8	-177.3	167.5	-0.9	104.8
208	D	31.5	Very low	31.9	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	76%	0.759	S	S	*	*				-137.3	143.9	50.6	-70.2	-52.6	0	0	0	114
209	D	29.3	Very low	32.1	Very low	137 Å²	137	151 Å²	151	73%	0.733	76%	0.762	S	S	*	*			trans	-66.7	167.1	165.1	-81.1	-51.6	0	0	0	112.4
210	I	31	Very low	32	Very low	130 Å²	130	144.9 Å²	144.9	67%	0.667	76%	0.755	S	S	*	*			trans	74.1	108.6	159.8	-36.6	111.2	0	0	0	115.9
211	H	32.9	Very low	32	Very low	171 Å²	171	145.7 Å²	145.7	79%	0.792	76%	0.76	S	S	*	*				172.5	117	106.4	-86.5	-70.3	0	0	0	110.7
212	S	25	Very low	32.1	Very low	96 Å²	96	143.3 Å²	143.3	67%	0.671	76%	0.756	S	S	*	*			trans	-54.4	155.5	158.4	50.2	0	0	0	0	112.2
213	T	30.1	Very low	31.8	Very low	124 Å²	124	148 Å²	148	76%	0.761	77%	0.767	S	S	*	*			trans	99.9	106.6	160.1	71.1	0	0	0	0	117.3
214	L	28.8	Very low	32.1	Very low	159 Å²	159	145.8 Å²	145.8	83%	0.832	76%	0.764	S	S	*	*				40.2	135.6	126.5	-65.3	166.4	0	0	0	120
215	S	28.5	Very low	32.1	Very low	103 Å²	103	147.1 Å²	147.1	72%	0.72	78%	0.783	S	S	*	*			trans	88	109.6	148.3	16.7	0	0	0	0	119.6
216	S	31	Very low	32.1	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	78%	0.775	S	S	*	*				85.3	122.1	122.6	64.6	0	0	0	0	121.5
217	L	33	Very low	31.8	Very low	146 Å²	146	136 Å²	136	76%	0.764	77%	0.769	S	S	*	*			trans	83.1	111.9	133.8	-95.7	92.1	0	0	0	120.7
218	D	31.3	Very low	31.8	Very low	132 Å²	132	139 Å²	139	71%	0.706	78%	0.781	S	S	*	*				53.3	109.8	121.7	-63.5	-18.5	0	0	0	119.7
219	H	33.6	Very low	31.8	Very low	201 Å²	201	141.8 Å²	141.8	93%	0.931	78%	0.781	S	S	*	*			trans	-114	117.9	141.6	-80.1	-56.7	0	0	0	110.2
220	S	30.9	Very low	31.9	Very low	103 Å²	103	142.7 Å²	142.7	72%	0.72	79%	0.786	S	S	*	*			trans	-90.4	165.3	172.3	54.2	0	0	0	0	111.4
221	S	36.1	Very low	32.2	Very low	107 Å²	107	146 Å²	146	75%	0.748	80%	0.799	S	S	*	*			trans	86.1	141	152.3	93.8	0	0	0	0	115.7
222	C	34.8	Very low	32.1	Very low	109 Å²	109	142.4 Å²	142.4	74%	0.736	80%	0.798	S	S	*	*			cis	-150.1	141.7	21.5	-80.1	0	0	0	0	110.9
223	R	30.5	Very low	32.5	Very low	259 Å²	259	144.9 Å²	144.9	98%	0.977	81%	0.81	S	S	*	*				-152.7	133.9	125.5	-119.4	179	171.6	-173.3	-3	109.6
224	S	38.5	Very low	32.5	Very low	120 Å²	120	143.6 Å²	143.6	84%	0.839	81%	0.806	S	S	*	*			trans	-113.3	156.9	-150.7	43.6	0	0	0	0	113
225	G	34.8	Very low	32.6	Very low	80 Å²	80	146 Å²	146	83%	0.825	81%	0.806	S	S	*	*			trans	144.6	107.3	164.8	0	0	0	0	0	108.8
226	G	32.3	Very low	32.8	Very low	69 Å²	69	146 Å²	146	71%	0.711	80%	0.801	S	S	*	*			cis	114	99.9	24.2	0	0	0	0	0	108.1
227	H	30.9	Very low	32.9	Very low	178 Å²	178	150.4 Å²	150.4	82%	0.824	81%	0.807	S	S	*	*			trans	173	124	136.9	-98.5	-65.5	0	0	0	111.7
228	R	32.9	Very low	32.7	Very low	237 Å²	237	155 Å²	155	89%	0.894	81%	0.814	S	S	*	*			trans	-91.4	144.2	158.5	-71.4	-178.5	174.4	-176.8	-2.2	108.3
229	Y	32.7	Very low	32.6	Very low	214 Å²	214	152.7 Å²	152.7	84%	0.839	81%	0.809	S	S	*	*			trans	-150.5	122.7	151	-94.6	-76.9	0	0	0	109.4
230	D	31.3	Very low	32.3	Very low	156 Å²	156	151.7 Å²	151.7	83%	0.834	80%	0.804	S	S	*	*			trans	-82.2	131	154.3	-74.6	-49.7	0	0	0	108.1
231	Q	36.4	Very low	32.2	Very low	201 Å²	201	152.6 Å²	152.6	94%	0.939	81%	0.811	S	S	*	*			trans	-179.9	138.9	138.3	-108.3	-179.1	3.2	0	0	112
232	A	30.2	Very low	32	Very low	94 Å²	94	153.5 Å²	153.5	78%	0.777	81%	0.812	S	S	*	*			trans	-77.3	146.9	175.8	0	0	0	0	0	112.7
233	T	33.5	Very low	31.6	Very low	149 Å²	149	154.8 Å²	154.8	91%	0.914	82%	0.816	S	S	*	*			trans	-152.6	140.1	144.2	43.3	0	0	0	0	111.8
234	S	31	Very low	31.4	Very low	97 Å²	97	151.5 Å²	151.5	68%	0.678	81%	0.812	S	S	*	*			trans	-104.9	171.2	-179.4	44.2	0	0	0	0	111.5
235	Y	29.9	Very low	31	Very low	210 Å²	210	155.4 Å²	155.4	82%	0.824	82%	0.817	S	S	*	*			trans	75.9	133.7	168.6	-73.6	-85.9	0	0	0	116.5
236	T	34	Very low	30.7	Very low	103 Å²	103	162.1 Å²	162.1	63%	0.632	82%	0.817	S	S	*	*			cis	-168.1	150.7	31.8	3.9	0	0	0	0	111.9
237	K	31.8	Very low	30.5	Very low	193 Å²	193	167 Å²	167	84%	0.839	83%	0.827	S	S	*	*			trans	67.2	134.1	147.1	-65.6	168.8	-179.3	176.8	0	117.8
238	R	29.2	Very low	30.5	Very low	242 Å²	242	166.4 Å²	166.4	91%	0.913	83%	0.829	S	S	*	*			cis	-159.8	159.3	23.6	-139.3	176.7	-166.6	-176.3	2.9	110.4
239	S	29.2	Very low	30.3	Very low	84 Å²	84	166 Å²	166	59%	0.587	83%	0.827	S	S	*	*			trans	-80.8	157.5	-171.8	40.9	0	0	0	0	116
240	H	27.1	Very low	29.9	Very low	180 Å²	180	160.8 Å²	160.8	83%	0.833	82%	0.822	S	S	*	*			trans	138.5	92.3	136	-70.3	-64	0	0	0	113.3
241	S	30	Very low	29.5	Very low	123 Å²	123	163.7 Å²	163.7	86%	0.86	82%	0.822	S	S	*	*			trans	-152.6	135.8	132.2	71.4	0	0	0	0	109.6
242	T	30	Very low	28.9	Very low	126 Å²	126	159 Å²	159	77%	0.773	81%	0.812	S	S	*	*			trans	-89.8	129.5	-175.6	41.7	0	0	0	0	109.8
243	T	26.5	Very low	28.6	Very low	135 Å²	135	157.7 Å²	157.7	83%	0.828	81%	0.808	S	S	*	*	S	Bend	trans	56.3	66.8	154.3	46.4	0	0	0	0	117.8
244	E	26.9	Very low	28.1	Very low	190 Å²	190	161.2 Å²	161.2	89%	0.888	81%	0.806	S	S	*	*			trans	-139.6	104.7	142	-78.2	-168.3	158.8	0	0	107.7	R246	E244-R246 PolarHBondContact O-N 2.65Å
245	Q	30.2	Very low	27.8	Very low	202 Å²	202	162.8 Å²	162.8	94%	0.944	82%	0.815	S	S	*	*			trans	-76.7	91.1	177.8	-84.9	-172.1	-18.9	0	0	110.5
246	R	29.2	Very low	27.6	Very low	221 Å²	221	160.4 Å²	160.4	83%	0.834	82%	0.816	S	S	*	*			trans	42.9	100.3	132.9	-73	-179.1	171.5	170.1	-2.8	117.8	E244	E244-R246 PolarHBondContact O-N 2.65Å
247	L	26.8	Very low	27.4	Very low	173 Å²	173	161 Å²	161	91%	0.906	82%	0.821	S	S	*	*				-60	121.1	129.1	-73.8	162.6	0	0	0	109.1
248	L	31.9	Very low	27.2	Very low	165 Å²	165	163.5 Å²	163.5	86%	0.864	83%	0.826	S	S	*	*			trans	-153.9	137.8	146.9	-131.7	107.3	0	0	0	112.9
249	R	28.1	Very low	27	Very low	229 Å²	229	157 Å²	157	86%	0.864	82%	0.817	S	S	*	*			trans	-52	150.8	179.8	-74.9	164.6	159.3	177.2	-6.4	115.9
250	S	24.5	Very low	26.8	Very low	103 Å²	103	160.6 Å²	160.6	72%	0.72	83%	0.83	S	S	*	*			trans	88.7	115.6	130.8	56.8	0	0	0	0	122.3
251	Y	22.6	Very low	26.8	Very low	217 Å²	217	156.9 Å²	156.9	85%	0.851	83%	0.83	S	S	*	*				110	119.1	120.5	-106.6	-103.2	0	0	0	121.1
252	S	24.6	Very low	26.4	Very low	104 Å²	104	157.2 Å²	157.2	73%	0.727	83%	0.827	S	S	*	*			trans	45.4	124	142.1	72.2	0	0	0	0	122.7
253	G	23.9	Very low	26.1	Very low	66 Å²	66	156.4 Å²	156.4	68%	0.68	83%	0.825	S	S	*	*				108.1	102.3	120.6	0	0	0	0	0	118
254	Y	22.3	Very low	26	Very low	223 Å²	223	154.8 Å²	154.8	88%	0.875	82%	0.819	S	S	*	*			trans	55.5	109.8	147	-77.3	-91.3	0	0	0	120.4
255	C	25.1	Very low	26	Very low	130 Å²	130	153.8 Å²	153.8	88%	0.878	82%	0.815	S	S	*	*			trans	-142.8	107.2	137.2	-86.5	0	0	0	0	108.8
256	L	26.4	Very low	26	Very low	159 Å²	159	150.8 Å²	150.8	83%	0.832	81%	0.81	S	S	*	*			trans	-91	135.4	143.6	-80.1	168	0	0	0	105.6
257	P	28.7	Very low	26	Very low	115 Å²	115	146.6 Å²	146.6	75%	0.747	80%	0.804	S	S	*	*				-147.6	135.3	104.1	34.2	-17.2	0	0	0	114
258	R	28.1	Very low	26.2	Very low	247 Å²	247	143.3 Å²	143.3	93%	0.932	78%	0.783	S	S	*	*			trans	-159.1	117.2	132.3	-108.6	175.3	177.1	-166.9	-2	109.6
259	S	25.8	Very low	26.2	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	78%	0.783	S	S	*	*			trans	-75	141.7	171.1	47.6	0	0	0	0	110.1
260	N	24.3	Very low	26.7	Very low	160 Å²	160	134.6 Å²	134.6	86%	0.856	76%	0.763	S	S	*	*			trans	101.1	51.7	173.4	-50	-12.7	0	0	0	116.7
261	A	26.2	Very low	27.1	Very low	102 Å²	102	132.9 Å²	132.9	84%	0.843	74%	0.743	S	S	*	*			trans	-120.9	98.4	153	0	0	0	0	0	108.8
262	T	22.4	Very low	27.5	Very low	130 Å²	130	129.2 Å²	129.2	80%	0.798	73%	0.733	S	S	*	*			trans	-124.9	143.3	163.9	40.3	0	0	0	0	108.7
263	C	23.1	Very low	28	Very low	109 Å²	109	130.5 Å²	130.5	74%	0.736	74%	0.739	S	S	*	*			trans	89.4	135.3	179	-63.2	0	0	0	0	114.5
264	S	24.7	Very low	28.5	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	74%	0.735	S	S	*	*			cis	175.7	118	-8.7	44.2	0	0	0	0	104.6
265	E	27.8	Very low	29.1	Very low	170 Å²	170	121.8 Å²	121.8	79%	0.794	70%	0.702	S	S	*	*			trans	-177.1	149.6	148.5	-106	163.8	-174.3	0	0	106.5	D267	E265-D267 PolarHBondContact O-N 3.08Å
266	V	28.6	Very low	29.5	Very low	139 Å²	139	120.9 Å²	120.9	84%	0.842	69%	0.688	S	S	*	*			trans	-74.4	73.3	-172.1	-178	0	0	0	0	108.1
267	D	30.4	Very low	30	Very low	133 Å²	133	118 Å²	118	71%	0.711	67%	0.673	S	S	*	*			trans	-105.8	115.1	-174.1	-79	-26.7	0	0	0	111.7	E265 S269	E265-D267 PolarHBondContact O-N 3.08Å; D267-S269 PolarHBondContact O-N 3.48Å
268	F	31.6	Very low	30.3	Very low	104 Å²	104	115.4 Å²	115.4	46%	0.456	66%	0.657	S	S	.	*			trans	-50.4	110.3	163.4	-71.5	-93	0	0	0	109	I270	F268-I270 HydrophobicContact CB-CD1 4.07Å; F268-I270 HydrophobicContact CB-CG1 4.13Å; F268-I270 HydrophobicContact CD1-CD1 3.98Å; F268-I270 HydrophobicContact CG-CD1 4.47Å; F268-I270 PolarHBondContact O-N 3.39Å
269	S	30.9	Very low	30.9	Very low	125 Å²	125	107.7 Å²	107.7	87%	0.874	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	50.2	175.6	53	0	0	0	0	112.3	D267	D267-S269 PolarHBondContact O-N 3.48Å
270	I	38.3	Very low	32	Very low	85 Å²	85	108.4 Å²	108.4	44%	0.436	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.3	-15.6	-176.9	-55.4	176.3	0	0	0	111.4	F268	F268-I270 HydrophobicContact CB-CD1 4.07Å; F268-I270 HydrophobicContact CB-CG1 4.13Å; F268-I270 HydrophobicContact CD1-CD1 3.98Å; F268-I270 HydrophobicContact CG-CD1 4.47Å; F268-I270 PolarHBondContact O-N 3.39Å
271	F	32.4	Very low	33.1	Very low	67 Å²	67	109 Å²	109	29%	0.294	63%	0.631	S	S	.	*	S	Bend	trans	-115.6	135.1	-172.8	-59.1	-75.1	0	0	0	113	F24 V41 L277	F24-F271 HydrophobicContact CD1-CZ 4.41Å; V41-F271 HydrophobicContact CB-CE2 4.43Å; V41-F271 HydrophobicContact CB-CZ 3.99Å; V41-F271 HydrophobicContact CG1-CE1 4.28Å; V41-F271 HydrophobicContact CG1-CE2 3.78Å; V41-F271 HydrophobicContact CG1-CZ 3.52Å; F271-L277 HydrophobicContact CB-CD2 4.18Å; F271-L277 HydrophobicContact CD1-CD2 3.85Å; F271-L277 HydrophobicContact CD2-CD1 4.3Å; F271-L277 HydrophobicContact CD2-CD2 3.77Å; F271-L277 HydrophobicContact CE1-CD2 4.17Å; F271-L277 HydrophobicContact CE2-CD2 4.1Å; F271-L277 HydrophobicContact CG-CD2 3.64Å; F271-L277 HydrophobicContact CZ-CD2 4.29Å
272	H	33.1	Very low	34.6	Very low	140 Å²	140	108.9 Å²	108.9	65%	0.648	61%	0.613	S	S	*	*			trans	-62.6	138.3	170.7	-162.9	-92	0	0	0	108.5	S274 A275	H272-S274 PolarHBondContact ND1-OG 2.65Å; H272-S274 PolarHBondContact O-N 2.9Å; H272-A275 PolarHBondContact O-N 3.07Å
273	P	34.7	Very low	36.1	Very low	131 Å²	131	103.6 Å²	103.6	85%	0.851	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	0.1	-175.1	21.9	-32.7	0	0	0	115.4
274	S	34.2	Very low	37.8	Very low	85 Å²	85	101.4 Å²	101.4	59%	0.594	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	2.7	176.4	62.9	0	0	0	0	114.1	H272	H272-S274 PolarHBondContact ND1-OG 2.65Å; H272-S274 PolarHBondContact O-N 2.9Å
275	A	35	Very low	39.3	Very low	22 Å²	22	96.8 Å²	96.8	18%	0.182	53%	0.531	C	S	.	.			trans	-87.5	117.5	175.6	0	0	0	0	0	109.8	H272 L277	H272-A275 PolarHBondContact O-N 3.07Å; A275-L277 PolarHBondContact O-N 3.47Å
276	D	33.6	Very low	40.7	Very low	111 Å²	111	92.6 Å²	92.6	59%	0.594	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	105.2	167.1	-80.7	-34.6	0	0	0	107.7	V44 C278	V44-D276 PolarHBondContact N-O 3.36Å; D276-C278 PolarHBondContact O-N 3.43Å
277	L	36.9	Very low	42	Very low	98 Å²	98	88.6 Å²	88.6	51%	0.513	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	111.9	178	-67.5	170.3	0	0	0	109	V41 F271 A275	V41-L277 HydrophobicContact CG1-CD2 3.86Å; F271-L277 HydrophobicContact CB-CD2 4.18Å; F271-L277 HydrophobicContact CD1-CD2 3.85Å; F271-L277 HydrophobicContact CD2-CD1 4.3Å; F271-L277 HydrophobicContact CD2-CD2 3.77Å; F271-L277 HydrophobicContact CE1-CD2 4.17Å; F271-L277 HydrophobicContact CE2-CD2 4.1Å; F271-L277 HydrophobicContact CG-CD2 3.64Å; F271-L277 HydrophobicContact CZ-CD2 4.29Å; A275-L277 PolarHBondContact O-N 3.47Å
278	C	34.9	Very low	43.1	Very low	61 Å²	61	88.6 Å²	88.6	41%	0.412	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-76.9	160.4	171.1	-83	0	0	0	0	111	E42 D276 I280	E42-C278 HydrophobicContact CB-CB 4.41Å; E42-C278 WeakPolarHBondContact O-CB 3.46Å; E42-C278 PolarHBondContact O-N 3.41Å; E42-C278 VanDerWaalsContact O-N 3.11Å; D276-C278 PolarHBondContact O-N 3.43Å; C278-I280 PolarHBondContact O-N 3.25Å
279	A	39.9	Very low	44.1	Very low	85 Å²	85	88 Å²	88	70%	0.702	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-48.1	125.4	-169.6	0	0	0	0	0	113.7	R281	A279-R281 PolarHBondContact O-N 3.43Å
280	I	48.6	Very low	45.1	Very low	119 Å²	119	82.7 Å²	82.7	61%	0.61	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-62.3	118.5	174.6	-58.9	171.5	0	0	0	108.2	C278	C278-I280 PolarHBondContact O-N 3.25Å
281	R	48.5	Very low	45.5	Very low	172 Å²	172	81.6 Å²	81.6	65%	0.649	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	118.4	171.2	-70.5	-173.4	180	-175.9	2.4	109	R40 A279	R40-R281 PolarHBondContact N-O 3.17Å; R40-R281 PolarHBondContact O-N 3.18Å; R40-R281 VanDerWaalsContact O-N 3.14Å; A279-R281 PolarHBondContact O-N 3.43Å
282	E	56.6	Low	46.3	Very low	100 Å²	100	83.1 Å²	83.1	47%	0.467	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.7	177	-171.4	169.2	-145.2	0	0	109.3	T37 I38 R39 V284	T37-E282 HydrophobicContact CG2-CG 3.48Å; T37-E282 VanDerWaalsContact CG2-CG 3.48Å; T37-E282 WeakPolarHBondContact CG2-OE1 3.38Å; I38-E282 CarbonylContact O-C 3.55Å; I38-E282 WeakPolarHBondContact O-CA 3.33Å; R39-E282 HydrophobicContact CG-CG 4.05Å; R39-E282 IonicContact CZ-OE1 2.82Å; R39-E282 VanDerWaalsContact CZ-OE1 3.3Å; R39-E282 IonicContact NE-OE1 2.8Å; R39-E282 PolarHBondContact NE-OE1 3.13Å; R39-E282 IonicContact NH2-OE1 3.66Å; R39-E282 PolarHBondContact NH2-OE1 3.44Å; E282-V284 HydrophobicContact CG-CG2 4.03Å
283	T	54.7	Low	47.2	Very low	18 Å²	18	82.2 Å²	82.2	11%	0.11	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.7	175.1	-32.1	0	0	0	0	108.2	I38 F285	I38-T283 PolarHBondContact N-O 2.81Å; I38-T283 PolarHBondContact O-N 2.97Å; T283-F285 HydrophobicContact CG2-CE2 4.37Å; T283-F285 HydrophobicContact CG2-CZ 4.39Å
284	V	58.6	Low	48	Very low	64 Å²	64	81.5 Å²	81.5	39%	0.388	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	117.5	-173.2	-175.8	0	0	0	0	109.9	R35 T37 E282	R35-V284 HydrophobicContact CB-CG1 4.32Å; R35-V284 HydrophobicContact CG-CG1 4.12Å; T37-V284 HydrophobicContact CG2-CG2 4.22Å; E282-V284 HydrophobicContact CG-CG2 4.03Å
285	F	55.7	Low	48.9	Very low	3 Å²	3	79 Å²	79	1%	0.013	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.7	173.4	-65	-77.3	0	0	0	110.4	R35 I36 I38 T283 F295 D299 L300 C303 L308	R35-F285 CarbonylContact C-O 3.57Å; R35-F285 WeakPolarHBondContact CA-O 3.49Å; I36-F285 HydrophobicContact CB-CB 4.23Å; I36-F285 PolarHBondContact N-O 3.42Å; I36-F285 PolarHBondContact O-N 2.94Å; I38-F285 HydrophobicContact CD1-CD2 4.29Å; I38-F285 HydrophobicContact CD1-CE2 3.73Å; I38-F285 HydrophobicContact CG1-CD2 4.32Å; I38-F285 HydrophobicContact CG1-CE2 4.13Å; T283-F285 HydrophobicContact CG2-CE2 4.37Å; T283-F285 HydrophobicContact CG2-CZ 4.39Å; F285-F295 HydrophobicContact CB-CE1 4.3Å; F285-F295 AromaticContact CD1-CD1 3.5Å; F285-F295 HydrophobicContact CD1-CD1 3.5Å; F285-F295 AromaticContact CD1-CE1 3.44Å; F285-F295 HydrophobicContact CD1-CE1 3.44Å; F285-F295 VanDerWaalsContact CD1-CE1 3.44Å; F285-F295 HydrophobicContact CD1-CG 4.33Å; F285-F295 HydrophobicContact CD1-CZ 4.21Å; F285-F295 AromaticContact CE1-CD1 3.86Å; F285-F295 HydrophobicContact CE1-CD1 3.86Å; F285-F295 HydrophobicContact CE1-CE1 4.22Å; F285-F295 HydrophobicContact CE1-CG 4.32Å; F285-F295 HydrophobicContact CG-CE1 4.34Å; F285-D299 HydrophobicContact CE1-CB 4.5Å; F285-L300 HydrophobicContact CE1-CD2 4.4Å; F285-C303 WeakPolarHBondContact CZ-SG 3.26Å; F285-L308 HydrophobicContact CZ-CD2 4.41Å
286	N	57.1	Low	49.7	Very low	82 Å²	82	82.3 Å²	82.3	44%	0.439	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.9	171.7	-93.7	-27.5	0	0	0	110.9	R35 E288 K289	R35-N286 WeakPolarHBondContact CD-OD1 3.28Å; R35-N286 WeakPolarHBondContact CG-OD1 3.4Å; N286-E288 VanDerWaalsContact C-N 3.3Å; N286-E288 PolarHBondContact O-N 3.2Å; N286-K289 PolarHBondContact O-N 2.94Å
287	W	56	Low	50.5	Low	55 Å²	55	83.7 Å²	83.7	21%	0.208	43%	0.43	C	S	.	.	H	α-helix	trans	-63.5	-33.2	-176.4	-80.1	-5.5	0	0	0	114.4	I29 K31 R34 K289 L290 F314	I29-W287 HydrophobicContact CG2-CZ2 3.96Å; K31-W287 HydrophobicContact CB-CH2 3.55Å; K31-W287 HydrophobicContact CB-CZ2 4.27Å; K31-W287 HydrophobicContact CB-CZ3 4.41Å; K31-W287 HydrophobicContact CG-CH2 3.85Å; K31-W287 HydrophobicContact CG-CZ2 4.2Å; K31-W287 WeakPolarHBondContact O-CH2 3.39Å; K31-W287 VanDerWaalsContact O-CZ3 3.27Å; K31-W287 WeakPolarHBondContact O-CZ3 3.39Å; R34-W287 VanDerWaalsContact CA-CD2 3.44Å; R34-W287 HydrophobicContact CB-CB 4.03Å; R34-W287 HydrophobicContact CB-CD2 3.98Å; R34-W287 HydrophobicContact CB-CE3 3.46Å; R34-W287 VanDerWaalsContact CB-CE3 3.46Å; R34-W287 HydrophobicContact CB-CG 4.24Å; R34-W287 HydrophobicContact CB-CZ3 4.18Å; R34-W287 HydrophobicContact CG-CE3 3.63Å; R34-W287 HydrophobicContact CG-CZ3 4.05Å; R34-W287 WeakPolarHBondContact O-CB 3.45Å; R34-W287 PolarHBondContact O-N 3.32Å; W287-K289 PolarHBondContact O-N 2.85Å; W287-L290 HydrophobicContact CB-CD1 4.35Å; W287-L290 HydrophobicContact CG-CD1 4.12Å; W287-L290 WeakPolarHBondContact O-CB 3.27Å; W287-L290 PolarHBondContact O-N 3.42Å; W287-F314 AromaticContact CZ2-CE1 3.87Å; W287-F314 HydrophobicContact CZ2-CE1 3.87Å; W287-F314 HydrophobicContact CZ2-CZ 4.02Å
288	E	53	Low	51.3	Low	134 Å²	134	82.7 Å²	82.7	63%	0.626	43%	0.431	S	S	*	.	H	α-helix	trans	-64.8	-24.1	-178.4	-62	-174.6	168.3	0	0	111.8	R34 N286	R34-E288 IonicContact NH1-OE1 3.09Å; R34-E288 PolarHBondContact NH1-OE1 3.37Å; N286-E288 VanDerWaalsContact C-N 3.3Å; N286-E288 PolarHBondContact O-N 3.2Å
289	K	54.3	Low	52.1	Low	90 Å²	90	82.4 Å²	82.4	39%	0.391	43%	0.426	S	S	.	.	H	α-helix	trans	-86.3	-15.9	174.7	-61.4	-170.5	174.2	-168.8	0	113.6	N286 W287 S291 N292 L293 E294 F295	N286-K289 PolarHBondContact O-N 2.94Å; W287-K289 PolarHBondContact O-N 2.85Å; K289-S291 PolarHBondContact O-N 3.29Å; K289-N292 PolarHBondContact O-N 2.83Å; K289-L293 PolarHBondContact O-N 2.98Å; K289-L293 VanDerWaalsContact O-N 3.13Å; K289-E294 PolarHBondContact O-N 3.09Å; K289-F295 HydrophobicContact CB-CE1 4.28Å
290	L	50.8	Low	52.8	Low	14 Å²	14	80.7 Å²	80.7	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-67.9	-30.1	-177.9	-75.2	165.9	0	0	0	113.3	I36 W287 N292 F295 V311 V315	I36-L290 HydrophobicContact CD1-CD1 3.79Å; I36-L290 HydrophobicContact CG1-CD1 4.41Å; W287-L290 HydrophobicContact CB-CD1 4.35Å; W287-L290 HydrophobicContact CG-CD1 4.12Å; W287-L290 WeakPolarHBondContact O-CB 3.27Å; W287-L290 PolarHBondContact O-N 3.42Å; L290-N292 VanDerWaalsContact C-N 3.34Å; L290-F295 HydrophobicContact CB-CZ 4.16Å; L290-F295 HydrophobicContact CD2-CE1 4.15Å; L290-F295 HydrophobicContact CD2-CE2 3.7Å; L290-F295 HydrophobicContact CD2-CZ 3.17Å; L290-F295 HydrophobicContact CG-CE1 4.47Å; L290-F295 HydrophobicContact CG-CE2 4.45Å; L290-F295 HydrophobicContact CG-CZ 3.62Å; L290-V311 HydrophobicContact CD2-CG1 3.78Å; L290-V315 HydrophobicContact CB-CG2 4.08Å; L290-V315 HydrophobicContact CD1-CG2 3.83Å; L290-V315 HydrophobicContact CD2-CG2 3.78Å; L290-V315 HydrophobicContact CG-CG2 4.13Å
291	S	46.5	Very low	53.1	Low	62 Å²	62	78.7 Å²	78.7	43%	0.434	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-34.5	178.5	54.2	0	0	0	0	112.5	K289 R319	K289-S291 PolarHBondContact O-N 3.29Å; S291-R319 PolarHBondContact O-NH2 2.91Å
292	N	50.4	Low	53.6	Low	100 Å²	100	72.8 Å²	72.8	54%	0.535	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-5.8	-176.7	-61.9	2.6	0	0	0	112.6	K289 L290 E294	K289-N292 PolarHBondContact O-N 2.83Å; L290-N292 VanDerWaalsContact C-N 3.34Å; N292-E294 HydrophobicContact CB-CB 4.39Å; N292-E294 HydrophobicContact CB-CG 3.74Å; N292-E294 VanDerWaalsContact CB-OE1 3.25Å; N292-E294 WeakPolarHBondContact CB-OE1 3.48Å; N292-E294 PolarHBondContact ND2-OE1 3.5Å; N292-E294 PolarHBondContact O-N 2.94Å
293	L	50.7	Low	53.5	Low	121 Å²	121	68.8 Å²	68.8	63%	0.634	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	29.3	-173.2	-66.7	158.8	0	0	0	112.2	K289 F295	K289-L293 PolarHBondContact O-N 2.98Å; K289-L293 VanDerWaalsContact O-N 3.13Å; L293-F295 HydrophobicContact CD2-CE2 4.43Å; L293-F295 PolarHBondContact O-N 2.84Å
294	E	52	Low	53.8	Low	115 Å²	115	70.2 Å²	70.2	54%	0.537	38%	0.381	S	S	.	.			trans	-82.3	71.9	177.5	-72	170.9	-149.7	0	0	109.1	K289 N292	K289-E294 PolarHBondContact O-N 3.09Å; N292-E294 HydrophobicContact CB-CB 4.39Å; N292-E294 HydrophobicContact CB-CG 3.74Å; N292-E294 VanDerWaalsContact CB-OE1 3.25Å; N292-E294 WeakPolarHBondContact CB-OE1 3.48Å; N292-E294 PolarHBondContact ND2-OE1 3.5Å; N292-E294 PolarHBondContact O-N 2.94Å
295	F	53.6	Low	53.7	Low	32 Å²	32	75.9 Å²	75.9	14%	0.14	40%	0.395	C	S	.	.			trans	-103.2	131.6	171.8	-63.7	-65.9	0	0	0	109.9	F285 K289 L290 L293 L300	F285-F295 HydrophobicContact CB-CE1 4.3Å; F285-F295 AromaticContact CD1-CD1 3.5Å; F285-F295 HydrophobicContact CD1-CD1 3.5Å; F285-F295 AromaticContact CD1-CE1 3.44Å; F285-F295 HydrophobicContact CD1-CE1 3.44Å; F285-F295 VanDerWaalsContact CD1-CE1 3.44Å; F285-F295 HydrophobicContact CD1-CG 4.33Å; F285-F295 HydrophobicContact CD1-CZ 4.21Å; F285-F295 AromaticContact CE1-CD1 3.86Å; F285-F295 HydrophobicContact CE1-CD1 3.86Å; F285-F295 HydrophobicContact CE1-CE1 4.22Å; F285-F295 HydrophobicContact CE1-CG 4.32Å; F285-F295 HydrophobicContact CG-CE1 4.34Å; K289-F295 HydrophobicContact CB-CE1 4.28Å; L290-F295 HydrophobicContact CB-CZ 4.16Å; L290-F295 HydrophobicContact CD2-CE1 4.15Å; L290-F295 HydrophobicContact CD2-CE2 3.7Å; L290-F295 HydrophobicContact CD2-CZ 3.17Å; L290-F295 HydrophobicContact CG-CE1 4.47Å; L290-F295 HydrophobicContact CG-CE2 4.45Å; L290-F295 HydrophobicContact CG-CZ 3.62Å; L293-F295 HydrophobicContact CD2-CE2 4.43Å; L293-F295 PolarHBondContact O-N 2.84Å; F295-L300 HydrophobicContact CB-CD1 3.85Å; F295-L300 HydrophobicContact CB-CD2 3.88Å; F295-L300 HydrophobicContact CB-CG 3.66Å; F295-L300 HydrophobicContact CD2-CD2 4.33Å; F295-L300 HydrophobicContact CG-CD2 4.19Å; F295-L300 HydrophobicContact CG-CG 4.5Å
296	D	51.1	Low	53.7	Low	93 Å²	93	78.2 Å²	78.2	50%	0.497	41%	0.41	S	S	.	.			trans	-63.6	138.4	172.5	-64.2	-38.9	0	0	0	108.7	S298 D299 L300	D296-S298 PolarHBondContact O-N 3.33Å; D296-S298 VanDerWaalsContact O-N 3.1Å; D296-D299 WeakPolarHBondContact O-CB 3.48Å; D296-D299 PolarHBondContact O-N 2.87Å; D296-L300 PolarHBondContact O-N 3.03Å
297	E	49.9	Very low	53.7	Low	140 Å²	140	74.3 Å²	74.3	65%	0.654	39%	0.389	S	S	*	.	H	α-helix	trans	-60	-27	-174	-165.8	175.7	-177.8	0	0	112.2	D299 S301	E297-D299 VanDerWaalsContact C-N 3.32Å; E297-D299 PolarHBondContact O-N 2.84Å; E297-S301 VanDerWaalsContact O-CB 3.24Å; E297-S301 WeakPolarHBondContact O-CB 3.36Å; E297-S301 PolarHBondContact O-N 3.48Å; E297-S301 PolarHBondContact O-OG 2.88Å
298	S	54.2	Low	53.9	Low	77 Å²	77	74.3 Å²	74.3	54%	0.538	39%	0.393	S	S	.	.	H	α-helix	trans	-60.3	-37.8	171.5	52.1	0	0	0	0	113.2	D296 S301 A302	D296-S298 PolarHBondContact O-N 3.33Å; D296-S298 VanDerWaalsContact O-N 3.1Å; S298-S301 PolarHBondContact O-OG 3.37Å; S298-S301 VanDerWaalsContact O-OG 3.09Å; S298-A302 PolarHBondContact O-N 3.48Å
299	D	51.6	Low	54	Low	55 Å²	55	71.6 Å²	71.6	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-79.6	-35.9	-175.5	-61.8	-15.7	0	0	0	110.9	F285 D296 E297 C303	F285-D299 HydrophobicContact CE1-CB 4.5Å; D296-D299 WeakPolarHBondContact O-CB 3.48Å; D296-D299 PolarHBondContact O-N 2.87Å; E297-D299 VanDerWaalsContact C-N 3.32Å; E297-D299 PolarHBondContact O-N 2.84Å; D299-C303 PolarHBondContact O-SG 3.38Å; D299-C303 VanDerWaalsContact O-SG 3.35Å
300	L	54.8	Low	54	Low	48 Å²	48	68.8 Å²	68.8	25%	0.251	37%	0.37	S	S	.	.	H	α-helix	trans	-73.6	-38.4	176.2	-67.5	176.3	0	0	0	112.5	F285 F295 D296 A302 C303 L308	F285-L300 HydrophobicContact CE1-CD2 4.4Å; F295-L300 HydrophobicContact CB-CD1 3.85Å; F295-L300 HydrophobicContact CB-CD2 3.88Å; F295-L300 HydrophobicContact CB-CG 3.66Å; F295-L300 HydrophobicContact CD2-CD2 4.33Å; F295-L300 HydrophobicContact CG-CD2 4.19Å; F295-L300 HydrophobicContact CG-CG 4.5Å; D296-L300 PolarHBondContact O-N 3.03Å; L300-A302 PolarHBondContact O-N 3.05Å; L300-C303 PolarHBondContact O-N 3.47Å; L300-C303 VanDerWaalsContact O-N 3.16Å; L300-L308 HydrophobicContact CD2-CD2 3.8Å
301	S	55.7	Low	54.5	Low	77 Å²	77	68.7 Å²	68.7	54%	0.538	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-25.2	-179.8	59.4	0	0	0	0	113	E297 S298 C303	E297-S301 VanDerWaalsContact O-CB 3.24Å; E297-S301 WeakPolarHBondContact O-CB 3.36Å; E297-S301 PolarHBondContact O-N 3.48Å; E297-S301 PolarHBondContact O-OG 2.88Å; S298-S301 PolarHBondContact O-OG 3.37Å; S298-S301 VanDerWaalsContact O-OG 3.09Å; S301-C303 VanDerWaalsContact C-N 3.32Å
302	A	57.8	Low	55	Low	48 Å²	48	66.8 Å²	66.8	40%	0.397	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-21.7	173.4	0	0	0	0	0	113.2	R40 S298 L300	R40-A302 VanDerWaalsContact CZ-O 3.32Å; R40-A302 PolarHBondContact NH1-O 3.46Å; R40-A302 PolarHBondContact NH2-O 2.82Å; S298-A302 PolarHBondContact O-N 3.48Å; L300-A302 PolarHBondContact O-N 3.05Å
303	C	55.4	Low	55.2	Low	16 Å²	16	68.7 Å²	68.7	11%	0.108	36%	0.361	C	S	.	.	S	Bend	trans	-89.3	145.4	-173.3	-69.6	0	0	0	0	113.5	R40 F285 D299 L300 S301 L308	R40-C303 VanDerWaalsContact NH2-C 3.27Å; R40-C303 VanDerWaalsContact NH2-CA 3.27Å; F285-C303 WeakPolarHBondContact CZ-SG 3.26Å; D299-C303 PolarHBondContact O-SG 3.38Å; D299-C303 VanDerWaalsContact O-SG 3.35Å; L300-C303 PolarHBondContact O-N 3.47Å; L300-C303 VanDerWaalsContact O-N 3.16Å; S301-C303 VanDerWaalsContact C-N 3.32Å; C303-L308 HydrophobicContact CB-CD1 4.24Å; C303-L308 HydrophobicContact CB-CD2 3.77Å; C303-L308 HydrophobicContact CB-CG 3.77Å
304	T	61.5	Low	55.5	Low	49 Å²	49	64.2 Å²	64.2	30%	0.301	34%	0.337	S	S	.	.			trans	-79.3	157.3	174.1	59.6	0	0	0	0	108.9	R40 T306 E307 L308	R40-T304 VanDerWaalsContact NH2-CG2 3.28Å; T304-T306 PolarHBondContact O-N 3.01Å; T304-T306 PolarHBondContact OG1-OG1 3.32Å; T304-E307 PolarHBondContact N-OE2 3.02Å; T304-E307 PolarHBondContact O-N 3.06Å; T304-E307 WeakPolarHBondContact OG1-CB 3.46Å; T304-E307 VanDerWaalsContact OG1-CG 3.22Å; T304-E307 WeakPolarHBondContact OG1-CG 3.45Å; T304-E307 PolarHBondContact OG1-N 3.08Å; T304-E307 PolarHBondContact OG1-OE2 3.41Å; T304-L308 PolarHBondContact O-N 3.49Å
305	R	56.5	Low	55.7	Low	183 Å²	183	60 Å²	60	69%	0.691	32%	0.319	S	S	*	.	H	α-helix	trans	-54.7	-42.3	176.6	-179.9	177.4	174.8	158.9	1.9	112.3	L308 E309	R305-L308 PolarHBondContact O-N 3.46Å; R305-E309 IonicContact CZ-OE1 3.96Å; R305-E309 IonicContact NE-OE1 3.3Å; R305-E309 PolarHBondContact NE-OE1 3.26Å; R305-E309 VanDerWaalsContact NE-OE1 3.09Å; R305-E309 IonicContact NH2-OE1 2.88Å; R305-E309 WeakPolarHBondContact O-CG 3.36Å; R305-E309 PolarHBondContact O-N 3.12Å
306	T	54	Low	55.8	Low	52 Å²	52	61.6 Å²	61.6	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-69.5	-36.4	-177.8	47.2	0	0	0	0	112.5	F14 T304 E309 V310	F14-T306 HydrophobicContact CE1-CG2 3.87Å; F14-T306 VanDerWaalsContact CZ-CB 3.46Å; F14-T306 HydrophobicContact CZ-CG2 4.09Å; F14-T306 WeakPolarHBondContact CZ-OG1 3.49Å; T304-T306 PolarHBondContact O-N 3.01Å; T304-T306 PolarHBondContact OG1-OG1 3.32Å; T306-E309 PolarHBondContact O-N 3.46Å; T306-V310 WeakPolarHBondContact O-CG2 3.32Å; T306-V310 PolarHBondContact O-N 2.92Å; T306-V310 VanDerWaalsContact O-N 3.08Å
307	E	59	Low	55.9	Low	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-46	172.5	-80.1	162.5	-177.8	0	0	111.8	S25 V27 I38 R40 T304 E309 V310 V311	S25-E307 VanDerWaalsContact CB-OE1 3.26Å; S25-E307 WeakPolarHBondContact CB-OE1 3.4Å; S25-E307 PolarHBondContact OG-OE1 2.84Å; V27-E307 HydrophobicContact CG2-CG 4.46Å; I38-E307 HydrophobicContact CD1-CB 3.78Å; I38-E307 HydrophobicContact CD1-CG 4.13Å; I38-E307 HydrophobicContact CG2-CG 3.98Å; R40-E307 IonicContact CZ-OE1 3.69Å; R40-E307 IonicContact CZ-OE2 3.35Å; R40-E307 IonicContact NE-OE1 2.63Å; R40-E307 PolarHBondContact NE-OE1 3.35Å; R40-E307 IonicContact NE-OE2 2.89Å; R40-E307 PolarHBondContact NE-OE2 3.44Å; R40-E307 IonicContact NH2-OE1 3.36Å; R40-E307 IonicContact NH2-OE2 3.26Å; R40-E307 PolarHBondContact NH2-OE2 3.49Å; T304-E307 PolarHBondContact N-OE2 3.02Å; T304-E307 PolarHBondContact O-N 3.06Å; T304-E307 WeakPolarHBondContact OG1-CB 3.46Å; T304-E307 VanDerWaalsContact OG1-CG 3.22Å; T304-E307 WeakPolarHBondContact OG1-CG 3.45Å; T304-E307 PolarHBondContact OG1-N 3.08Å; T304-E307 PolarHBondContact OG1-OE2 3.41Å; E307-E309 VanDerWaalsContact C-N 3.32Å; E307-E309 PolarHBondContact O-N 3.02Å; E307-V310 PolarHBondContact O-N 3.03Å; E307-V311 WeakPolarHBondContact O-CG2 3.45Å; E307-V311 PolarHBondContact O-N 2.89Å
308	L	58.5	Low	56.2	Low	55 Å²	55	59.8 Å²	59.8	29%	0.288	32%	0.318	S	S	.	.	H	α-helix	trans	-63.2	-37.8	175.8	-67.5	173.8	0	0	0	111.8	F285 L300 C303 T304 R305 V310 V311 A312	F285-L308 HydrophobicContact CZ-CD2 4.41Å; L300-L308 HydrophobicContact CD2-CD2 3.8Å; C303-L308 HydrophobicContact CB-CD1 4.24Å; C303-L308 HydrophobicContact CB-CD2 3.77Å; C303-L308 HydrophobicContact CB-CG 3.77Å; T304-L308 PolarHBondContact O-N 3.49Å; R305-L308 PolarHBondContact O-N 3.46Å; L308-V310 VanDerWaalsContact C-N 3.33Å; L308-V310 PolarHBondContact O-N 3.29Å; L308-V311 PolarHBondContact O-N 2.92Å; L308-A312 VanDerWaalsContact O-CB 3.3Å; L308-A312 WeakPolarHBondContact O-CB 3.33Å; L308-A312 PolarHBondContact O-N 2.9Å
309	E	56	Low	56.4	Low	77 Å²	77	61.5 Å²	61.5	36%	0.36	31%	0.313	S	S	.	.	H	α-helix	trans	-63	-36.7	174.5	-77.1	174.4	-167.6	0	0	112.4	R305 T306 E307 K313	R305-E309 IonicContact CZ-OE1 3.96Å; R305-E309 IonicContact NE-OE1 3.3Å; R305-E309 PolarHBondContact NE-OE1 3.26Å; R305-E309 VanDerWaalsContact NE-OE1 3.09Å; R305-E309 IonicContact NH2-OE1 2.88Å; R305-E309 WeakPolarHBondContact O-CG 3.36Å; R305-E309 PolarHBondContact O-N 3.12Å; T306-E309 PolarHBondContact O-N 3.46Å; E307-E309 VanDerWaalsContact C-N 3.32Å; E307-E309 PolarHBondContact O-N 3.02Å; E309-K313 WeakPolarHBondContact O-CB 3.46Å; E309-K313 WeakPolarHBondContact O-CG 3.41Å; E309-K313 PolarHBondContact O-N 3.42Å
310	V	55.2	Low	56.3	Low	31 Å²	31	61.3 Å²	61.3	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-71.9	-42.1	176.7	169.6	0	0	0	0	111.6	V10 L12 T306 E307 L308 A312 K313 F314	V10-V310 HydrophobicContact CG1-CG1 4.42Å; L12-V310 HydrophobicContact CD1-CB 4.11Å; L12-V310 HydrophobicContact CD1-CG1 4.29Å; L12-V310 HydrophobicContact CD1-CG2 3.62Å; L12-V310 HydrophobicContact CD2-CG2 4.13Å; L12-V310 HydrophobicContact CG-CG2 4.47Å; T306-V310 WeakPolarHBondContact O-CG2 3.32Å; T306-V310 PolarHBondContact O-N 2.92Å; T306-V310 VanDerWaalsContact O-N 3.08Å; E307-V310 PolarHBondContact O-N 3.03Å; L308-V310 VanDerWaalsContact C-N 3.33Å; L308-V310 PolarHBondContact O-N 3.29Å; V310-A312 VanDerWaalsContact C-N 3.33Å; V310-A312 PolarHBondContact O-N 3.39Å; V310-K313 PolarHBondContact O-N 3.47Å; V310-F314 WeakPolarHBondContact O-CB 3.49Å; V310-F314 PolarHBondContact O-N 3.13Å
311	V	59.7	Low	56.2	Low	12 Å²	12	61.4 Å²	61.4	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-59	-47	172.7	173.1	0	0	0	0	110.2	I36 I38 L290 E307 L308 K313 F314 V315	I36-V311 HydrophobicContact CD1-CG1 4.05Å; I36-V311 HydrophobicContact CD1-CG2 4.5Å; I36-V311 HydrophobicContact CG2-CG2 4.21Å; I38-V311 HydrophobicContact CD1-CG2 4.06Å; L290-V311 HydrophobicContact CD2-CG1 3.78Å; E307-V311 WeakPolarHBondContact O-CG2 3.45Å; E307-V311 PolarHBondContact O-N 2.89Å; L308-V311 PolarHBondContact O-N 2.92Å; V311-K313 PolarHBondContact O-N 3Å; V311-F314 PolarHBondContact O-N 3.27Å; V311-V315 HydrophobicContact CG1-CG2 4.47Å; V311-V315 WeakPolarHBondContact O-CG2 3.38Å; V311-V315 PolarHBondContact O-N 3.36Å
312	A	57.2	Low	56.1	Low	21 Å²	21	61.7 Å²	61.7	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-46.6	178.6	0	0	0	0	0	112.5	L138 L308 V310 F314 V315 L316	L138-A312 HydrophobicContact CD2-CB 3.77Å; L308-A312 VanDerWaalsContact O-CB 3.3Å; L308-A312 WeakPolarHBondContact O-CB 3.33Å; L308-A312 PolarHBondContact O-N 2.9Å; V310-A312 VanDerWaalsContact C-N 3.33Å; V310-A312 PolarHBondContact O-N 3.39Å; A312-F314 VanDerWaalsContact C-N 3.3Å; A312-F314 PolarHBondContact O-N 3.4Å; A312-V315 PolarHBondContact O-N 2.94Å; A312-L316 WeakPolarHBondContact O-CG 3.26Å; A312-L316 PolarHBondContact O-N 3.41Å
313	K	55.6	Low	55.9	Low	140 Å²	140	64.7 Å²	64.7	61%	0.609	33%	0.328	S	S	*	.	H	α-helix	trans	-58.9	-42.6	175.5	-78.7	176.3	-178.8	174.1	0	111.6	E309 V310 V311 L316 L317	E309-K313 WeakPolarHBondContact O-CB 3.46Å; E309-K313 WeakPolarHBondContact O-CG 3.41Å; E309-K313 PolarHBondContact O-N 3.42Å; V310-K313 PolarHBondContact O-N 3.47Å; V311-K313 PolarHBondContact O-N 3Å; K313-L316 PolarHBondContact O-N 3.42Å; K313-L317 WeakPolarHBondContact O-CB 3.15Å; K313-L317 PolarHBondContact O-N 3.1Å
314	F	56.7	Low	55.9	Low	28 Å²	28	71.3 Å²	71.3	12%	0.123	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-46.1	177.8	-177.8	-97.7	0	0	0	112.1	M1 I29 I36 W287 V310 V311 A312 L316 L317 R318	M1-F314 HydrophobicContact CE-CD2 3.73Å; M1-F314 HydrophobicContact CE-CE2 3.85Å; I29-F314 HydrophobicContact CD1-CD2 3.75Å; I29-F314 HydrophobicContact CD1-CE2 4.01Å; I29-F314 HydrophobicContact CD1-CG 4.05Å; I29-F314 HydrophobicContact CG2-CE1 3.95Å; I29-F314 HydrophobicContact CG2-CE2 4.04Å; I29-F314 HydrophobicContact CG2-CZ 3.62Å; I36-F314 HydrophobicContact CD1-CD1 3.79Å; I36-F314 HydrophobicContact CD1-CE1 4.3Å; W287-F314 AromaticContact CZ2-CE1 3.87Å; W287-F314 HydrophobicContact CZ2-CE1 3.87Å; W287-F314 HydrophobicContact CZ2-CZ 4.02Å; V310-F314 WeakPolarHBondContact O-CB 3.49Å; V310-F314 PolarHBondContact O-N 3.13Å; V311-F314 PolarHBondContact O-N 3.27Å; A312-F314 VanDerWaalsContact C-N 3.3Å; A312-F314 PolarHBondContact O-N 3.4Å; F314-L316 PolarHBondContact O-N 3.33Å; F314-L317 PolarHBondContact O-N 3.26Å; F314-R318 HydrophobicContact CE1-CG 4.28Å; F314-R318 HydrophobicContact CZ-CG 4.18Å; F314-R318 PolarHBondContact O-N 2.95Å
315	V	56.8	Low	55.3	Low	25 Å²	25	70.4 Å²	70.4	15%	0.152	35%	0.347	C	S	.	.	H	α-helix	trans	-60.4	-45.8	177.7	172.4	0	0	0	0	111.3	L290 V311 A312 L317 R318 R319	L290-V315 HydrophobicContact CB-CG2 4.08Å; L290-V315 HydrophobicContact CD1-CG2 3.83Å; L290-V315 HydrophobicContact CD2-CG2 3.78Å; L290-V315 HydrophobicContact CG-CG2 4.13Å; V311-V315 HydrophobicContact CG1-CG2 4.47Å; V311-V315 WeakPolarHBondContact O-CG2 3.38Å; V311-V315 PolarHBondContact O-N 3.36Å; A312-V315 PolarHBondContact O-N 2.94Å; V315-L317 PolarHBondContact O-N 3.31Å; V315-R318 PolarHBondContact O-N 3.4Å; V315-R319 PolarHBondContact O-N 2.96Å
316	L	54.1	Low	55.1	Low	67 Å²	67	65.1 Å²	65.1	35%	0.351	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-45.3	178.1	-72.7	172.3	0	0	0	111.8	A312 K313 F314 R318 R319 A320	A312-L316 WeakPolarHBondContact O-CG 3.26Å; A312-L316 PolarHBondContact O-N 3.41Å; K313-L316 PolarHBondContact O-N 3.42Å; F314-L316 PolarHBondContact O-N 3.33Å; L316-R318 VanDerWaalsContact C-N 3.28Å; L316-R318 PolarHBondContact O-N 3.5Å; L316-R319 PolarHBondContact O-N 3.43Å; L316-A320 PolarHBondContact O-N 3.34Å
317	L	54.5	Low	55.2	Low	135 Å²	135	64.7 Å²	64.7	71%	0.707	34%	0.336	S	S	*	.	H	α-helix	trans	-64.1	-36.2	-179.9	-149	141.4	0	0	0	111.1	K313 F314 V315 S321	K313-L317 WeakPolarHBondContact O-CB 3.15Å; K313-L317 PolarHBondContact O-N 3.1Å; F314-L317 PolarHBondContact O-N 3.26Å; V315-L317 PolarHBondContact O-N 3.31Å; L317-S321 PolarHBondContact O-N 3.24Å; L317-S321 VanDerWaalsContact O-N 3.08Å
318	R	56.7	Low	55.1	Low	59 Å²	59	67.4 Å²	67.4	22%	0.223	35%	0.35	C	S	.	.	H	α-helix	trans	-72.3	-40.2	173.3	-95.4	-53.3	-155.7	-175.3	6.3	114.1	F314 V315 L316 A320 S321 L322 D414	F314-R318 HydrophobicContact CE1-CG 4.28Å; F314-R318 HydrophobicContact CZ-CG 4.18Å; F314-R318 PolarHBondContact O-N 2.95Å; V315-R318 PolarHBondContact O-N 3.4Å; L316-R318 VanDerWaalsContact C-N 3.28Å; L316-R318 PolarHBondContact O-N 3.5Å; R318-A320 VanDerWaalsContact C-N 3.31Å; R318-A320 PolarHBondContact O-N 3.05Å; R318-S321 WeakPolarHBondContact O-CB 3.22Å; R318-S321 PolarHBondContact O-N 2.91Å; R318-L322 PolarHBondContact O-N 3.32Å; R318-D414 IonicContact CZ-OD1 2.92Å; R318-D414 IonicContact CZ-OD2 2.7Å; R318-D414 IonicContact NH1-OD1 3.97Å; R318-D414 IonicContact NH1-OD2 3.67Å; R318-D414 PolarHBondContact NH1-OD2 3.02Å; R318-D414 VanDerWaalsContact NH2-CG 3.33Å; R318-D414 IonicContact NH2-OD1 3.76Å; R318-D414 PolarHBondContact NH2-OD1 3.21Å; R318-D414 IonicContact NH2-OD2 2.71Å; R318-D414 PolarHBondContact NH2-OD2 2.9Å
319	R	57.2	Low	54.8	Low	113 Å²	113	66.6 Å²	66.6	43%	0.426	35%	0.346	S	S	.	.	H	α-helix	trans	-58.5	-44.2	172.6	-81.9	-176.1	172.4	176.8	-1.5	111.5	S291 V315 L316 S321 L322 N323	S291-R319 PolarHBondContact O-NH2 2.91Å; V315-R319 PolarHBondContact O-N 2.96Å; L316-R319 PolarHBondContact O-N 3.43Å; R319-S321 VanDerWaalsContact C-N 3.34Å; R319-S321 PolarHBondContact O-N 3.28Å; R319-L322 PolarHBondContact O-N 3.35Å; R319-N323 WeakPolarHBondContact O-CB 3.36Å; R319-N323 PolarHBondContact O-N 2.82Å
320	A	50.7	Low	55	Low	52 Å²	52	65.5 Å²	65.5	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-42.7	175.8	0	0	0	0	0	111.9	L316 R318 N323 R324	L316-A320 PolarHBondContact O-N 3.34Å; R318-A320 VanDerWaalsContact C-N 3.31Å; R318-A320 PolarHBondContact O-N 3.05Å; A320-N323 PolarHBondContact O-N 3.32Å; A320-R324 WeakPolarHBondContact O-CB 3.47Å; A320-R324 PolarHBondContact O-N 2.95Å
321	S	52.3	Low	55.2	Low	50 Å²	50	67.6 Å²	67.6	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175.2	-174.2	0	0	0	0	112.5	L317 R318 R319 R324 S325	L317-S321 PolarHBondContact O-N 3.24Å; L317-S321 VanDerWaalsContact O-N 3.08Å; R318-S321 WeakPolarHBondContact O-CB 3.22Å; R318-S321 PolarHBondContact O-N 2.91Å; R319-S321 VanDerWaalsContact C-N 3.34Å; R319-S321 PolarHBondContact O-N 3.28Å; S321-R324 PolarHBondContact O-N 2.84Å; S321-S325 PolarHBondContact O-N 3.48Å; S321-S325 PolarHBondContact O-OG 3.47Å
322	L	54	Low	55.1	Low	82 Å²	82	69.4 Å²	69.4	43%	0.429	37%	0.368	S	S	.	.	H	α-helix	trans	-63.5	-49.8	177.2	-85.3	162.8	0	0	0	110.8	R318 R319 R324 S325 T326 M417	R318-L322 PolarHBondContact O-N 3.32Å; R319-L322 PolarHBondContact O-N 3.35Å; L322-R324 PolarHBondContact O-N 2.92Å; L322-S325 PolarHBondContact O-N 3.47Å; L322-S325 PolarHBondContact O-OG 3.29Å; L322-T326 WeakPolarHBondContact O-CG2 3.35Å; L322-T326 PolarHBondContact O-N 3.04Å; L322-T326 PolarHBondContact O-OG1 2.99Å; L322-M417 HydrophobicContact CD2-CE 4.48Å
323	N	53.5	Low	55.1	Low	111 Å²	111	70.3 Å²	70.3	59%	0.594	37%	0.371	S	S	*	.	H	α-helix	trans	-58.2	-36.8	177.4	-74.6	-4.7	0	0	0	112.5	R319 A320 T326 A327	R319-N323 WeakPolarHBondContact O-CB 3.36Å; R319-N323 PolarHBondContact O-N 2.82Å; A320-N323 PolarHBondContact O-N 3.32Å; N323-T326 WeakPolarHBondContact CA-OG1 3.29Å; N323-T326 PolarHBondContact O-OG1 2.83Å; N323-A327 VanDerWaalsContact O-CB 3.3Å; N323-A327 WeakPolarHBondContact O-CB 3.27Å; N323-A327 PolarHBondContact O-N 3.21Å
324	R	53.6	Low	55.7	Low	155 Å²	155	70.5 Å²	70.5	59%	0.585	37%	0.368	S	S	*	.	H	α-helix	trans	-67.2	-43.2	175.2	-168.2	177.1	-171	176	3.1	111.7	A320 S321 L322 A327 I328	A320-R324 WeakPolarHBondContact O-CB 3.47Å; A320-R324 PolarHBondContact O-N 2.95Å; S321-R324 PolarHBondContact O-N 2.84Å; L322-R324 PolarHBondContact O-N 2.92Å; R324-A327 PolarHBondContact O-N 3.12Å; R324-I328 HydrophobicContact CG-CD1 4.24Å; R324-I328 WeakPolarHBondContact O-CG1 3.44Å; R324-I328 PolarHBondContact O-N 2.94Å; R324-I328 VanDerWaalsContact O-N 3.11Å
325	S	48.8	Very low	56	Low	30 Å²	30	71.5 Å²	71.5	21%	0.21	38%	0.381	C	S	.	.	H	α-helix	trans	-66	-39.8	178.1	67.7	0	0	0	0	112.4	S321 L322 I328 M329	S321-S325 PolarHBondContact O-N 3.48Å; S321-S325 PolarHBondContact O-OG 3.47Å; L322-S325 PolarHBondContact O-N 3.47Å; L322-S325 PolarHBondContact O-OG 3.29Å; S325-I328 PolarHBondContact O-N 2.99Å; S325-M329 WeakPolarHBondContact O-CE 3.26Å; S325-M329 WeakPolarHBondContact O-CG 2.9Å; S325-M329 PolarHBondContact O-N 2.85Å
326	T	53.2	Low	55.9	Low	72 Å²	72	71 Å²	71	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-69.5	-37.5	177.5	53.3	0	0	0	0	112	L322 N323 M329 A330	L322-T326 WeakPolarHBondContact O-CG2 3.35Å; L322-T326 PolarHBondContact O-N 3.04Å; L322-T326 PolarHBondContact O-OG1 2.99Å; N323-T326 WeakPolarHBondContact CA-OG1 3.29Å; N323-T326 PolarHBondContact O-OG1 2.83Å; T326-M329 HydrophobicContact CG2-CE 4.39Å; T326-M329 PolarHBondContact O-N 3.47Å; T326-A330 WeakPolarHBondContact O-CB 3.28Å; T326-A330 PolarHBondContact O-N 2.92Å
327	A	56.8	Low	56.5	Low	43 Å²	43	73.9 Å²	73.9	36%	0.355	39%	0.389	S	S	.	.	H	α-helix	trans	-62	-47	173.8	0	0	0	0	0	112.1	N323 R324 M329 A330 D331	N323-A327 VanDerWaalsContact O-CB 3.3Å; N323-A327 WeakPolarHBondContact O-CB 3.27Å; N323-A327 PolarHBondContact O-N 3.21Å; R324-A327 PolarHBondContact O-N 3.12Å; A327-M329 VanDerWaalsContact C-N 3.32Å; A327-M329 PolarHBondContact O-N 3.09Å; A327-A330 PolarHBondContact O-N 2.89Å; A327-D331 PolarHBondContact O-N 2.77Å
328	I	55.5	Low	57.3	Low	57 Å²	57	73.2 Å²	73.2	29%	0.292	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-43.6	176.5	-66.9	166	0	0	0	110.6	R324 S325 A330 D331 E332	R324-I328 HydrophobicContact CG-CD1 4.24Å; R324-I328 WeakPolarHBondContact O-CG1 3.44Å; R324-I328 PolarHBondContact O-N 2.94Å; R324-I328 VanDerWaalsContact O-N 3.11Å; S325-I328 PolarHBondContact O-N 2.99Å; I328-A330 VanDerWaalsContact C-N 3.35Å; I328-A330 PolarHBondContact O-N 3.31Å; I328-D331 PolarHBondContact O-N 3.09Å; I328-E332 HydrophobicContact CG2-CG 4.48Å; I328-E332 WeakPolarHBondContact O-CG 3.43Å; I328-E332 PolarHBondContact O-N 2.86Å
329	M	51.9	Low	57.6	Low	39 Å²	39	71.8 Å²	71.8	19%	0.192	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-43.4	175.9	-79.8	-174	-84	0	0	111.9	S325 T326 A327 D331 E332 V333 M417 C421	S325-M329 WeakPolarHBondContact O-CE 3.26Å; S325-M329 WeakPolarHBondContact O-CG 2.9Å; S325-M329 PolarHBondContact O-N 2.85Å; T326-M329 HydrophobicContact CG2-CE 4.39Å; T326-M329 PolarHBondContact O-N 3.47Å; A327-M329 VanDerWaalsContact C-N 3.32Å; A327-M329 PolarHBondContact O-N 3.09Å; M329-D331 PolarHBondContact O-N 2.85Å; M329-E332 PolarHBondContact O-N 3.39Å; M329-V333 WeakPolarHBondContact O-CG2 3.32Å; M329-V333 PolarHBondContact O-N 3.38Å; M329-M417 HydrophobicContact CE-CE 4.4Å; M329-C421 VanDerWaalsContact SD-SG 3.62Å
330	A	61	Low	57.8	Low	53 Å²	53	68 Å²	68	44%	0.438	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-41.4	179.3	0	0	0	0	0	112.7	T326 A327 I328 V333 R334	T326-A330 WeakPolarHBondContact O-CB 3.28Å; T326-A330 PolarHBondContact O-N 2.92Å; A327-A330 PolarHBondContact O-N 2.89Å; I328-A330 VanDerWaalsContact C-N 3.35Å; I328-A330 PolarHBondContact O-N 3.31Å; A330-V333 PolarHBondContact O-N 2.87Å; A330-R334 PolarHBondContact O-N 2.92Å
331	D	59.9	Low	58.7	Low	75 Å²	75	69.8 Å²	69.8	40%	0.401	37%	0.372	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176.7	-74.8	-22.7	0	0	0	111.7	A327 I328 M329 R334 A335	A327-D331 PolarHBondContact O-N 2.77Å; I328-D331 PolarHBondContact O-N 3.09Å; M329-D331 PolarHBondContact O-N 2.85Å; D331-R334 PolarHBondContact O-N 3.32Å; D331-R334 IonicContact OD1-NH1 3.4Å; D331-A335 PolarHBondContact O-N 2.9Å
332	E	57.3	Low	59.5	Low	51 Å²	51	70.7 Å²	70.7	24%	0.238	38%	0.376	C	S	.	.	H	α-helix	trans	-67.9	-39.9	176.4	-69.9	-70.8	167.3	0	0	111.7	I328 M329 R334 A335 L336 R405 F425	I328-E332 HydrophobicContact CG2-CG 4.48Å; I328-E332 WeakPolarHBondContact O-CG 3.43Å; I328-E332 PolarHBondContact O-N 2.86Å; M329-E332 PolarHBondContact O-N 3.39Å; E332-R334 VanDerWaalsContact C-N 3.29Å; E332-R334 PolarHBondContact O-N 3.35Å; E332-A335 PolarHBondContact O-N 2.87Å; E332-L336 VanDerWaalsContact O-CB 3.29Å; E332-L336 WeakPolarHBondContact O-CB 3.42Å; E332-L336 PolarHBondContact O-N 2.9Å; E332-R405 IonicContact OE1-NH1 3.03Å; E332-R405 PolarHBondContact OE1-NH1 2.87Å; E332-R405 IonicContact OE2-NH1 3.78Å; E332-F425 HydrophobicContact CB-CE1 4.06Å; E332-F425 HydrophobicContact CB-CZ 3.89Å; E332-F425 HydrophobicContact CG-CZ 4.42Å
333	V	56.3	Low	59.9	Low	39 Å²	39	68.2 Å²	68.2	24%	0.236	36%	0.362	C	S	.	.	H	α-helix	trans	-58.4	-43	172.8	171.4	0	0	0	0	110.8	M329 A330 L336 Q337 F424 M428	M329-V333 WeakPolarHBondContact O-CG2 3.32Å; M329-V333 PolarHBondContact O-N 3.38Å; A330-V333 PolarHBondContact O-N 2.87Å; V333-L336 PolarHBondContact O-N 3.13Å; V333-Q337 PolarHBondContact O-N 3.49Å; V333-F424 HydrophobicContact CG2-CE1 4.19Å; V333-M428 HydrophobicContact CB-SD 4.49Å; V333-M428 HydrophobicContact CG1-SD 4.28Å; V333-M428 HydrophobicContact CG2-CE 4.13Å; V333-M428 HydrophobicContact CG2-SD 3.77Å
334	R	68.9	Low	60.6	Low	145 Å²	145	68 Å²	68	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-63.7	-47.9	177.2	-175.2	-175.7	-67.6	142.5	1.2	111.8	A330 D331 E332 L336 Q337 E338	A330-R334 PolarHBondContact O-N 2.92Å; D331-R334 PolarHBondContact O-N 3.32Å; D331-R334 IonicContact OD1-NH1 3.4Å; E332-R334 VanDerWaalsContact C-N 3.29Å; E332-R334 PolarHBondContact O-N 3.35Å; R334-L336 PolarHBondContact O-N 3.15Å; R334-Q337 PolarHBondContact O-N 3.11Å; R334-E338 PolarHBondContact O-N 3.43Å
335	A	62.3	Low	61.2	Low	49 Å²	49	66.4 Å²	66.4	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-35.6	178.2	0	0	0	0	0	111.8	D331 E332 E338 A339	D331-A335 PolarHBondContact O-N 2.9Å; E332-A335 PolarHBondContact O-N 2.87Å; A335-E338 PolarHBondContact O-N 3.5Å; A335-A339 PolarHBondContact O-N 2.99Å
336	L	56.1	Low	62.1	Low	15 Å²	15	73 Å²	73	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-75.7	-37.8	-179.8	-142.6	164.1	0	0	0	111.5	E332 V333 R334 E338 A339 V340 L398 M428 M432	E332-L336 VanDerWaalsContact O-CB 3.29Å; E332-L336 WeakPolarHBondContact O-CB 3.42Å; E332-L336 PolarHBondContact O-N 2.9Å; V333-L336 PolarHBondContact O-N 3.13Å; R334-L336 PolarHBondContact O-N 3.15Å; L336-E338 VanDerWaalsContact C-N 3.35Å; L336-E338 PolarHBondContact O-N 3.35Å; L336-A339 PolarHBondContact O-N 2.89Å; L336-V340 HydrophobicContact CD2-CG2 4.22Å; L336-V340 WeakPolarHBondContact O-CG2 3.21Å; L336-V340 PolarHBondContact O-N 3.48Å; L336-L398 HydrophobicContact CD2-CD1 4.39Å; L336-L398 HydrophobicContact CG-CD1 4.49Å; L336-M428 HydrophobicContact CD1-CE 3.93Å; L336-M432 HydrophobicContact CD1-CE 4.04Å; L336-M432 HydrophobicContact CD2-CE 3.12Å; L336-M432 HydrophobicContact CD2-SD 3.27Å; L336-M432 WeakPolarHBondContact CD2-SD 3.48Å; L336-M432 HydrophobicContact CG-CE 4.11Å
337	Q	66.7	Low	62.5	Low	127 Å²	127	71 Å²	71	59%	0.593	36%	0.364	S	S	*	.	H	α-helix	trans	-58.8	-44	167.9	-83.7	178.3	-39.4	0	0	112.1	V333 R334 A339 V340 E341	V333-Q337 PolarHBondContact O-N 3.49Å; R334-Q337 PolarHBondContact O-N 3.11Å; Q337-A339 PolarHBondContact O-N 3.37Å; Q337-V340 PolarHBondContact O-N 3.48Å; Q337-E341 PolarHBondContact O-N 2.89Å
338	E	70.9	Confident	62.9	Low	120 Å²	120	74.5 Å²	74.5	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-42.8	176.5	-74.7	176.1	-171.6	0	0	111.9	R334 A335 L336 V340 E341 T342	R334-E338 PolarHBondContact O-N 3.43Å; A335-E338 PolarHBondContact O-N 3.5Å; L336-E338 VanDerWaalsContact C-N 3.35Å; L336-E338 PolarHBondContact O-N 3.35Å; E338-V340 PolarHBondContact O-N 3.01Å; E338-E341 PolarHBondContact O-N 2.68Å; E338-T342 WeakPolarHBondContact O-CB 3.37Å; E338-T342 PolarHBondContact O-N 3.33Å; E338-T342 PolarHBondContact O-OG1 2.91Å
339	A	63	Low	63.4	Low	30 Å²	30	75.1 Å²	75.1	25%	0.248	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-42.5	177.7	0	0	0	0	0	112.4	A335 L336 Q337 T342 Q343 L398	A335-A339 PolarHBondContact O-N 2.99Å; L336-A339 PolarHBondContact O-N 2.89Å; Q337-A339 PolarHBondContact O-N 3.37Å; A339-T342 PolarHBondContact O-N 3.42Å; A339-Q343 PolarHBondContact O-N 2.89Å; A339-L398 HydrophobicContact CB-CD1 4.21Å
340	V	62.1	Low	63.7	Low	34 Å²	34	77.5 Å²	77.5	21%	0.206	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-44.5	176.3	169.8	0	0	0	0	111.1	L336 Q337 E338 T342 Q343 K344 M432	L336-V340 HydrophobicContact CD2-CG2 4.22Å; L336-V340 WeakPolarHBondContact O-CG2 3.21Å; L336-V340 PolarHBondContact O-N 3.48Å; Q337-V340 PolarHBondContact O-N 3.48Å; E338-V340 PolarHBondContact O-N 3.01Å; V340-T342 VanDerWaalsContact C-N 3.35Å; V340-T342 PolarHBondContact O-N 3.2Å; V340-Q343 PolarHBondContact O-N 3.29Å; V340-Q343 VanDerWaalsContact O-N 3.13Å; V340-K344 PolarHBondContact O-N 3.49Å; V340-M432 HydrophobicContact CG2-CG 4.35Å; V340-M432 HydrophobicContact CG2-SD 3.61Å
341	E	69.2	Low	63.7	Low	88 Å²	88	80.5 Å²	80.5	41%	0.411	40%	0.395	S	S	.	.	H	α-helix	trans	-71.7	-33.5	-177.4	-135.6	54.5	-172.6	0	0	112.2	Q337 E338 Q343 K344 Q345	Q337-E341 PolarHBondContact O-N 2.89Å; E338-E341 PolarHBondContact O-N 2.68Å; E341-Q343 VanDerWaalsContact C-N 3.31Å; E341-Q343 PolarHBondContact O-N 3.39Å; E341-K344 PolarHBondContact O-N 3.4Å; E341-K344 WeakPolarHBondContact OE1-CD 3.21Å; E341-K344 IonicContact OE1-NZ 3.18Å; E341-K344 PolarHBondContact OE1-NZ 2.73Å; E341-Q345 WeakPolarHBondContact O-CG 3.47Å; E341-Q345 PolarHBondContact O-N 3.31Å
342	T	67.7	Low	63.6	Low	69 Å²	69	80.4 Å²	80.4	42%	0.423	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-42.4	169.5	-43.3	0	0	0	0	110.7	E338 A339 V340 Q345 W346	E338-T342 WeakPolarHBondContact O-CB 3.37Å; E338-T342 PolarHBondContact O-N 3.33Å; E338-T342 PolarHBondContact O-OG1 2.91Å; A339-T342 PolarHBondContact O-N 3.42Å; V340-T342 VanDerWaalsContact C-N 3.35Å; V340-T342 PolarHBondContact O-N 3.2Å; T342-Q345 PolarHBondContact O-N 3.48Å; T342-W346 PolarHBondContact O-N 3.11Å; T342-W346 VanDerWaalsContact O-N 3.08Å
343	Q	63.1	Low	63.5	Low	30 Å²	30	86.7 Å²	86.7	14%	0.14	42%	0.423	C	S	.	.	H	α-helix	trans	-68.3	-38.8	178.6	-177.2	146	9.5	0	0	112.7	A339 V340 E341 Q345 W346 C347 A391 L394	A339-Q343 PolarHBondContact O-N 2.89Å; V340-Q343 PolarHBondContact O-N 3.29Å; V340-Q343 VanDerWaalsContact O-N 3.13Å; E341-Q343 VanDerWaalsContact C-N 3.31Å; E341-Q343 PolarHBondContact O-N 3.39Å; Q343-Q345 VanDerWaalsContact C-N 3.31Å; Q343-Q345 PolarHBondContact O-N 2.89Å; Q343-W346 PolarHBondContact O-N 3.27Å; Q343-W346 VanDerWaalsContact O-N 3.16Å; Q343-C347 PolarHBondContact O-N 2.71Å; Q343-C347 PolarHBondContact O-SG 3.27Å; Q343-A391 VanDerWaalsContact NE2-CA 3.27Å; Q343-L394 VanDerWaalsContact OE1-CD2 3.31Å
344	K	67.6	Low	63.3	Low	108 Å²	108	90.6 Å²	90.6	47%	0.47	44%	0.438	S	S	.	.	H	α-helix	trans	-58.7	-43.7	174	-174	178.5	168.4	-169.9	0	111.3	V340 E341 W346 C347 E348	V340-K344 PolarHBondContact O-N 3.49Å; E341-K344 PolarHBondContact O-N 3.4Å; E341-K344 WeakPolarHBondContact OE1-CD 3.21Å; E341-K344 IonicContact OE1-NZ 3.18Å; E341-K344 PolarHBondContact OE1-NZ 2.73Å; K344-W346 PolarHBondContact O-N 3.3Å; K344-C347 PolarHBondContact O-N 2.98Å; K344-E348 PolarHBondContact O-N 2.81Å
345	Q	68	Low	62.3	Low	121 Å²	121	91.3 Å²	91.3	57%	0.565	45%	0.45	S	S	*	.	H	α-helix	trans	-60	-44.2	173.4	-70.8	173.5	1.8	0	0	112.2	E341 T342 Q343 C347 E348 V349	E341-Q345 WeakPolarHBondContact O-CG 3.47Å; E341-Q345 PolarHBondContact O-N 3.31Å; T342-Q345 PolarHBondContact O-N 3.48Å; Q343-Q345 VanDerWaalsContact C-N 3.31Å; Q343-Q345 PolarHBondContact O-N 2.89Å; Q345-C347 VanDerWaalsContact C-N 3.34Å; Q345-C347 PolarHBondContact O-N 3.37Å; Q345-E348 PolarHBondContact O-N 2.86Å; Q345-V349 WeakPolarHBondContact O-CG2 3.32Å; Q345-V349 PolarHBondContact O-N 3.45Å
346	W	66.3	Low	61.2	Low	167 Å²	167	97.7 Å²	97.7	63%	0.633	47%	0.465	S	S	*	.	H	α-helix	trans	-61.9	-40.5	175.7	-82.9	107.8	0	0	0	112.9	T342 Q343 K344 E348 V349 L350	T342-W346 PolarHBondContact O-N 3.11Å; T342-W346 VanDerWaalsContact O-N 3.08Å; Q343-W346 PolarHBondContact O-N 3.27Å; Q343-W346 VanDerWaalsContact O-N 3.16Å; K344-W346 PolarHBondContact O-N 3.3Å; W346-E348 VanDerWaalsContact C-N 3.35Å; W346-V349 PolarHBondContact O-N 3.18Å; W346-L350 WeakPolarHBondContact O-CB 3.42Å; W346-L350 WeakPolarHBondContact O-CG 3.38Å; W346-L350 PolarHBondContact O-N 2.69Å
347	C	62.6	Low	60.5	Low	32 Å²	32	101 Å²	101	22%	0.216	49%	0.487	C	S	.	.	H	α-helix	trans	-63.8	-39.4	174.9	-72.1	0	0	0	0	111.9	Q343 K344 Q345 L350 K351	Q343-C347 PolarHBondContact O-N 2.71Å; Q343-C347 PolarHBondContact O-SG 3.27Å; K344-C347 PolarHBondContact O-N 2.98Å; Q345-C347 VanDerWaalsContact C-N 3.34Å; Q345-C347 PolarHBondContact O-N 3.37Å; C347-L350 PolarHBondContact O-N 3.5Å; C347-K351 WeakPolarHBondContact O-CG 3.45Å; C347-K351 PolarHBondContact O-N 3.08Å
348	E	65.1	Low	59.4	Low	115 Å²	115	98.1 Å²	98.1	54%	0.537	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-44.6	173.7	-74.5	-172.7	176.1	0	0	112	K344 Q345 W346 L350 K351 C352	K344-E348 PolarHBondContact O-N 2.81Å; Q345-E348 PolarHBondContact O-N 2.86Å; W346-E348 VanDerWaalsContact C-N 3.35Å; E348-L350 VanDerWaalsContact C-N 3.31Å; E348-L350 PolarHBondContact O-N 3.2Å; E348-K351 WeakPolarHBondContact O-CB 3.42Å; E348-K351 PolarHBondContact O-N 3.47Å; E348-K351 VanDerWaalsContact O-N 3.17Å; E348-C352 PolarHBondContact O-N 3.49Å; E348-C352 PolarHBondContact O-SG 3.26Å; E348-C352 VanDerWaalsContact O-SG 3.4Å
349	V	64.5	Low	57.8	Low	70 Å²	70	98.3 Å²	98.3	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-59.2	-42.7	175.6	172.1	0	0	0	0	111.2	Q345 W346 C352 Y353	Q345-V349 WeakPolarHBondContact O-CG2 3.32Å; Q345-V349 PolarHBondContact O-N 3.45Å; W346-V349 PolarHBondContact O-N 3.18Å; V349-C352 WeakPolarHBondContact O-CB 3.22Å; V349-C352 PolarHBondContact O-N 3.04Å; V349-Y353 HydrophobicContact CG1-CD2 4.15Å; V349-Y353 HydrophobicContact CG1-CE2 4.46Å; V349-Y353 PolarHBondContact O-N 3.41Å
350	L	58.6	Low	56.6	Low	89 Å²	89	102.2 Å²	102.2	47%	0.466	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-40.9	175.8	-79.7	164.5	0	0	0	112.2	W346 C347 E348 C352 Y353 H354	W346-L350 WeakPolarHBondContact O-CB 3.42Å; W346-L350 WeakPolarHBondContact O-CG 3.38Å; W346-L350 PolarHBondContact O-N 2.69Å; C347-L350 PolarHBondContact O-N 3.5Å; E348-L350 VanDerWaalsContact C-N 3.31Å; E348-L350 PolarHBondContact O-N 3.2Å; L350-C352 VanDerWaalsContact C-N 3.32Å; L350-C352 PolarHBondContact O-N 3.04Å; L350-Y353 PolarHBondContact O-N 3Å; L350-H354 PolarHBondContact O-CD2 2.88Å; L350-H354 PolarHBondContact O-N 3.01Å
351	K	60.7	Low	55.7	Low	116 Å²	116	105.9 Å²	105.9	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-41.6	173.3	-76.3	179.4	179.4	-176.8	0	111.4	C347 E348 H354 M355	C347-K351 WeakPolarHBondContact O-CG 3.45Å; C347-K351 PolarHBondContact O-N 3.08Å; E348-K351 WeakPolarHBondContact O-CB 3.42Å; E348-K351 PolarHBondContact O-N 3.47Å; E348-K351 VanDerWaalsContact O-N 3.17Å; K351-H354 PolarHBondContact O-N 2.87Å; K351-M355 WeakPolarHBondContact O-CB 3.44Å; K351-M355 WeakPolarHBondContact O-CG 3.36Å; K351-M355 PolarHBondContact O-N 2.97Å
352	C	59.4	Low	54.6	Low	73 Å²	73	106.4 Å²	106.4	49%	0.493	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-40.9	175.4	-69.8	0	0	0	0	112.2	E348 V349 L350 H354 M355 Y356	E348-C352 PolarHBondContact O-N 3.49Å; E348-C352 PolarHBondContact O-SG 3.26Å; E348-C352 VanDerWaalsContact O-SG 3.4Å; V349-C352 WeakPolarHBondContact O-CB 3.22Å; V349-C352 PolarHBondContact O-N 3.04Å; L350-C352 VanDerWaalsContact C-N 3.32Å; L350-C352 PolarHBondContact O-N 3.04Å; C352-H354 VanDerWaalsContact C-N 3.26Å; C352-H354 PolarHBondContact O-N 3.16Å; C352-M355 PolarHBondContact O-N 2.73Å; C352-Y356 WeakPolarHBondContact O-CD2 3.43Å; C352-Y356 PolarHBondContact O-N 2.81Å; C352-Y356 VanDerWaalsContact O-N 3.12Å
353	Y	53.6	Low	53.2	Low	184 Å²	184	109.2 Å²	109.2	72%	0.722	56%	0.555	S	S	*	*	H	α-helix	trans	-61.8	-31.2	178.5	-108	-86.6	0	0	0	113.6	V349 L350	V349-Y353 HydrophobicContact CG1-CD2 4.15Å; V349-Y353 HydrophobicContact CG1-CE2 4.46Å; V349-Y353 PolarHBondContact O-N 3.41Å; L350-Y353 PolarHBondContact O-N 3Å
354	H	52.7	Low	52.2	Low	121 Å²	121	117 Å²	117	56%	0.56	59%	0.591	S	S	*	*	H	α-helix	trans	-89.8	-17.8	175.9	-76.4	-69.3	0	0	0	114.4	L350 K351 C352 I383	L350-H354 PolarHBondContact O-CD2 2.88Å; L350-H354 PolarHBondContact O-N 3.01Å; K351-H354 PolarHBondContact O-N 2.87Å; C352-H354 VanDerWaalsContact C-N 3.26Å; C352-H354 PolarHBondContact O-N 3.16Å; H354-I383 HydrophobicContact CB-CD1 4.14Å; H354-I383 VanDerWaalsContact CD2-CD1 3.42Å; H354-I383 WeakPolarHBondContact CD2-CD1 3.32Å
355	M	48.2	Very low	50.9	Low	159 Å²	159	117 Å²	117	78%	0.783	60%	0.604	S	S	*	*	H	α-helix	trans	-82.9	-19.9	174	-78.1	-76.4	136.3	0	0	112.9	K351 C352 P357	K351-M355 WeakPolarHBondContact O-CB 3.44Å; K351-M355 WeakPolarHBondContact O-CG 3.36Å; K351-M355 PolarHBondContact O-N 2.97Å; C352-M355 PolarHBondContact O-N 2.73Å; M355-P357 WeakPolarHBondContact O-CD 3.43Å
356	Y	39.5	Very low	49.7	Very low	184 Å²	184	120.4 Å²	120.4	72%	0.722	62%	0.617	S	S	*	*	S	Bend	trans	-72.8	113.9	166.2	-90.4	-86.9	0	0	0	108.7	C352 S358	C352-Y356 WeakPolarHBondContact O-CD2 3.43Å; C352-Y356 PolarHBondContact O-N 2.81Å; C352-Y356 VanDerWaalsContact O-N 3.12Å; Y356-S358 PolarHBondContact O-N 3.06Å; Y356-S358 VanDerWaalsContact O-N 3.17Å
357	P	40.6	Very low	48.8	Very low	84 Å²	84	118 Å²	118	55%	0.545	62%	0.623	S	S	.	*			trans	-57.2	129.3	163.6	26.9	-31.6	0	0	0	105.6	M355 N359	M355-P357 WeakPolarHBondContact O-CD 3.43Å; P357-N359 WeakPolarHBondContact O-CB 3.42Å; P357-N359 PolarHBondContact O-N 3.36Å
358	S	44.5	Very low	48.1	Very low	67 Å²	67	121.2 Å²	121.2	47%	0.469	64%	0.644	S	S	.	*			trans	-59.1	74.8	-179.2	48.1	0	0	0	0	111.1	Y356	Y356-S358 PolarHBondContact O-N 3.06Å; Y356-S358 VanDerWaalsContact O-N 3.17Å
359	N	37.1	Very low	47.4	Very low	123 Å²	123	119.4 Å²	119.4	66%	0.658	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	21.7	-171.2	-84	-2.7	0	0	0	112.6	P357	P357-N359 WeakPolarHBondContact O-CB 3.42Å; P357-N359 PolarHBondContact O-N 3.36Å
360	S	37.8	Very low	46.9	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.9	-2.2	174.5	56.3	0	0	0	0	117.6
361	S	43.9	Very low	46.6	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.7	0.6	170.1	61.7	0	0	0	0	117.7
362	I	45.9	Very low	46.1	Very low	100 Å²	100	125 Å²	125	51%	0.513	66%	0.661	S	S	.	*			trans	-105.4	32	173.3	-65.6	169.6	0	0	0	110.8	Q364	I362-Q364 PolarHBondContact O-N 2.95Å
363	N	37.9	Very low	45.7	Very low	127 Å²	127	125.3 Å²	125.3	68%	0.679	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	36.7	177.1	-81.3	-23.7	0	0	0	114.2
364	Q	42.3	Very low	45.6	Very low	193 Å²	193	125.3 Å²	125.3	90%	0.902	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	0.7	170	-71.6	-164.6	12.2	0	0	115.2	I362	I362-Q364 PolarHBondContact O-N 2.95Å
365	C	40.2	Very low	45.6	Very low	109 Å²	109	125.7 Å²	125.7	74%	0.736	68%	0.675	S	S	*	*	S	Bend	trans	-94.7	121	170.8	-74.4	0	0	0	0	109.8
366	K	42.4	Very low	45.8	Very low	193 Å²	193	121 Å²	121	84%	0.839	66%	0.661	S	S	*	*			trans	-37.9	147.9	177.9	-76.1	173.5	175.4	175.3	0	112.9
367	P	46.4	Very low	46.4	Very low	115 Å²	115	120.3 Å²	120.3	75%	0.747	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-54.5	140.5	-178.2	22.6	-33.2	0	0	0	111.2	S369	P367-S369 PolarHBondContact O-N 2.7Å; P367-S369 VanDerWaalsContact O-N 3.14Å
368	P	48.7	Very low	47.1	Very low	101 Å²	101	118.9 Å²	118.9	66%	0.656	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-63.1	117.7	-176.2	23.1	-30.7	0	0	0	110	D372	P368-D372 VanDerWaalsContact C-OD2 3.26Å; P368-D372 WeakPolarHBondContact CA-OD2 3.3Å; P368-D372 HydrophobicContact CB-CB 3.58Å; P368-D372 WeakPolarHBondContact CB-OD2 3.49Å
369	S	50.3	Low	47.5	Very low	76 Å²	76	117.9 Å²	117.9	53%	0.531	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-72.5	159.6	170.3	70.5	0	0	0	0	108.5	P367 T371 D372	P367-S369 PolarHBondContact O-N 2.7Å; P367-S369 VanDerWaalsContact O-N 3.14Å; S369-T371 PolarHBondContact O-N 3.5Å; S369-T371 PolarHBondContact OG-OG1 3.01Å; S369-D372 PolarHBondContact N-OD2 3.34Å; S369-D372 VanDerWaalsContact N-OD2 3.16Å; S369-D372 PolarHBondContact O-N 2.87Å; S369-D372 VanDerWaalsContact O-OD2 3.05Å
370	R	53.4	Low	48.3	Very low	255 Å²	255	114.6 Å²	114.6	96%	0.962	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-6.5	-173.3	-78.6	178.3	165.8	178.2	-4.6	116.3	D372	R370-D372 VanDerWaalsContact C-N 3.34Å
371	T	53.1	Low	49.3	Very low	88 Å²	88	112.6 Å²	112.6	54%	0.54	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-19.3	168.2	40	0	0	0	0	115.2	S369 A373 K374 Q375	S369-T371 PolarHBondContact O-N 3.5Å; S369-T371 PolarHBondContact OG-OG1 3.01Å; T371-A373 PolarHBondContact O-N 3.45Å; T371-K374 PolarHBondContact O-N 2.95Å; T371-Q375 PolarHBondContact O-N 3.26Å
372	D	50.4	Low	50	Low	51 Å²	51	110 Å²	110	27%	0.273	61%	0.608	S	S	.	*	H	α-helix	trans	-75.3	-20.6	-171.4	-71.9	-56.5	0	0	0	115.2	P368 S369 R370 K374 Q375 A376	P368-D372 VanDerWaalsContact C-OD2 3.26Å; P368-D372 WeakPolarHBondContact CA-OD2 3.3Å; P368-D372 HydrophobicContact CB-CB 3.58Å; P368-D372 WeakPolarHBondContact CB-OD2 3.49Å; S369-D372 PolarHBondContact N-OD2 3.34Å; S369-D372 VanDerWaalsContact N-OD2 3.16Å; S369-D372 PolarHBondContact O-N 2.87Å; S369-D372 VanDerWaalsContact O-OD2 3.05Å; R370-D372 VanDerWaalsContact C-N 3.34Å; D372-K374 PolarHBondContact O-N 2.85Å; D372-Q375 PolarHBondContact O-N 3.31Å; D372-Q375 VanDerWaalsContact O-N 3.16Å; D372-Q375 PolarHBondContact OD1-OE1 3.3Å; D372-A376 WeakPolarHBondContact O-CB 3.32Å; D372-A376 PolarHBondContact O-N 3.15Å
373	A	51.5	Low	50.4	Low	79 Å²	79	106.8 Å²	106.8	65%	0.653	59%	0.591	S	S	*	*	H	α-helix	trans	-64.9	-28.2	171.2	0	0	0	0	0	112.4	T371	T371-A373 PolarHBondContact O-N 3.45Å
374	K	51.4	Low	51.3	Low	184 Å²	184	104.5 Å²	104.5	80%	0.8	58%	0.579	S	S	*	*	H	α-helix	trans	-78.5	-34.4	171.9	-78.4	-174.4	176.3	-178.7	0	111.9	T371 D372 A378	T371-K374 PolarHBondContact O-N 2.95Å; D372-K374 PolarHBondContact O-N 2.85Å; K374-A378 PolarHBondContact O-N 3.38Å
375	Q	52.7	Low	52.2	Low	129 Å²	129	104.5 Å²	104.5	60%	0.603	57%	0.571	S	S	*	*	H	α-helix	trans	-72.6	-35.4	175.7	-77.3	-169.3	0.4	0	0	113	T371 D372 K377 A378 A379	T371-Q375 PolarHBondContact O-N 3.26Å; D372-Q375 PolarHBondContact O-N 3.31Å; D372-Q375 VanDerWaalsContact O-N 3.16Å; D372-Q375 PolarHBondContact OD1-OE1 3.3Å; Q375-K377 VanDerWaalsContact C-N 3.35Å; Q375-K377 PolarHBondContact O-N 2.98Å; Q375-A378 PolarHBondContact O-N 3.37Å; Q375-A378 VanDerWaalsContact O-N 3.17Å; Q375-A379 WeakPolarHBondContact O-CB 3.27Å; Q375-A379 PolarHBondContact O-N 2.89Å
376	A	51	Low	53.1	Low	61 Å²	61	105.8 Å²	105.8	50%	0.504	57%	0.566	S	S	.	*	H	α-helix	trans	-64.2	-38.4	176.1	0	0	0	0	0	112.3	D372 A379 S380	D372-A376 WeakPolarHBondContact O-CB 3.32Å; D372-A376 PolarHBondContact O-N 3.15Å; A376-A379 PolarHBondContact O-N 3.48Å; A376-S380 PolarHBondContact O-N 3.33Å; A376-S380 PolarHBondContact O-OG 2.98Å
377	K	53.3	Low	53.6	Low	168 Å²	168	97.9 Å²	97.9	73%	0.73	54%	0.535	S	S	*	.	H	α-helix	trans	-66.2	-36.8	172	-108.7	-177.8	177.2	-178	0	112.7	Q375 S380 S381	Q375-K377 VanDerWaalsContact C-N 3.35Å; Q375-K377 PolarHBondContact O-N 2.98Å; K377-S380 PolarHBondContact O-OG 3.13Å; K377-S380 VanDerWaalsContact O-OG 3.04Å; K377-S381 PolarHBondContact O-N 3.04Å; K377-S381 PolarHBondContact O-OG 3Å
378	A	54.4	Low	54.1	Low	55 Å²	55	94.2 Å²	94.2	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-68.6	-42.6	174.9	0	0	0	0	0	111.2	K374 Q375 S381 S382	K374-A378 PolarHBondContact O-N 3.38Å; Q375-A378 PolarHBondContact O-N 3.37Å; Q375-A378 VanDerWaalsContact O-N 3.17Å; A378-S381 PolarHBondContact O-N 3.08Å; A378-S381 PolarHBondContact O-OG 3.41Å; A378-S382 PolarHBondContact O-N 2.69Å
379	A	54.2	Low	54.6	Low	45 Å²	45	94.7 Å²	94.7	37%	0.372	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-44.8	177.5	0	0	0	0	0	112	Q375 A376 S381 S382 I383	Q375-A379 WeakPolarHBondContact O-CB 3.27Å; Q375-A379 PolarHBondContact O-N 2.89Å; A376-A379 PolarHBondContact O-N 3.48Å; A379-S381 VanDerWaalsContact C-N 3.34Å; A379-S381 PolarHBondContact O-N 2.69Å; A379-S382 PolarHBondContact O-N 3.22Å; A379-S382 VanDerWaalsContact O-N 3.14Å; A379-S382 PolarHBondContact O-OG 3.48Å; A379-I383 WeakPolarHBondContact O-CD1 3.1Å; A379-I383 WeakPolarHBondContact O-CG1 3.03Å; A379-I383 PolarHBondContact O-N 3.48Å
380	S	52.4	Low	54.8	Low	54 Å²	54	93.5 Å²	93.5	38%	0.378	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-42.4	175.7	69.5	0	0	0	0	111.9	A376 K377 S382 I383 D384	A376-S380 PolarHBondContact O-N 3.33Å; A376-S380 PolarHBondContact O-OG 2.98Å; K377-S380 PolarHBondContact O-OG 3.13Å; K377-S380 VanDerWaalsContact O-OG 3.04Å; S380-S382 VanDerWaalsContact C-N 3.3Å; S380-S382 PolarHBondContact O-N 3.49Å; S380-I383 PolarHBondContact O-N 2.97Å; S380-D384 PolarHBondContact O-N 3.3Å
381	S	59.1	Low	54.8	Low	71 Å²	71	81.5 Å²	81.5	50%	0.497	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-30.4	176.1	74.1	0	0	0	0	113.4	K377 A378 A379 R385	K377-S381 PolarHBondContact O-N 3.04Å; K377-S381 PolarHBondContact O-OG 3Å; A378-S381 PolarHBondContact O-N 3.08Å; A378-S381 PolarHBondContact O-OG 3.41Å; A379-S381 VanDerWaalsContact C-N 3.34Å; A379-S381 PolarHBondContact O-N 2.69Å; S381-R385 WeakPolarHBondContact O-CB 3.47Å; S381-R385 PolarHBondContact O-N 3.48Å; S381-R385 VanDerWaalsContact O-N 3.14Å
382	S	58.4	Low	55.1	Low	56 Å²	56	79.4 Å²	79.4	39%	0.392	45%	0.447	S	S	.	.	H	α-helix	trans	-72	-38.1	176	74.1	0	0	0	0	112.1	A378 A379 S380 R385 E386	A378-S382 PolarHBondContact O-N 2.69Å; A379-S382 PolarHBondContact O-N 3.22Å; A379-S382 VanDerWaalsContact O-N 3.14Å; A379-S382 PolarHBondContact O-OG 3.48Å; S380-S382 VanDerWaalsContact C-N 3.3Å; S380-S382 PolarHBondContact O-N 3.49Å; S382-R385 PolarHBondContact O-N 2.98Å; S382-E386 WeakPolarHBondContact O-CB 3.3Å; S382-E386 PolarHBondContact O-N 3.4Å
383	I	55.4	Low	55.6	Low	33 Å²	33	83.9 Å²	83.9	17%	0.169	46%	0.464	C	S	.	.	H	α-helix	trans	-70.8	-42.2	178	-68.1	156.8	0	0	0	110.7	H354 A379 S380 R385 E386 S387	H354-I383 HydrophobicContact CB-CD1 4.14Å; H354-I383 VanDerWaalsContact CD2-CD1 3.42Å; H354-I383 WeakPolarHBondContact CD2-CD1 3.32Å; A379-I383 WeakPolarHBondContact O-CD1 3.1Å; A379-I383 WeakPolarHBondContact O-CG1 3.03Å; A379-I383 PolarHBondContact O-N 3.48Å; S380-I383 PolarHBondContact O-N 2.97Å; I383-R385 VanDerWaalsContact C-N 3.26Å; I383-R385 PolarHBondContact O-N 2.96Å; I383-E386 PolarHBondContact O-N 2.92Å; I383-S387 VanDerWaalsContact O-CB 3.23Å; I383-S387 WeakPolarHBondContact O-CB 3.08Å; I383-S387 PolarHBondContact O-N 3.15Å; I383-S387 PolarHBondContact O-OG 2.96Å; I383-S387 VanDerWaalsContact O-OG 3.12Å
384	D	57.1	Low	55.8	Low	79 Å²	79	83.8 Å²	83.8	42%	0.422	45%	0.452	S	S	.	.	H	α-helix	trans	-59.8	-42.5	173.7	-75.7	-27.8	0	0	0	110	S380 S387 S388	S380-D384 PolarHBondContact O-N 3.3Å; D384-S387 WeakPolarHBondContact CA-OG 3.4Å; D384-S387 PolarHBondContact O-N 3.06Å; D384-S387 PolarHBondContact O-OG 3.22Å; D384-S388 WeakPolarHBondContact O-CB 3.13Å; D384-S388 PolarHBondContact O-N 2.76Å; D384-S388 PolarHBondContact O-OG 3.4Å
385	R	60.6	Low	56	Low	193 Å²	193	75.5 Å²	75.5	73%	0.728	42%	0.418	S	S	*	.	H	α-helix	trans	-65.7	-42.3	176.9	-164.7	176.3	-179.8	169.9	0.6	113.2	S381 S382 I383 Q389	S381-R385 WeakPolarHBondContact O-CB 3.47Å; S381-R385 PolarHBondContact O-N 3.48Å; S381-R385 VanDerWaalsContact O-N 3.14Å; S382-R385 PolarHBondContact O-N 2.98Å; I383-R385 VanDerWaalsContact C-N 3.26Å; I383-R385 PolarHBondContact O-N 2.96Å; R385-Q389 WeakPolarHBondContact O-CB 3.48Å; R385-Q389 PolarHBondContact O-N 3.04Å
386	E	57.8	Low	56.3	Low	135 Å²	135	71.2 Å²	71.2	63%	0.631	41%	0.405	S	S	*	.	H	α-helix	trans	-68.4	-39.1	176.2	-80.1	-172	165.5	0	0	112.2	S382 I383 Q389 A390	S382-E386 WeakPolarHBondContact O-CB 3.3Å; S382-E386 PolarHBondContact O-N 3.4Å; I383-E386 PolarHBondContact O-N 2.92Å; E386-Q389 PolarHBondContact O-N 3.37Å; E386-A390 WeakPolarHBondContact O-CB 3.27Å; E386-A390 PolarHBondContact O-N 2.87Å
387	S	54.6	Low	56.7	Low	27 Å²	27	71.5 Å²	71.5	19%	0.189	40%	0.403	C	S	.	.	H	α-helix	trans	-66.9	-42.9	176.8	73	0	0	0	0	111.6	I383 D384 Q389 A390 A391	I383-S387 VanDerWaalsContact O-CB 3.23Å; I383-S387 WeakPolarHBondContact O-CB 3.08Å; I383-S387 PolarHBondContact O-N 3.15Å; I383-S387 PolarHBondContact O-OG 2.96Å; I383-S387 VanDerWaalsContact O-OG 3.12Å; D384-S387 WeakPolarHBondContact CA-OG 3.4Å; D384-S387 PolarHBondContact O-N 3.06Å; D384-S387 PolarHBondContact O-OG 3.22Å; S387-Q389 VanDerWaalsContact C-N 3.32Å; S387-Q389 PolarHBondContact O-N 2.8Å; S387-A390 PolarHBondContact O-N 3.1Å; S387-A391 WeakPolarHBondContact O-CB 3.46Å; S387-A391 PolarHBondContact O-N 3.18Å
388	S	55.6	Low	56.8	Low	39 Å²	39	65.3 Å²	65.3	27%	0.273	38%	0.378	S	S	.	.	H	α-helix	trans	-62.1	-38.6	171	-69.8	0	0	0	0	111.7	D384 A392 N437	D384-S388 WeakPolarHBondContact O-CB 3.13Å; D384-S388 PolarHBondContact O-N 2.76Å; D384-S388 PolarHBondContact O-OG 3.4Å; S388-A392 VanDerWaalsContact O-CB 3.27Å; S388-A392 WeakPolarHBondContact O-CB 3.46Å; S388-A392 PolarHBondContact O-N 2.84Å; S388-N437 PolarHBondContact OG-OD1 3.28Å
389	Q	60.2	Low	57	Low	111 Å²	111	63.7 Å²	63.7	52%	0.519	36%	0.364	S	S	.	.	H	α-helix	trans	-68.3	-39.1	175.4	-115.3	-177.6	5.1	0	0	112.8	R385 E386 S387 A392 K393	R385-Q389 WeakPolarHBondContact O-CB 3.48Å; R385-Q389 PolarHBondContact O-N 3.04Å; E386-Q389 PolarHBondContact O-N 3.37Å; S387-Q389 VanDerWaalsContact C-N 3.32Å; S387-Q389 PolarHBondContact O-N 2.8Å; Q389-A392 PolarHBondContact O-N 2.8Å; Q389-K393 WeakPolarHBondContact O-CB 3.46Å; Q389-K393 WeakPolarHBondContact O-CG 3.36Å; Q389-K393 PolarHBondContact O-N 2.92Å
390	A	54.9	Low	57.5	Low	51 Å²	51	69.8 Å²	69.8	42%	0.421	38%	0.378	S	S	.	.	H	α-helix	trans	-67	-42.6	176.4	0	0	0	0	0	110.9	E386 S387 K393 L394	E386-A390 WeakPolarHBondContact O-CB 3.27Å; E386-A390 PolarHBondContact O-N 2.87Å; S387-A390 PolarHBondContact O-N 3.1Å; A390-K393 PolarHBondContact O-N 2.92Å; A390-L394 WeakPolarHBondContact O-CB 3.37Å; A390-L394 PolarHBondContact O-N 3.01Å
391	A	53.5	Low	57.7	Low	2 Å²	2	72 Å²	72	2%	0.017	38%	0.382	C	S	.	.	H	α-helix	trans	-61.1	-44.8	171.7	0	0	0	0	0	112.6	Q343 S387 K393 L394 A395 I436	Q343-A391 VanDerWaalsContact NE2-CA 3.27Å; S387-A391 WeakPolarHBondContact O-CB 3.46Å; S387-A391 PolarHBondContact O-N 3.18Å; A391-K393 VanDerWaalsContact C-N 3.33Å; A391-K393 PolarHBondContact O-N 3.21Å; A391-L394 PolarHBondContact O-N 3.36Å; A391-A395 WeakPolarHBondContact O-CB 3.11Å; A391-A395 PolarHBondContact O-N 3.24Å; A391-I436 HydrophobicContact CB-CB 4.5Å; A391-I436 HydrophobicContact CB-CD1 4.18Å; A391-I436 HydrophobicContact CB-CG2 3.47Å; A391-I436 VanDerWaalsContact CB-CG2 3.47Å
392	A	57.6	Low	57.4	Low	44 Å²	44	69.2 Å²	69.2	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-41.6	176.4	0	0	0	0	0	112.2	S388 Q389 A396 L433	S388-A392 VanDerWaalsContact O-CB 3.27Å; S388-A392 WeakPolarHBondContact O-CB 3.46Å; S388-A392 PolarHBondContact O-N 2.84Å; Q389-A392 PolarHBondContact O-N 2.8Å; A392-A396 VanDerWaalsContact O-CB 3.28Å; A392-A396 WeakPolarHBondContact O-CB 3.41Å; A392-A396 PolarHBondContact O-N 3.4Å; A392-L433 HydrophobicContact CB-CD2 4.31Å
393	K	61.4	Low	57.4	Low	146 Å²	146	71 Å²	71	64%	0.635	37%	0.366	S	S	*	.	H	α-helix	trans	-65.1	-39	175.3	-76.4	175	-178.3	174	0	112.1	Q389 A390 A391 A396 S397	Q389-K393 WeakPolarHBondContact O-CB 3.46Å; Q389-K393 WeakPolarHBondContact O-CG 3.36Å; Q389-K393 PolarHBondContact O-N 2.92Å; A390-K393 PolarHBondContact O-N 2.92Å; A391-K393 VanDerWaalsContact C-N 3.33Å; A391-K393 PolarHBondContact O-N 3.21Å; K393-A396 PolarHBondContact O-N 3.32Å; K393-S397 WeakPolarHBondContact O-CB 3.34Å; K393-S397 PolarHBondContact O-N 3.21Å
394	L	55.4	Low	57.6	Low	76 Å²	76	73.8 Å²	73.8	40%	0.398	38%	0.384	S	S	.	.	H	α-helix	trans	-71.7	-43.3	-179.9	-158.4	141.8	0	0	0	111.4	Q343 A390 A391 A396 S397 L398	Q343-L394 VanDerWaalsContact OE1-CD2 3.31Å; A390-L394 WeakPolarHBondContact O-CB 3.37Å; A390-L394 PolarHBondContact O-N 3.01Å; A391-L394 PolarHBondContact O-N 3.36Å; L394-A396 VanDerWaalsContact C-N 3.34Å; L394-A396 PolarHBondContact O-N 3.08Å; L394-S397 WeakPolarHBondContact O-CB 3.36Å; L394-S397 PolarHBondContact O-N 3.41Å; L394-S397 VanDerWaalsContact O-N 3.13Å; L394-L398 HydrophobicContact CD2-CD1 3.59Å; L394-L398 HydrophobicContact CD2-CG 4.15Å; L394-L398 PolarHBondContact O-N 3.45Å
395	A	55.6	Low	57.5	Low	11 Å²	11	76.5 Å²	76.5	9%	0.091	39%	0.388	C	S	.	.	H	α-helix	trans	-59.4	-43.2	171.7	0	0	0	0	0	111.9	A391 S397 L398 A399 I429 L433	A391-A395 WeakPolarHBondContact O-CB 3.11Å; A391-A395 PolarHBondContact O-N 3.24Å; A395-S397 VanDerWaalsContact C-N 3.31Å; A395-S397 PolarHBondContact O-N 3Å; A395-L398 PolarHBondContact O-N 3.18Å; A395-A399 WeakPolarHBondContact O-CB 3.39Å; A395-A399 PolarHBondContact O-N 2.87Å; A395-I429 HydrophobicContact CB-CG2 4.41Å; A395-L433 HydrophobicContact CB-CD1 4.19Å; A395-L433 HydrophobicContact CB-CD2 3.45Å; A395-L433 VanDerWaalsContact CB-CD2 3.45Å; A395-L433 HydrophobicContact CB-CG 3.77Å
396	A	59.6	Low	57.1	Low	39 Å²	39	67.8 Å²	67.8	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-67	-30.5	175.2	0	0	0	0	0	113.2	A392 K393 L394 R400	A392-A396 VanDerWaalsContact O-CB 3.28Å; A392-A396 WeakPolarHBondContact O-CB 3.41Å; A392-A396 PolarHBondContact O-N 3.4Å; K393-A396 PolarHBondContact O-N 3.32Å; L394-A396 VanDerWaalsContact C-N 3.34Å; L394-A396 PolarHBondContact O-N 3.08Å; A396-R400 PolarHBondContact O-N 2.96Å
397	S	59.4	Low	57.1	Low	66 Å²	66	68.1 Å²	68.1	46%	0.462	36%	0.357	S	S	.	.	H	α-helix	trans	-68.6	-46.5	172.5	178.9	0	0	0	0	111	K393 L394 A395 A399 R400 Q401	K393-S397 WeakPolarHBondContact O-CB 3.34Å; K393-S397 PolarHBondContact O-N 3.21Å; L394-S397 WeakPolarHBondContact O-CB 3.36Å; L394-S397 PolarHBondContact O-N 3.41Å; L394-S397 VanDerWaalsContact O-N 3.13Å; A395-S397 VanDerWaalsContact C-N 3.31Å; A395-S397 PolarHBondContact O-N 3Å; S397-A399 VanDerWaalsContact C-N 3.34Å; S397-A399 PolarHBondContact O-N 3.44Å; S397-R400 PolarHBondContact O-N 2.84Å; S397-Q401 PolarHBondContact O-N 3.39Å
398	L	56	Low	57.1	Low	38 Å²	38	70.7 Å²	70.7	20%	0.199	38%	0.381	C	S	.	.	H	α-helix	trans	-62.6	-40.7	175.7	-76.1	169.6	0	0	0	111.7	L336 A339 L394 A395 R400 Q401 A402	L336-L398 HydrophobicContact CD2-CD1 4.39Å; L336-L398 HydrophobicContact CG-CD1 4.49Å; A339-L398 HydrophobicContact CB-CD1 4.21Å; L394-L398 HydrophobicContact CD2-CD1 3.59Å; L394-L398 HydrophobicContact CD2-CG 4.15Å; L394-L398 PolarHBondContact O-N 3.45Å; A395-L398 PolarHBondContact O-N 3.18Å; L398-R400 VanDerWaalsContact C-N 3.33Å; L398-R400 PolarHBondContact O-N 3.01Å; L398-Q401 WeakPolarHBondContact O-CB 3.21Å; L398-Q401 PolarHBondContact O-N 3.49Å; L398-Q401 VanDerWaalsContact O-N 3.09Å; L398-A402 WeakPolarHBondContact O-CB 3.1Å; L398-A402 PolarHBondContact O-N 3.27Å
399	A	58.5	Low	56.7	Low	21 Å²	21	72.2 Å²	72.2	17%	0.174	39%	0.385	C	S	.	.	H	α-helix	trans	-55.7	-47.7	173.3	0	0	0	0	0	111.8	A395 S397 Q401 A402 Q403 I429	A395-A399 WeakPolarHBondContact O-CB 3.39Å; A395-A399 PolarHBondContact O-N 2.87Å; S397-A399 VanDerWaalsContact C-N 3.34Å; S397-A399 PolarHBondContact O-N 3.44Å; A399-Q401 VanDerWaalsContact C-N 3.32Å; A399-Q401 PolarHBondContact O-N 3.38Å; A399-A402 PolarHBondContact O-N 3.42Å; A399-Q403 WeakPolarHBondContact O-CB 3.3Å; A399-Q403 PolarHBondContact O-N 3.09Å; A399-I429 HydrophobicContact CB-CD1 3.6Å; A399-I429 HydrophobicContact CB-CG2 4.4Å
400	R	63.7	Low	56.1	Low	173 Å²	173	71.8 Å²	71.8	65%	0.653	39%	0.392	S	S	*	.	H	α-helix	trans	-63.5	-38.7	175.7	-83.4	-172.5	-100.6	-161.8	-7.6	112	A396 S397 L398 Q403 T404	A396-R400 PolarHBondContact O-N 2.96Å; S397-R400 PolarHBondContact O-N 2.84Å; L398-R400 VanDerWaalsContact C-N 3.33Å; L398-R400 PolarHBondContact O-N 3.01Å; R400-Q403 PolarHBondContact O-N 3.14Å; R400-T404 WeakPolarHBondContact O-CB 3.36Å; R400-T404 PolarHBondContact O-N 3.46Å; R400-T404 PolarHBondContact O-OG1 2.88Å
401	Q	56.9	Low	55.8	Low	102 Å²	102	75.3 Å²	75.3	48%	0.477	41%	0.414	S	S	.	.	H	α-helix	trans	-66	-44.6	178.1	-132.5	174.7	13.7	0	0	111.7	S397 L398 A399 T404 R405	S397-Q401 PolarHBondContact O-N 3.39Å; L398-Q401 WeakPolarHBondContact O-CB 3.21Å; L398-Q401 PolarHBondContact O-N 3.49Å; L398-Q401 VanDerWaalsContact O-N 3.09Å; A399-Q401 VanDerWaalsContact C-N 3.32Å; A399-Q401 PolarHBondContact O-N 3.38Å; Q401-T404 PolarHBondContact O-N 2.91Å; Q401-R405 WeakPolarHBondContact O-CG 3.34Å; Q401-R405 PolarHBondContact O-N 2.82Å
402	A	54.2	Low	55.3	Low	11 Å²	11	79.4 Å²	79.4	9%	0.091	44%	0.442	C	S	.	.	H	α-helix	trans	-61.1	-44.4	174.1	0	0	0	0	0	111.5	L398 A399 T404 R405 M406 F425	L398-A402 WeakPolarHBondContact O-CB 3.1Å; L398-A402 PolarHBondContact O-N 3.27Å; A399-A402 PolarHBondContact O-N 3.42Å; A402-T404 PolarHBondContact O-N 3Å; A402-R405 PolarHBondContact O-N 2.81Å; A402-M406 WeakPolarHBondContact O-CG 3.42Å; A402-M406 PolarHBondContact O-N 2.78Å; A402-F425 HydrophobicContact CB-CD1 4.4Å; A402-F425 HydrophobicContact CB-CG 4.5Å
403	Q	57.6	Low	54.7	Low	95 Å²	95	81.6 Å²	81.6	44%	0.444	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-42.5	177.6	-164.6	177.7	19.2	0	0	112.2	A399 R400 R405 M406 Q407	A399-Q403 WeakPolarHBondContact O-CB 3.3Å; A399-Q403 PolarHBondContact O-N 3.09Å; R400-Q403 PolarHBondContact O-N 3.14Å; Q403-R405 VanDerWaalsContact C-N 3.33Å; Q403-R405 PolarHBondContact O-N 2.99Å; Q403-M406 PolarHBondContact O-N 3.43Å; Q403-Q407 WeakPolarHBondContact O-CG 3.43Å; Q403-Q407 PolarHBondContact O-N 3.49Å
404	T	59.9	Low	54.2	Low	91 Å²	91	77.1 Å²	77.1	56%	0.558	43%	0.428	S	S	*	.	H	α-helix	trans	-66	-37.7	177.9	-48.2	0	0	0	0	111.1	R400 Q401 A402 Q407 A408	R400-T404 WeakPolarHBondContact O-CB 3.36Å; R400-T404 PolarHBondContact O-N 3.46Å; R400-T404 PolarHBondContact O-OG1 2.88Å; Q401-T404 PolarHBondContact O-N 2.91Å; A402-T404 PolarHBondContact O-N 3Å; T404-Q407 PolarHBondContact O-N 2.78Å; T404-A408 PolarHBondContact O-N 2.82Å
405	R	55.4	Low	54	Low	135 Å²	135	77.5 Å²	77.5	51%	0.509	44%	0.442	S	S	.	.	H	α-helix	trans	-72	-33.8	176.1	-72.9	-173.5	179.7	178.6	3.5	113	E332 Q401 A402 Q403 Q407 A408 L409	E332-R405 IonicContact OE1-NH1 3.03Å; E332-R405 PolarHBondContact OE1-NH1 2.87Å; E332-R405 IonicContact OE2-NH1 3.78Å; Q401-R405 WeakPolarHBondContact O-CG 3.34Å; Q401-R405 PolarHBondContact O-N 2.82Å; A402-R405 PolarHBondContact O-N 2.81Å; Q403-R405 VanDerWaalsContact C-N 3.33Å; Q403-R405 PolarHBondContact O-N 2.99Å; R405-Q407 VanDerWaalsContact C-N 3.32Å; R405-A408 WeakPolarHBondContact O-CB 3.44Å; R405-A408 PolarHBondContact O-N 2.8Å; R405-A408 VanDerWaalsContact O-N 3.13Å; R405-L409 PolarHBondContact O-N 2.81Å
406	M	52.6	Low	53.7	Low	10 Å²	10	83.8 Å²	83.8	5%	0.049	47%	0.469	C	S	.	.	H	α-helix	trans	-68.6	-31.1	171.5	-77.6	-171.9	-65.3	0	0	113	A402 Q403 A408 L409 N418 C421 N422 F425	A402-M406 WeakPolarHBondContact O-CG 3.42Å; A402-M406 PolarHBondContact O-N 2.78Å; Q403-M406 PolarHBondContact O-N 3.43Å; M406-A408 PolarHBondContact O-N 2.82Å; M406-L409 HydrophobicContact CG-CD1 4.4Å; M406-L409 WeakPolarHBondContact O-CB 3.46Å; M406-L409 PolarHBondContact O-N 2.76Å; M406-N418 PolarHBondContact O-ND2 3.34Å; M406-C421 HydrophobicContact SD-CB 3.68Å; M406-N422 HydrophobicContact CE-CB 4.26Å; M406-N422 VanDerWaalsContact CE-CG 3.42Å; M406-N422 WeakPolarHBondContact CE-OD1 3.12Å; M406-F425 HydrophobicContact CE-CD2 4.12Å; M406-F425 HydrophobicContact SD-CD2 3.74Å; M406-F425 HydrophobicContact SD-CE2 4.18Å
407	Q	56.3	Low	53.3	Low	142 Å²	142	84.3 Å²	84.3	66%	0.664	47%	0.466	S	S	*	.	H	α-helix	trans	-70	-22.5	170.7	-71.8	179.9	6.5	0	0	112.7	Q403 T404 R405 L409	Q403-Q407 WeakPolarHBondContact O-CG 3.43Å; Q403-Q407 PolarHBondContact O-N 3.49Å; T404-Q407 PolarHBondContact O-N 2.78Å; R405-Q407 VanDerWaalsContact C-N 3.32Å; Q407-L409 VanDerWaalsContact C-N 3.33Å
408	A	54.8	Low	53.1	Low	82 Å²	82	83.1 Å²	83.1	68%	0.678	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.6	173.4	0	0	0	0	0	113.5	T404 R405 M406	T404-A408 PolarHBondContact O-N 2.82Å; R405-A408 WeakPolarHBondContact O-CB 3.44Å; R405-A408 PolarHBondContact O-N 2.8Å; R405-A408 VanDerWaalsContact O-N 3.13Å; M406-A408 PolarHBondContact O-N 2.82Å
409	L	47.5	Very low	53.1	Low	70 Å²	70	85 Å²	85	37%	0.366	47%	0.471	S	S	.	.	S	Bend	trans	-66.4	137.3	169.2	-71.7	162.4	0	0	0	109.1	R405 M406 Q407 S411	R405-L409 PolarHBondContact O-N 2.81Å; M406-L409 HydrophobicContact CG-CD1 4.4Å; M406-L409 WeakPolarHBondContact O-CB 3.46Å; M406-L409 PolarHBondContact O-N 2.76Å; Q407-L409 VanDerWaalsContact C-N 3.33Å; L409-S411 PolarHBondContact O-N 2.99Å
410	P	47.4	Very low	52.9	Low	103 Å²	103	89.5 Å²	89.5	67%	0.669	49%	0.491	S	S	*	.			trans	-54.8	117.6	-172.6	19.3	-31.3	0	0	0	111.2	S412	P410-S412 PolarHBondContact O-N 2.74Å
411	S	48.6	Very low	52.5	Low	125 Å²	125	82 Å²	82	87%	0.874	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-3.1	-171	54.9	0	0	0	0	115.1	L409	L409-S411 PolarHBondContact O-N 2.99Å
412	S	43	Very low	52.5	Low	87 Å²	87	79.1 Å²	79.1	61%	0.608	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	9.6	-167.1	67.8	0	0	0	0	115.3	P410	P410-S412 PolarHBondContact O-N 2.74Å
413	H	45.9	Very low	52.8	Low	91 Å²	91	81.6 Å²	81.6	42%	0.421	47%	0.473	S	S	.	.	S	Bend	trans	-145.2	-12.1	-171.6	-119.6	-72.8	0	0	0	121.8	K31	K31-H413 PolarHBondContact NZ-CE1 2.8Å; K31-H413 VanDerWaalsContact NZ-CE1 3.3Å
414	D	50	Low	52.8	Low	51 Å²	51	82.1 Å²	82.1	27%	0.273	47%	0.474	S	S	.	.			trans	-159.8	80.7	173.9	-79.3	-52.4	0	0	0	113	R318 Q416 M417 N418	R318-D414 IonicContact CZ-OD1 2.92Å; R318-D414 IonicContact CZ-OD2 2.7Å; R318-D414 IonicContact NH1-OD1 3.97Å; R318-D414 IonicContact NH1-OD2 3.67Å; R318-D414 PolarHBondContact NH1-OD2 3.02Å; R318-D414 VanDerWaalsContact NH2-CG 3.33Å; R318-D414 IonicContact NH2-OD1 3.76Å; R318-D414 PolarHBondContact NH2-OD1 3.21Å; R318-D414 IonicContact NH2-OD2 2.71Å; R318-D414 PolarHBondContact NH2-OD2 2.9Å; D414-Q416 PolarHBondContact O-N 3.23Å; D414-M417 HydrophobicContact CB-CB 3.57Å; D414-M417 HydrophobicContact CB-CG 3.87Å; D414-M417 PolarHBondContact O-N 3.27Å; D414-N418 PolarHBondContact O-N 3.07Å
415	A	51.1	Low	52.7	Low	84 Å²	84	78.5 Å²	78.5	69%	0.694	45%	0.451	S	S	*	.	H	α-helix	trans	-60	-33.6	170.1	0	0	0	0	0	111.8	S419	A415-S419 WeakPolarHBondContact O-CB 3.29Å; A415-S419 PolarHBondContact O-N 2.63Å
416	Q	49.3	Very low	53.1	Low	144 Å²	144	76.1 Å²	76.1	67%	0.673	45%	0.448	S	S	*	.	H	α-helix	trans	-72.1	-40.2	176.7	-75	-173.7	-11.8	0	0	113.4	D414 N418 S419 L420	D414-Q416 PolarHBondContact O-N 3.23Å; Q416-N418 VanDerWaalsContact C-N 3.35Å; Q416-S419 WeakPolarHBondContact O-CB 3.01Å; Q416-S419 PolarHBondContact O-N 3.2Å; Q416-L420 PolarHBondContact O-N 3.16Å
417	M	51.4	Low	53.5	Low	49 Å²	49	77.1 Å²	77.1	24%	0.241	46%	0.461	C	S	.	.	H	α-helix	trans	-67.3	-38.4	172.6	-73.2	-70	-62.7	0	0	111.1	L322 M329 D414 S419 L420 C421	L322-M417 HydrophobicContact CD2-CE 4.48Å; M329-M417 HydrophobicContact CE-CE 4.4Å; D414-M417 HydrophobicContact CB-CB 3.57Å; D414-M417 HydrophobicContact CB-CG 3.87Å; D414-M417 PolarHBondContact O-N 3.27Å; M417-S419 VanDerWaalsContact C-N 3.27Å; M417-S419 PolarHBondContact O-N 3.13Å; M417-L420 PolarHBondContact O-N 3.28Å; M417-C421 WeakPolarHBondContact O-CB 3.02Å; M417-C421 PolarHBondContact O-N 3.3Å; M417-C421 PolarHBondContact O-SG 2.64Å
418	N	54.3	Low	53.6	Low	42 Å²	42	72.1 Å²	72.1	23%	0.225	44%	0.438	C	S	.	.	H	α-helix	trans	-64.5	-34.1	174.4	-112.8	1.2	0	0	0	111.8	M406 D414 Q416 N422	M406-N418 PolarHBondContact O-ND2 3.34Å; D414-N418 PolarHBondContact O-N 3.07Å; Q416-N418 VanDerWaalsContact C-N 3.35Å; N418-N422 VanDerWaalsContact O-CB 3.26Å; N418-N422 WeakPolarHBondContact O-CB 3.39Å; N418-N422 PolarHBondContact O-N 3.4Å; N418-N422 PolarHBondContact O-ND2 3.34Å
419	S	56.5	Low	54	Low	78 Å²	78	68.8 Å²	68.8	55%	0.545	41%	0.409	S	S	.	.	H	α-helix	trans	-66.8	-44.9	172.8	-177.5	0	0	0	0	112.3	A415 Q416 M417 N422 A423	A415-S419 WeakPolarHBondContact O-CB 3.29Å; A415-S419 PolarHBondContact O-N 2.63Å; Q416-S419 WeakPolarHBondContact O-CB 3.01Å; Q416-S419 PolarHBondContact O-N 3.2Å; M417-S419 VanDerWaalsContact C-N 3.27Å; M417-S419 PolarHBondContact O-N 3.13Å; S419-N422 PolarHBondContact O-N 2.99Å; S419-A423 WeakPolarHBondContact O-CB 3.13Å; S419-A423 PolarHBondContact O-N 2.81Å
420	L	54.4	Low	54.6	Low	115 Å²	115	68.4 Å²	68.4	60%	0.602	41%	0.412	S	S	*	.	H	α-helix	trans	-65.7	-43.5	177.5	-99	156.9	0	0	0	111.7	Q416 M417 A423 F424	Q416-L420 PolarHBondContact O-N 3.16Å; M417-L420 PolarHBondContact O-N 3.28Å; L420-A423 PolarHBondContact O-N 2.82Å; L420-F424 WeakPolarHBondContact O-CB 3.26Å; L420-F424 PolarHBondContact O-N 3.06Å
421	C	55.4	Low	55.1	Low	14 Å²	14	64.5 Å²	64.5	10%	0.095	39%	0.388	C	S	.	.	H	α-helix	trans	-62.6	-43.3	173.6	-70.2	0	0	0	0	111.2	M329 M406 M417 A423 F424 F425	M329-C421 VanDerWaalsContact SD-SG 3.62Å; M406-C421 HydrophobicContact SD-CB 3.68Å; M417-C421 WeakPolarHBondContact O-CB 3.02Å; M417-C421 PolarHBondContact O-N 3.3Å; M417-C421 PolarHBondContact O-SG 2.64Å; C421-A423 PolarHBondContact O-N 3.02Å; C421-F424 PolarHBondContact O-N 3.24Å; C421-F425 WeakPolarHBondContact O-CB 3.22Å; C421-F425 WeakPolarHBondContact O-CD2 3.47Å; C421-F425 PolarHBondContact O-N 2.85Å
422	N	58	Low	55.5	Low	42 Å²	42	59.9 Å²	59.9	23%	0.225	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-45.5	174.4	-90.9	-65.5	0	0	0	111.9	M406 N418 S419 N426	M406-N422 HydrophobicContact CE-CB 4.26Å; M406-N422 VanDerWaalsContact CE-CG 3.42Å; M406-N422 WeakPolarHBondContact CE-OD1 3.12Å; N418-N422 VanDerWaalsContact O-CB 3.26Å; N418-N422 WeakPolarHBondContact O-CB 3.39Å; N418-N422 PolarHBondContact O-N 3.4Å; N418-N422 PolarHBondContact O-ND2 3.34Å; S419-N422 PolarHBondContact O-N 2.99Å; N422-N426 VanDerWaalsContact O-CB 3.28Å; N422-N426 WeakPolarHBondContact O-CB 3.35Å; N422-N426 PolarHBondContact O-N 2.84Å; N422-N426 PolarHBondContact O-ND2 3.13Å; N422-N426 VanDerWaalsContact O-ND2 3.12Å
423	A	59.5	Low	56.2	Low	63 Å²	63	57.8 Å²	57.8	52%	0.521	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-44.4	177.7	0	0	0	0	0	111.3	S419 L420 C421 N426 G427	S419-A423 WeakPolarHBondContact O-CB 3.13Å; S419-A423 PolarHBondContact O-N 2.81Å; L420-A423 PolarHBondContact O-N 2.82Å; C421-A423 PolarHBondContact O-N 3.02Å; A423-N426 PolarHBondContact O-N 3.18Å; A423-G427 PolarHBondContact O-N 2.9Å
424	F	57.6	Low	56.9	Low	107 Å²	107	56 Å²	56	47%	0.469	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-49.7	177.6	-176.6	-96.2	0	0	0	112.1	V333 L420 C421 N426 G427 M428	V333-F424 HydrophobicContact CG2-CE1 4.19Å; L420-F424 WeakPolarHBondContact O-CB 3.26Å; L420-F424 PolarHBondContact O-N 3.06Å; C421-F424 PolarHBondContact O-N 3.24Å; F424-N426 PolarHBondContact O-N 3.48Å; F424-G427 PolarHBondContact O-N 3.14Å; F424-M428 HydrophobicContact CE1-SD 4.06Å; F424-M428 HydrophobicContact CZ-SD 4.43Å; F424-M428 WeakPolarHBondContact O-CB 3.42Å; F424-M428 PolarHBondContact O-N 2.65Å
425	F	57.9	Low	57.2	Low	14 Å²	14	61 Å²	61	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-62.3	-44.1	178.1	-83.6	-66.6	0	0	0	111.8	E332 A402 M406 C421 G427 M428 I429	E332-F425 HydrophobicContact CB-CE1 4.06Å; E332-F425 HydrophobicContact CB-CZ 3.89Å; E332-F425 HydrophobicContact CG-CZ 4.42Å; A402-F425 HydrophobicContact CB-CD1 4.4Å; A402-F425 HydrophobicContact CB-CG 4.5Å; M406-F425 HydrophobicContact CE-CD2 4.12Å; M406-F425 HydrophobicContact SD-CD2 3.74Å; M406-F425 HydrophobicContact SD-CE2 4.18Å; C421-F425 WeakPolarHBondContact O-CB 3.22Å; C421-F425 WeakPolarHBondContact O-CD2 3.47Å; C421-F425 PolarHBondContact O-N 2.85Å; F425-G427 VanDerWaalsContact C-N 3.34Å; F425-G427 PolarHBondContact O-N 3.22Å; F425-M428 HydrophobicContact CD1-CE 3.83Å; F425-M428 HydrophobicContact CE1-CE 4.07Å; F425-M428 PolarHBondContact O-N 3.25Å; F425-I429 WeakPolarHBondContact O-CB 3.25Å; F425-I429 VanDerWaalsContact O-CD1 3.26Å; F425-I429 WeakPolarHBondContact O-CD1 3.38Å; F425-I429 WeakPolarHBondContact O-CG1 3.46Å; F425-I429 PolarHBondContact O-N 3.26Å
426	N	64.1	Low	57.6	Low	85 Å²	85	60 Å²	60	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-64	-39.1	177.5	-73.4	-29.4	0	0	0	112.1	N422 A423 F424 S430	N422-N426 VanDerWaalsContact O-CB 3.28Å; N422-N426 WeakPolarHBondContact O-CB 3.35Å; N422-N426 PolarHBondContact O-N 2.84Å; N422-N426 PolarHBondContact O-ND2 3.13Å; N422-N426 VanDerWaalsContact O-ND2 3.12Å; A423-N426 PolarHBondContact O-N 3.18Å; F424-N426 PolarHBondContact O-N 3.48Å; N426-S430 WeakPolarHBondContact O-CB 3.42Å; N426-S430 PolarHBondContact O-N 3.25Å; N426-S430 PolarHBondContact O-OG 3.13Å
427	G	60.5	Low	58.2	Low	32 Å²	32	56.7 Å²	56.7	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-49.9	173.8	0	0	0	0	0	111.4	A423 F424 F425 I429 S430 A431	A423-G427 PolarHBondContact O-N 2.9Å; F424-G427 PolarHBondContact O-N 3.14Å; F425-G427 VanDerWaalsContact C-N 3.34Å; F425-G427 PolarHBondContact O-N 3.22Å; G427-I429 PolarHBondContact O-N 2.89Å; G427-S430 WeakPolarHBondContact O-CB 3.38Å; G427-S430 PolarHBondContact O-N 3.35Å; G427-S430 VanDerWaalsContact O-N 3.09Å; G427-A431 PolarHBondContact O-N 3.35Å
428	M	59.2	Low	58.6	Low	36 Å²	36	58.6 Å²	58.6	18%	0.177	34%	0.337	C	S	.	.	H	α-helix	trans	-62.1	-41.8	179.5	-153.9	-174.2	43.7	0	0	112.1	V333 L336 F424 F425 S430 A431 M432	V333-M428 HydrophobicContact CB-SD 4.49Å; V333-M428 HydrophobicContact CG1-SD 4.28Å; V333-M428 HydrophobicContact CG2-CE 4.13Å; V333-M428 HydrophobicContact CG2-SD 3.77Å; L336-M428 HydrophobicContact CD1-CE 3.93Å; F424-M428 HydrophobicContact CE1-SD 4.06Å; F424-M428 HydrophobicContact CZ-SD 4.43Å; F424-M428 WeakPolarHBondContact O-CB 3.42Å; F424-M428 PolarHBondContact O-N 2.65Å; F425-M428 HydrophobicContact CD1-CE 3.83Å; F425-M428 HydrophobicContact CE1-CE 4.07Å; F425-M428 PolarHBondContact O-N 3.25Å; M428-S430 VanDerWaalsContact C-N 3.31Å; M428-S430 PolarHBondContact O-N 3.16Å; M428-A431 PolarHBondContact O-N 2.89Å; M428-M432 HydrophobicContact CB-CE 4.25Å; M428-M432 HydrophobicContact CE-CE 4.05Å; M428-M432 HydrophobicContact CG-CE 3.79Å; M428-M432 WeakPolarHBondContact O-CB 3.5Å; M428-M432 WeakPolarHBondContact O-CE 3.4Å; M428-M432 PolarHBondContact O-N 3.1Å; M428-M432 HydrophobicContact SD-CE 4.34Å
429	I	62.5	Low	58.6	Low	13 Å²	13	61.9 Å²	61.9	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-39.7	175	-69.9	158.8	0	0	0	110.9	A395 A399 F425 G427 M432 L433	A395-I429 HydrophobicContact CB-CG2 4.41Å; A399-I429 HydrophobicContact CB-CD1 3.6Å; A399-I429 HydrophobicContact CB-CG2 4.4Å; F425-I429 WeakPolarHBondContact O-CB 3.25Å; F425-I429 VanDerWaalsContact O-CD1 3.26Å; F425-I429 WeakPolarHBondContact O-CD1 3.38Å; F425-I429 WeakPolarHBondContact O-CG1 3.46Å; F425-I429 PolarHBondContact O-N 3.26Å; G427-I429 PolarHBondContact O-N 2.89Å; I429-M432 PolarHBondContact O-N 2.71Å; I429-L433 HydrophobicContact CG2-CD1 4.1Å; I429-L433 WeakPolarHBondContact O-CB 3.48Å; I429-L433 VanDerWaalsContact O-CG 3.32Å; I429-L433 WeakPolarHBondContact O-CG 3.36Å; I429-L433 PolarHBondContact O-N 3.32Å
430	S	61	Low	58.2	Low	61 Å²	61	64 Å²	64	43%	0.427	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-47.1	176.3	-56.9	0	0	0	0	111.1	N426 G427 M428 M432 L433 D434	N426-S430 WeakPolarHBondContact O-CB 3.42Å; N426-S430 PolarHBondContact O-N 3.25Å; N426-S430 PolarHBondContact O-OG 3.13Å; G427-S430 WeakPolarHBondContact O-CB 3.38Å; G427-S430 PolarHBondContact O-N 3.35Å; G427-S430 VanDerWaalsContact O-N 3.09Å; M428-S430 VanDerWaalsContact C-N 3.31Å; M428-S430 PolarHBondContact O-N 3.16Å; S430-M432 VanDerWaalsContact C-N 3.28Å; S430-M432 PolarHBondContact O-N 3.39Å; S430-L433 WeakPolarHBondContact O-CB 3.43Å; S430-L433 PolarHBondContact O-N 3.44Å; S430-L433 VanDerWaalsContact O-N 3.09Å; S430-D434 PolarHBondContact O-N 2.96Å
431	A	56.3	Low	57.7	Low	21 Å²	21	67.6 Å²	67.6	17%	0.174	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-37.7	175.6	0	0	0	0	0	112.4	G427 M428 D434 R435	G427-A431 PolarHBondContact O-N 3.35Å; M428-A431 PolarHBondContact O-N 2.89Å; A431-D434 PolarHBondContact O-N 3.17Å; A431-R435 WeakPolarHBondContact O-CB 3.43Å; A431-R435 PolarHBondContact O-N 3.43Å
432	M	58	Low	57.1	Low	28 Å²	28	73 Å²	73	14%	0.138	39%	0.392	C	S	.	.	H	α-helix	trans	-69.9	-38	174.4	-80.5	-179.1	-72.3	0	0	113	L336 V340 M428 I429 S430 D434 R435 I436	L336-M432 HydrophobicContact CD1-CE 4.04Å; L336-M432 HydrophobicContact CD2-CE 3.12Å; L336-M432 HydrophobicContact CD2-SD 3.27Å; L336-M432 WeakPolarHBondContact CD2-SD 3.48Å; L336-M432 HydrophobicContact CG-CE 4.11Å; V340-M432 HydrophobicContact CG2-CG 4.35Å; V340-M432 HydrophobicContact CG2-SD 3.61Å; M428-M432 HydrophobicContact CB-CE 4.25Å; M428-M432 HydrophobicContact CE-CE 4.05Å; M428-M432 HydrophobicContact CG-CE 3.79Å; M428-M432 WeakPolarHBondContact O-CB 3.5Å; M428-M432 WeakPolarHBondContact O-CE 3.4Å; M428-M432 PolarHBondContact O-N 3.1Å; M428-M432 HydrophobicContact SD-CE 4.34Å; I429-M432 PolarHBondContact O-N 2.71Å; S430-M432 VanDerWaalsContact C-N 3.28Å; S430-M432 PolarHBondContact O-N 3.39Å; M432-D434 VanDerWaalsContact C-N 3.32Å; M432-R435 PolarHBondContact O-N 2.97Å; M432-I436 WeakPolarHBondContact O-CD1 3.24Å; M432-I436 VanDerWaalsContact O-CG1 3.22Å; M432-I436 WeakPolarHBondContact O-CG1 3.42Å; M432-I436 PolarHBondContact O-N 3.4Å
433	L	58.6	Low	56.1	Low	44 Å²	44	72.6 Å²	72.6	23%	0.23	39%	0.392	C	S	.	.	H	α-helix	trans	-62.7	-39.8	171.8	-78.7	168.6	0	0	0	111.8	A392 A395 I429 S430 I436 N437	A392-L433 HydrophobicContact CB-CD2 4.31Å; A395-L433 HydrophobicContact CB-CD1 4.19Å; A395-L433 HydrophobicContact CB-CD2 3.45Å; A395-L433 VanDerWaalsContact CB-CD2 3.45Å; A395-L433 HydrophobicContact CB-CG 3.77Å; I429-L433 HydrophobicContact CG2-CD1 4.1Å; I429-L433 WeakPolarHBondContact O-CB 3.48Å; I429-L433 VanDerWaalsContact O-CG 3.32Å; I429-L433 WeakPolarHBondContact O-CG 3.36Å; I429-L433 PolarHBondContact O-N 3.32Å; S430-L433 WeakPolarHBondContact O-CB 3.43Å; S430-L433 PolarHBondContact O-N 3.44Å; S430-L433 VanDerWaalsContact O-N 3.09Å; L433-I436 PolarHBondContact O-N 3.4Å; L433-N437 WeakPolarHBondContact O-CB 3.44Å; L433-N437 PolarHBondContact O-N 3.3Å; L433-N437 PolarHBondContact O-ND2 3.46Å; L433-N437 VanDerWaalsContact O-ND2 3.12Å
434	D	60	Low	55.1	Low	53 Å²	53	76.2 Å²	76.2	28%	0.283	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-41.1	177.1	-72	-28.7	0	0	0	111.5	S430 A431 M432 N437 A438 K439	S430-D434 PolarHBondContact O-N 2.96Å; A431-D434 PolarHBondContact O-N 3.17Å; M432-D434 VanDerWaalsContact C-N 3.32Å; D434-N437 CarbonylContact O-C 3.57Å; D434-N437 PolarHBondContact O-N 3.11Å; D434-A438 PolarHBondContact O-N 3.41Å; D434-K439 HydrophobicContact CB-CB 4.35Å; D434-K439 PolarHBondContact O-N 2.83Å
435	R	56.5	Low	54	Low	157 Å²	157	77.9 Å²	77.9	59%	0.592	44%	0.441	S	S	*	.	H	α-helix	trans	-58.4	-46.2	170.1	-94.7	-178.2	148.9	169.1	0.7	113.1	A431 M432 N437 A438 E440	A431-R435 WeakPolarHBondContact O-CB 3.43Å; A431-R435 PolarHBondContact O-N 3.43Å; M432-R435 PolarHBondContact O-N 2.97Å; R435-N437 VanDerWaalsContact C-N 3.27Å; R435-N437 PolarHBondContact O-N 3.09Å; R435-A438 PolarHBondContact O-N 2.62Å; R435-A438 VanDerWaalsContact O-N 3.1Å; R435-E440 HydrophobicContact CG-CG 3.67Å; R435-E440 IonicContact CZ-OE1 2.99Å; R435-E440 IonicContact NE-OE1 3.57Å; R435-E440 PolarHBondContact NE-OE1 3.05Å; R435-E440 IonicContact NH2-OE1 3.68Å; R435-E440 PolarHBondContact NH2-OE1 3.29Å
436	I	57.8	Low	53.8	Low	61 Å²	61	81.1 Å²	81.1	31%	0.313	46%	0.46	S	S	.	.	H	α-helix	trans	-66.3	-32.8	179.7	-65.8	162.6	0	0	0	111.3	A391 M432 L433 A438	A391-I436 HydrophobicContact CB-CB 4.5Å; A391-I436 HydrophobicContact CB-CD1 4.18Å; A391-I436 HydrophobicContact CB-CG2 3.47Å; A391-I436 VanDerWaalsContact CB-CG2 3.47Å; M432-I436 WeakPolarHBondContact O-CD1 3.24Å; M432-I436 VanDerWaalsContact O-CG1 3.22Å; M432-I436 WeakPolarHBondContact O-CG1 3.42Å; M432-I436 PolarHBondContact O-N 3.4Å; L433-I436 PolarHBondContact O-N 3.4Å; I436-A438 PolarHBondContact O-N 3.28Å
437	N	62.4	Low	53.2	Low	75 Å²	75	80.9 Å²	80.9	40%	0.401	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	9.9	175.5	-69.4	-37.8	0	0	0	113.9	S388 L433 D434 R435 K439	S388-N437 PolarHBondContact OG-OD1 3.28Å; L433-N437 WeakPolarHBondContact O-CB 3.44Å; L433-N437 PolarHBondContact O-N 3.3Å; L433-N437 PolarHBondContact O-ND2 3.46Å; L433-N437 VanDerWaalsContact O-ND2 3.12Å; D434-N437 CarbonylContact O-C 3.57Å; D434-N437 PolarHBondContact O-N 3.11Å; R435-N437 VanDerWaalsContact C-N 3.27Å; R435-N437 PolarHBondContact O-N 3.09Å; N437-K439 PolarHBondContact O-N 2.86Å
438	A	59.6	Low	52.8	Low	90 Å²	90	83.6 Å²	83.6	74%	0.744	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	30.9	-177.8	0	0	0	0	0	114.1	D434 R435 I436 E440	D434-A438 PolarHBondContact O-N 3.41Å; R435-A438 PolarHBondContact O-N 2.62Å; R435-A438 VanDerWaalsContact O-N 3.1Å; I436-A438 PolarHBondContact O-N 3.28Å; A438-E440 VanDerWaalsContact C-N 3.3Å; A438-E440 PolarHBondContact O-N 3.37Å
439	K	55.1	Low	52.5	Low	111 Å²	111	86.4 Å²	86.4	48%	0.483	49%	0.485	S	S	.	.			trans	-94.6	40.6	169.9	-67.3	-169.3	174.4	-169.2	0	111.8	D434 N437 E441 D442	D434-K439 HydrophobicContact CB-CB 4.35Å; D434-K439 PolarHBondContact O-N 2.83Å; N437-K439 PolarHBondContact O-N 2.86Å; K439-E441 PolarHBondContact O-N 2.95Å; K439-E441 VanDerWaalsContact O-N 3.15Å; K439-D442 PolarHBondContact O-N 3.43Å; K439-D442 VanDerWaalsContact O-N 3.13Å
440	E	48.5	Very low	51.8	Low	123 Å²	123	91 Å²	91	58%	0.575	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	-176.7	-95	-168.7	142.7	0	0	113.4	R435 A438 D442	R435-E440 HydrophobicContact CG-CG 3.67Å; R435-E440 IonicContact CZ-OE1 2.99Å; R435-E440 IonicContact NE-OE1 3.57Å; R435-E440 PolarHBondContact NE-OE1 3.05Å; R435-E440 IonicContact NH2-OE1 3.68Å; R435-E440 PolarHBondContact NH2-OE1 3.29Å; A438-E440 VanDerWaalsContact C-N 3.3Å; A438-E440 PolarHBondContact O-N 3.37Å; E440-D442 VanDerWaalsContact C-N 3.33Å; E440-D442 PolarHBondContact O-N 3.31Å
441	E	44.3	Very low	51.2	Low	190 Å²	190	93 Å²	93	89%	0.888	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.2	178	-66.5	-167.6	165.5	0	0	114	K439	K439-E441 PolarHBondContact O-N 2.95Å; K439-E441 VanDerWaalsContact O-N 3.15Å
442	D	42.3	Very low	50.9	Low	128 Å²	128	98.1 Å²	98.1	68%	0.684	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-10.6	178.4	-73.5	-30.8	0	0	0	113	K439 E440 V444	K439-D442 PolarHBondContact O-N 3.43Å; K439-D442 VanDerWaalsContact O-N 3.13Å; E440-D442 VanDerWaalsContact C-N 3.33Å; E440-D442 PolarHBondContact O-N 3.31Å; D442-V444 PolarHBondContact O-N 2.97Å; D442-V444 VanDerWaalsContact O-N 3.11Å
443	S	37.5	Very low	50.3	Low	33 Å²	33	103.5 Å²	103.5	23%	0.231	57%	0.573	C	S	.	*			trans	-89.8	66.9	-171.3	172.7	0	0	0	0	112.5
444	V	38.2	Very low	49.6	Very low	138 Å²	138	108.5 Å²	108.5	84%	0.836	60%	0.601	S	S	*	*			trans	-101.9	-7.5	172.1	-179.5	0	0	0	0	112.6	D442	D442-V444 PolarHBondContact O-N 2.97Å; D442-V444 VanDerWaalsContact O-N 3.11Å
445	A	33.6	Very low	48.7	Very low	143 Å²	143	113.5 Å²	113.5	100%	1.182	63%	0.63	S	S	*	*			trans	-86.3	0	-170.7	0	0	0	0	0	114.9

Retrieved 445 of 445 residues in 209.8 ms (Link to these results)

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