A0A096NIG9_PAPAN Loading...

Glutamine amidotransferase class 1 domain containing 3

AlphaFold DB (H9Z1N5), UniProt , Accession A0A096NIG9, Species PAPAN (Papio anubis, Olive baboon), Gene GATD3, Length 268 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	40.8	Very low	34.2	Very low	240 Å²	240	142.2 Å²	142.2	100%	1.182	83%	0.826	S	S	*	*				0	98	0	-62.1	-165.5	-160	0	0	106.2
2	A	30.7	Very low	34.1	Very low	102 Å²	102	144.5 Å²	144.5	84%	0.843	83%	0.831	S	S	*	*				59.6	130.9	78.6	0	0	0	0	0	110.6
3	A	31.6	Very low	34.2	Very low	90 Å²	90	141.5 Å²	141.5	74%	0.744	84%	0.835	S	S	*	*			cis	-169.3	138.9	11.6	0	0	0	0	0	105.1
4	V	31.7	Very low	34.3	Very low	130 Å²	130	138.4 Å²	138.4	79%	0.788	83%	0.832	S	S	*	*				67.7	136.3	76.5	175.2	0	0	0	0	115.6
5	R	34.7	Very low	34.4	Very low	224 Å²	224	135.3 Å²	135.3	85%	0.845	83%	0.827	S	S	*	*			trans	97.2	120.7	160.5	-86.7	159.1	174.9	-161.1	-2.7	117.2
6	A	33.2	Very low	34.5	Very low	84 Å²	84	134.1 Å²	134.1	69%	0.694	83%	0.827	S	S	*	*			cis	88.2	144.1	32.8	0	0	0	0	0	116.2
7	L	33.8	Very low	34.7	Very low	145 Å²	145	132.4 Å²	132.4	76%	0.759	83%	0.829	S	S	*	*			trans	89.6	112.8	164.1	-67	125.4	0	0	0	116.9
8	V	34.6	Very low	34.8	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	83%	0.833	S	S	*	*				72.1	125.5	74.4	176.1	0	0	0	0	112.6
9	G	31.2	Very low	35	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	84%	0.837	S	S	*	*			trans	-176.2	97.2	168.1	0	0	0	0	0	113
10	S	35.9	Very low	35	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	83%	0.828	S	S	*	*			trans	-83	160.8	172.9	-29.6	0	0	0	0	112.5
11	R	37.7	Very low	35.1	Very low	233 Å²	233	134.5 Å²	134.5	88%	0.879	83%	0.83	S	S	*	*			trans	143.8	115.2	138.7	-79.2	176	-178.8	-134.1	0.6	111.2
12	L	33.8	Very low	35	Very low	170 Å²	170	127.8 Å²	127.8	89%	0.89	81%	0.806	S	S	*	*				67.9	111.3	85.1	-102.1	145.3	0	0	0	114.4
13	A	35	Very low	35.9	Very low	106 Å²	106	129 Å²	129	88%	0.876	81%	0.805	S	S	*	*			trans	-162.5	137.7	139.1	0	0	0	0	0	110.5
14	A	36.2	Very low	36.3	Very low	97 Å²	97	128.8 Å²	128.8	80%	0.802	81%	0.812	S	S	*	*			trans	-109.2	159.7	-175.3	0	0	0	0	0	111.5
15	A	34.8	Very low	36.5	Very low	92 Å²	92	125.9 Å²	125.9	76%	0.76	81%	0.808	S	S	*	*			trans	168.2	109.3	142.7	0	0	0	0	0	107.8
16	S	36.5	Very low	36.9	Very low	117 Å²	117	127.4 Å²	127.4	82%	0.818	81%	0.814	S	S	*	*				73.5	109.9	81.7	-66	0	0	0	0	114.4
17	A	38.5	Very low	37.6	Very low	104 Å²	104	129.6 Å²	129.6	86%	0.86	82%	0.819	S	S	*	*			trans	-145.7	127.1	149.6	0	0	0	0	0	109.8
18	F	35.9	Very low	38	Very low	207 Å²	207	128.3 Å²	128.3	91%	0.908	82%	0.819	S	S	*	*			trans	-70.5	148.1	180	-84.6	-105.1	0	0	0	112.7
19	A	38.4	Very low	38.6	Very low	109 Å²	109	127 Å²	127	90%	0.901	82%	0.816	S	S	*	*			trans	-157.6	141.2	140.5	0	0	0	0	0	110
20	S	35.2	Very low	39.4	Very low	96 Å²	96	132.2 Å²	132.2	67%	0.671	82%	0.819	S	S	*	*			trans	-110.8	148.3	-161	59	0	0	0	0	113.8
21	L	38.1	Very low	39.9	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	83%	0.825	S	S	*	*			trans	58.1	144.3	143.2	-59.9	161.4	0	0	0	118.4
22	S	37.9	Very low	40.5	Very low	98 Å²	98	131.2 Å²	131.2	69%	0.685	82%	0.818	S	S	*	*			cis	-173.5	-158.6	-6.4	-97	0	0	0	0	105.7
23	P	50.3	Low	41	Very low	128 Å²	128	126.7 Å²	126.7	83%	0.831	81%	0.805	S	S	*	*				-117.5	167.1	-81.8	37.2	-21.1	0	0	0	113.1
24	G	39.3	Very low	41.8	Very low	86 Å²	86	128.5 Å²	128.5	89%	0.887	80%	0.799	S	S	*	*			trans	113.8	100.7	154	0	0	0	0	0	116
25	G	35.1	Very low	42.4	Very low	68 Å²	68	132 Å²	132	70%	0.701	80%	0.798	S	S	*	*			trans	-172.1	97.9	166.3	0	0	0	0	0	109.5	T27	G25-T27 PolarHBondContact O-N 3.15Å
26	R	44.3	Very low	43	Very low	257 Å²	257	135 Å²	135	97%	0.97	80%	0.8	S	S	*	*			trans	-63.2	113	172.8	-72.2	177.2	175.6	-175	-1.7	108.4
27	T	46.3	Very low	44	Very low	129 Å²	129	134.4 Å²	134.4	79%	0.791	80%	0.796	S	S	*	*			trans	-81.8	133	167.1	47.5	0	0	0	0	109.1	G25 S29	G25-T27 PolarHBondContact O-N 3.15Å; T27-S29 PolarHBondContact O-N 2.84Å
28	P	43	Very low	44.9	Very low	119 Å²	119	133.3 Å²	133.3	77%	0.773	79%	0.788	S	S	*	*			trans	-71.7	124	174.6	27.3	-28.4	0	0	0	108.8	Q30	P28-Q30 PolarHBondContact O-N 3.44Å
29	S	46.4	Very low	46.1	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	78%	0.783	S	S	*	*			trans	-57.7	103.6	168	172.7	0	0	0	0	108.8	T27 R31	T27-S29 PolarHBondContact O-N 2.84Å; S29-R31 VanDerWaalsContact C-N 3.31Å; S29-R31 PolarHBondContact O-N 3.38Å
30	Q	49.8	Very low	47.3	Very low	188 Å²	188	131.3 Å²	131.3	88%	0.879	77%	0.773	S	S	*	*			trans	-68.2	95.7	162.1	-79.1	-178.7	-19.4	0	0	107	P28 A32	P28-Q30 PolarHBondContact O-N 3.44Å; Q30-A32 VanDerWaalsContact C-N 3.28Å; Q30-A32 PolarHBondContact O-N 3.29Å
31	R	46.3	Very low	49.2	Very low	229 Å²	229	130.9 Å²	130.9	86%	0.864	77%	0.768	S	S	*	*			trans	-63.9	97.8	159.8	-79.5	-176.8	173.7	-176.1	-2.1	106.8	S29 A33	S29-R31 VanDerWaalsContact C-N 3.31Å; S29-R31 PolarHBondContact O-N 3.38Å; R31-A33 PolarHBondContact O-N 3.24Å
32	A	48.9	Very low	51.7	Low	87 Å²	87	124.7 Å²	124.7	72%	0.719	74%	0.74	S	S	*	*			trans	-56.8	110	163.5	0	0	0	0	0	107	Q30 I34	Q30-A32 VanDerWaalsContact C-N 3.28Å; Q30-A32 PolarHBondContact O-N 3.29Å; A32-I34 VanDerWaalsContact C-N 3.34Å; A32-I34 PolarHBondContact O-N 3.26Å
33	A	45.1	Very low	54.6	Low	76 Å²	76	120.4 Å²	120.4	63%	0.628	71%	0.711	S	S	*	*			trans	-66.4	99.6	170	0	0	0	0	0	106.8	R31 H35	R31-A33 PolarHBondContact O-N 3.24Å; A33-H35 PolarHBondContact O-N 3.37Å
34	I	52.5	Low	56.8	Low	143 Å²	143	118.9 Å²	118.9	73%	0.733	69%	0.692	S	S	*	*			trans	-71.3	90.8	169.2	-38.5	174.7	0	0	0	104.7	A32 L36	A32-I34 VanDerWaalsContact C-N 3.34Å; A32-I34 PolarHBondContact O-N 3.26Å; I34-L36 HydrophobicContact CG2-CG 4.28Å; I34-L36 PolarHBondContact O-N 2.76Å
35	H	48.1	Very low	59.7	Low	170 Å²	170	114.8 Å²	114.8	79%	0.787	65%	0.649	S	S	*	*			trans	-65.8	88.3	166.4	-80.8	-80.2	0	0	0	106.9	A33 S37	A33-H35 PolarHBondContact O-N 3.37Å; H35-S37 PolarHBondContact O-N 3.27Å
36	L	47.6	Very low	62.7	Low	156 Å²	156	111.6 Å²	111.6	82%	0.817	62%	0.616	S	S	*	*			trans	-68.9	85.7	162.6	-77.2	153.5	0	0	0	106.1	I34 A38	I34-L36 HydrophobicContact CG2-CG 4.28Å; I34-L36 PolarHBondContact O-N 2.76Å; L36-A38 PolarHBondContact O-N 3.18Å
37	S	57	Low	65.3	Low	104 Å²	104	99.3 Å²	99.3	73%	0.727	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-57.1	131.2	161.7	38.5	0	0	0	0	107.4	H35	H35-S37 PolarHBondContact O-N 3.27Å
38	A	57.1	Low	67.8	Low	82 Å²	82	93.2 Å²	93.2	68%	0.678	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-52.2	136.6	168.7	0	0	0	0	0	108	L36 Q40	L36-A38 PolarHBondContact O-N 3.18Å; A38-Q40 PolarHBondContact O-N 2.67Å
39	P	61.4	Low	70.5	Confident	126 Å²	126	87.5 Å²	87.5	82%	0.818	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-55.1	120	177.9	19.7	-28.8	0	0	0	108.1
40	Q	63.1	Low	73	Confident	147 Å²	147	82.5 Å²	82.5	69%	0.687	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-60.3	137.9	174.2	-73.9	-163.9	-73.7	0	0	108.3	A38 A42 K268	A38-Q40 PolarHBondContact O-N 2.67Å; Q40-A42 PolarHBondContact O-N 2.65Å; Q40-K268 WeakPolarHBondContact CB-OXT 3.35Å; Q40-K268 PolarHBondContact NE2-OXT 3.05Å; Q40-K268 VanDerWaalsContact NE2-OXT 3.07Å; Q40-K268 PolarHBondContact OE1-OXT 3.29Å
41	P	76.8	Confident	75.3	Confident	87 Å²	87	73.6 Å²	73.6	57%	0.565	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-60.7	127.4	-178.9	22.5	-29.9	0	0	0	109.3	A43 K268	P41-A43 PolarHBondContact O-N 3.25Å; P41-K268 HydrophobicContact CG-CD 4.41Å; P41-K268 WeakPolarHBondContact O-CD 3.23Å
42	A	90.6	Very high	77.8	Confident	33 Å²	33	64 Å²	64	27%	0.273	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-55.5	138.9	178.7	0	0	0	0	0	111.5	Q40 K44 G74 E76	Q40-A42 PolarHBondContact O-N 2.65Å; A42-K44 PolarHBondContact O-N 2.84Å; A42-G74 WeakPolarHBondContact CB-O 3.33Å; A42-E76 HydrophobicContact CB-CG 4Å
43	A	97	Very high	80.2	Confident	9 Å²	9	60 Å²	60	7%	0.074	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-67.5	128.5	171.2	0	0	0	0	0	110.3	P41 V45 A75 E76 L263 T266	P41-A43 PolarHBondContact O-N 3.25Å; A43-V45 HydrophobicContact CB-CG2 4.37Å; A43-A75 CarbonylContact O-C 3.58Å; A43-A75 VanDerWaalsContact O-CA 3.29Å; A43-A75 WeakPolarHBondContact O-CA 3.22Å; A43-A75 WeakPolarHBondContact O-CB 3.16Å; A43-E76 PolarHBondContact O-N 3.28Å; A43-L263 HydrophobicContact CB-CD2 3.88Å; A43-T266 HydrophobicContact CB-CG2 4.29Å
44	K	98.4	Very high	82.7	Confident	96 Å²	96	58.5 Å²	58.5	42%	0.417	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	109.3	173.9	-68.8	-177.3	178.3	-176	0	109.4	A42 E76 H128 D129 A130	A42-K44 PolarHBondContact O-N 2.84Å; K44-E76 CarbonylContact C-O 3.55Å; K44-E76 WeakPolarHBondContact CA-O 3.33Å; K44-E76 WeakPolarHBondContact CE-OE2 3.4Å; K44-E76 HydrophobicContact CG-CB 4.19Å; K44-H128 CarbonylContact O-C 3.38Å; K44-D129 PolarHBondContact N-OD2 3.47Å; K44-D129 PolarHBondContact O-N 2.97Å; K44-A130 PolarHBondContact O-N 3.47Å
45	V	98.8	Very high	84.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.9	-174.9	-177.4	0	0	0	0	110.3	A43 L70 A75 E76 V77 Q78 A130 I132 L263	A43-V45 HydrophobicContact CB-CG2 4.37Å; V45-L70 HydrophobicContact CB-CD1 4.41Å; V45-L70 HydrophobicContact CB-CD2 4.03Å; V45-L70 HydrophobicContact CG1-CD1 4.04Å; V45-L70 HydrophobicContact CG1-CD2 3.93Å; V45-L70 HydrophobicContact CG2-CD2 3.83Å; V45-A75 HydrophobicContact CG2-CB 4.05Å; V45-E76 PolarHBondContact N-O 3.32Å; V45-V77 WeakPolarHBondContact O-CA 3.14Å; V45-Q78 PolarHBondContact O-N 2.72Å; V45-A130 HydrophobicContact CG1-CB 4.31Å; V45-A130 HydrophobicContact CG2-CB 4.18Å; V45-I132 HydrophobicContact CG1-CD1 3.95Å; V45-I132 HydrophobicContact CG1-CG1 3.94Å; V45-L263 HydrophobicContact CG2-CD2 3.97Å
46	A	98.9	Very high	87.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.9	169.5	0	0	0	0	0	109.7	Q78 F80 L123 A130 A131 I132 F166	A46-Q78 CarbonylContact C-O 3.55Å; A46-Q78 WeakPolarHBondContact CA-O 3.3Å; A46-F80 HydrophobicContact CB-CD2 4.07Å; A46-F80 HydrophobicContact CB-CE2 3.93Å; A46-L123 HydrophobicContact CB-CD1 3.68Å; A46-L123 HydrophobicContact CB-CD2 3.85Å; A46-L123 HydrophobicContact CB-CG 4.46Å; A46-A130 PolarHBondContact N-O 2.92Å; A46-A131 HydrophobicContact CB-CB 4.47Å; A46-A131 CarbonylContact O-C 3.58Å; A46-A131 WeakPolarHBondContact O-CA 3.49Å; A46-I132 PolarHBondContact O-N 2.79Å; A46-F166 HydrophobicContact CB-CZ 4.23Å
47	L	98.9	Very high	89.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	116	172.4	-177.7	64.5	0	0	0	109.3	L49 I66 L67 V77 Q78 I79 F80 I132 P134	L47-L49 HydrophobicContact CD2-CD2 4.05Å; L47-L49 HydrophobicContact CG-CD2 3.9Å; L47-I66 HydrophobicContact CD1-CD1 4.47Å; L47-I66 HydrophobicContact CD1-CG2 3.73Å; L47-L67 HydrophobicContact CD2-CD1 4.4Å; L47-L67 HydrophobicContact CD2-CD2 3.68Å; L47-L67 HydrophobicContact CD2-CG 3.88Å; L47-V77 HydrophobicContact CB-CG1 4Å; L47-Q78 PolarHBondContact N-O 3.28Å; L47-I79 HydrophobicContact CB-CG1 4.31Å; L47-I79 HydrophobicContact CD2-CG1 4.32Å; L47-I79 CarbonylContact O-C 3.33Å; L47-I79 WeakPolarHBondContact O-CA 3.47Å; L47-F80 PolarHBondContact O-N 3.23Å; L47-I132 HydrophobicContact CD1-CB 4.16Å; L47-I132 HydrophobicContact CD1-CG2 4.14Å; L47-P134 HydrophobicContact CD1-CG 3.77Å
48	V	98.9	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116	-176.6	-176.1	0	0	0	0	110.4	F80 L120 L123 I132 F133 P134	V48-F80 CarbonylContact C-O 3.5Å; V48-F80 WeakPolarHBondContact CA-O 3.38Å; V48-F80 HydrophobicContact CG2-CB 4.48Å; V48-L120 HydrophobicContact CB-CD1 4.48Å; V48-L120 HydrophobicContact CG1-CD1 3.79Å; V48-L120 HydrophobicContact CG1-CD2 4.05Å; V48-L120 HydrophobicContact CG2-CD1 3.84Å; V48-L123 HydrophobicContact CG2-CD2 3.97Å; V48-I132 PolarHBondContact N-O 3.02Å; V48-F133 HydrophobicContact CB-CD1 3.64Å; V48-F133 HydrophobicContact CB-CE1 3.47Å; V48-F133 VanDerWaalsContact CB-CE1 3.47Å; V48-F133 HydrophobicContact CB-CG 4.33Å; V48-F133 HydrophobicContact CB-CZ 4.02Å; V48-F133 HydrophobicContact CG1-CD1 3.9Å; V48-F133 HydrophobicContact CG1-CE1 3.53Å; V48-F133 HydrophobicContact CG1-CZ 4.38Å; V48-F133 HydrophobicContact CG2-CD1 4.35Å; V48-F133 HydrophobicContact CG2-CE1 3.78Å; V48-F133 HydrophobicContact CG2-CE2 4.41Å; V48-F133 HydrophobicContact CG2-CZ 3.81Å; V48-P134 WeakPolarHBondContact O-CD 3.49Å
49	L	98.9	Very high	93.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.			trans	-101.9	166.6	-177.6	-53.6	-176.8	0	0	0	111.8	L47 T58 A63 I79 F80 A81 I112 I117 P134	L47-L49 HydrophobicContact CD2-CD2 4.05Å; L47-L49 HydrophobicContact CG-CD2 3.9Å; L49-T58 HydrophobicContact CD2-CG2 4.03Å; L49-A63 HydrophobicContact CD2-CB 4.37Å; L49-I79 HydrophobicContact CD1-CG2 3.42Å; L49-I79 VanDerWaalsContact CD1-CG2 3.42Å; L49-I79 HydrophobicContact CG-CG2 3.71Å; L49-F80 PolarHBondContact N-O 3.4Å; L49-A81 HydrophobicContact CB-CB 4.38Å; L49-I112 HydrophobicContact CD1-CB 3.98Å; L49-I112 HydrophobicContact CD1-CD1 4.32Å; L49-I112 HydrophobicContact CD1-CG2 3.98Å; L49-I117 HydrophobicContact CD1-CD1 4.41Å; L49-P134 HydrophobicContact CD2-CG 3.89Å
50	S	98.9	Very high	95.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.			trans	-133.4	13.9	-173.5	67.8	0	0	0	0	114.5	G57 T58 V105 G138 A139 N142	S50-G57 VanDerWaalsContact O-CA 3.3Å; S50-G57 WeakPolarHBondContact O-CA 3.44Å; S50-G57 VanDerWaalsContact OG-C 3.23Å; S50-G57 PolarHBondContact OG-O 2.99Å; S50-T58 PolarHBondContact N-OG1 3.46Å; S50-T58 PolarHBondContact OG-N 2.61Å; S50-T58 PolarHBondContact OG-OG1 3.39Å; S50-V105 VanDerWaalsContact C-CG1 3.5Å; S50-G138 VanDerWaalsContact CB-C 3.5Å; S50-G138 VanDerWaalsContact OG-C 3.28Å; S50-G138 WeakPolarHBondContact OG-CA 3.45Å; S50-A139 PolarHBondContact OG-N 2.92Å; S50-N142 PolarHBondContact O-ND2 3.38Å
51	G	98.8	Very high	97.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.			trans	130.8	-159.4	-173.8	0	0	0	0	0	110.4	T58 S109	G51-T58 PolarHBondContact O-N 3.38Å; G51-S109 WeakPolarHBondContact CA-OG 3.13Å; G51-S109 PolarHBondContact N-OG 3.19Å; G51-S109 PolarHBondContact O-OG 2.85Å
52	C	98.8	Very high	98.3	Very high	28 Å²	28	23.9 Å²	23.9	19%	0.189	12%	0.122	C	C	.	.	S	Bend	trans	-142.1	80.3	-178.4	-179.1	0	0	0	0	112.2	E108 R111 I112	C52-E108 HydrophobicContact CB-CB 4.3Å; C52-E108 VanDerWaalsContact CB-O 3.25Å; C52-E108 WeakPolarHBondContact CB-O 3.28Å; C52-R111 HydrophobicContact CB-CB 4.4Å; C52-I112 HydrophobicContact CB-CD1 4.31Å; C52-I112 HydrophobicContact CB-CG1 4.31Å
53	G	98.5	Very high	98.7	Very high	4 Å²	4	22.3 Å²	22.3	4%	0.041	11%	0.109	C	C	.	.	S	Bend	trans	155.5	139.3	-176.7	0	0	0	0	0	111	Y55 D56 G57 T58 H92	G53-Y55 VanDerWaalsContact C-N 3.3Å; G53-Y55 PolarHBondContact O-N 2.87Å; G53-D56 PolarHBondContact O-N 3.25Å; G53-G57 CarbonylContact O-C 3.53Å; G53-G57 WeakPolarHBondContact O-CA 3.49Å; G53-G57 PolarHBondContact O-N 3.49Å; G53-G57 VanDerWaalsContact O-O 3.1Å; G53-T58 CarbonylContact C-O 3.52Å; G53-T58 PolarHBondContact N-O 3.35Å; G53-H92 WeakPolarHBondContact CA-NE2 3.4Å
54	V	98.3	Very high	98.7	Very high	44 Å²	44	25 Å²	25	27%	0.267	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.9	-173.2	64	0	0	0	0	113.2	E59 H92 F137	V54-E59 HydrophobicContact CB-CG 4.04Å; V54-E59 HydrophobicContact CG2-CB 4.4Å; V54-E59 HydrophobicContact CG2-CG 3.81Å; V54-H92 PolarHBondContact N-NE2 3.4Å; V54-H92 VanDerWaalsContact N-NE2 3.17Å; V54-F137 WeakPolarHBondContact O-CB 3.48Å; V54-F137 WeakPolarHBondContact O-CD2 3.26Å; V54-F137 PolarHBondContact O-N 3.49Å
55	Y	98.4	Very high	98.8	Very high	94 Å²	94	20.7 Å²	20.7	37%	0.369	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.4	-172.5	-62.5	-48.8	0	0	0	114.5	G53 I90 H92 F137 K141	G53-Y55 VanDerWaalsContact C-N 3.3Å; G53-Y55 PolarHBondContact O-N 2.87Å; Y55-I90 HydrophobicContact CD2-CG2 3.96Å; Y55-I90 HydrophobicContact CG-CG2 4.18Å; Y55-H92 HydrophobicContact CD2-CB 4.31Å; Y55-H92 AromaticContact CD2-CD2 3.45Å; Y55-H92 VanDerWaalsContact CD2-CD2 3.45Å; Y55-H92 WeakPolarHBondContact CD2-CD2 3.37Å; Y55-H92 AromaticContact CD2-CG 3.78Å; Y55-H92 AromaticContact CD2-NE2 3.8Å; Y55-H92 PolarHBondContact N-NE2 2.94Å; Y55-H92 VanDerWaalsContact N-NE2 3.13Å; Y55-F137 HydrophobicContact CD1-CD2 4.06Å; Y55-F137 HydrophobicContact CD1-CE2 4.22Å; Y55-F137 WeakPolarHBondContact O-CB 3.43Å; Y55-K141 PolarHBondContact O-NZ 3.01Å
56	D	98.3	Very high	98.8	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.021	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-0.2	-174.6	60	9.2	0	0	0	114.8	G53 H88 I90 H92 N142	G53-D56 PolarHBondContact O-N 3.25Å; D56-H88 WeakPolarHBondContact CB-O 3.46Å; D56-I90 HydrophobicContact CB-CB 4.26Å; D56-I90 HydrophobicContact CB-CG1 3.92Å; D56-I90 PolarHBondContact OD2-N 2.82Å; D56-H92 IonicContact OD1-CE1 3.29Å; D56-H92 PolarHBondContact OD1-CE1 3.02Å; D56-H92 IonicContact OD2-CE1 3.24Å; D56-N142 PolarHBondContact O-ND2 2.95Å
57	G	98.8	Very high	98.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-157	-147.7	-177.9	0	0	0	0	0	113.1	S50 G53 G136 G138	S50-G57 VanDerWaalsContact O-CA 3.3Å; S50-G57 WeakPolarHBondContact O-CA 3.44Å; S50-G57 VanDerWaalsContact OG-C 3.23Å; S50-G57 PolarHBondContact OG-O 2.99Å; G53-G57 CarbonylContact O-C 3.53Å; G53-G57 WeakPolarHBondContact O-CA 3.49Å; G53-G57 PolarHBondContact O-N 3.49Å; G53-G57 VanDerWaalsContact O-O 3.1Å; G57-G136 CarbonylContact O-C 3.6Å; G57-G136 WeakPolarHBondContact O-CA 3.25Å; G57-G138 WeakPolarHBondContact O-CA 3.19Å; G57-G138 PolarHBondContact O-N 2.9Å
58	T	98.9	Very high	98.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.			trans	-76.5	137.7	175.9	-76.1	0	0	0	0	111.1	L49 S50 G51 G53 I60 A63 I112 P134 G135	L49-T58 HydrophobicContact CD2-CG2 4.03Å; S50-T58 PolarHBondContact N-OG1 3.46Å; S50-T58 PolarHBondContact OG-N 2.61Å; S50-T58 PolarHBondContact OG-OG1 3.39Å; G51-T58 PolarHBondContact O-N 3.38Å; G53-T58 CarbonylContact C-O 3.52Å; G53-T58 PolarHBondContact N-O 3.35Å; T58-I60 PolarHBondContact O-N 2.98Å; T58-A63 HydrophobicContact CG2-CB 3.72Å; T58-I112 HydrophobicContact CG2-CD1 4.04Å; T58-P134 HydrophobicContact CG2-CB 3.76Å; T58-P134 HydrophobicContact CG2-CG 4.08Å; T58-G135 WeakPolarHBondContact CA-O 3.43Å
59	E	98.8	Very high	98.8	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.061	14%	0.143	C	C	.	.			trans	-64	121.1	168.7	-154.2	-59.6	118	0	0	109.5	V54 H61 E62 A63 G135 F242	V54-E59 HydrophobicContact CB-CG 4.04Å; V54-E59 HydrophobicContact CG2-CB 4.4Å; V54-E59 HydrophobicContact CG2-CG 3.81Å; E59-H61 IonicContact OE1-CD2 3.91Å; E59-H61 PolarHBondContact OE1-CD2 3.07Å; E59-H61 VanDerWaalsContact OE1-CD2 3.26Å; E59-H61 IonicContact OE1-CG 2.73Å; E59-H61 PolarHBondContact OE1-N 3.21Å; E59-H61 VanDerWaalsContact OE2-CA 3.25Å; E59-H61 WeakPolarHBondContact OE2-CA 3.48Å; E59-H61 VanDerWaalsContact OE2-CB 3.26Å; E59-H61 WeakPolarHBondContact OE2-CB 3.44Å; E59-H61 PolarHBondContact OE2-N 3.26Å; E59-E62 HydrophobicContact CB-CB 4.21Å; E59-E62 HydrophobicContact CB-CG 4.04Å; E59-E62 HydrophobicContact CG-CG 4.22Å; E59-E62 WeakPolarHBondContact OE2-CG 3.4Å; E59-E62 PolarHBondContact OE2-N 3Å; E59-A63 PolarHBondContact O-N 3Å; E59-A63 VanDerWaalsContact O-N 3.12Å; E59-G135 PolarHBondContact N-O 2.77Å; E59-G135 VanDerWaalsContact N-O 3.15Å; E59-F242 HydrophobicContact CG-CD2 3.9Å; E59-F242 HydrophobicContact CG-CE2 4.22Å; E59-F242 HydrophobicContact CG-CG 4.47Å; E59-F242 VanDerWaalsContact OE2-CE2 3.24Å; E59-F242 WeakPolarHBondContact OE2-CE2 3.4Å
60	I	98.9	Very high	98.7	Very high	75 Å²	75	26.8 Å²	26.8	39%	0.385	14%	0.143	S	C	.	.	H	α-helix	trans	-74.5	-35.1	-165.6	-62.6	171.3	0	0	0	110.8	T58 S64 I112	T58-I60 PolarHBondContact O-N 2.98Å; I60-S64 VanDerWaalsContact O-CB 3.29Å; I60-S64 WeakPolarHBondContact O-CB 3.46Å; I60-S64 PolarHBondContact O-N 3.24Å; I60-I112 HydrophobicContact CG1-CD1 4.39Å
61	H	98.8	Very high	98.7	Very high	102 Å²	102	30.9 Å²	30.9	47%	0.472	17%	0.172	S	C	.	.	H	α-helix	trans	-70.2	-36.4	178.6	-59.8	-60	0	0	0	111.9	E59 S64 A65 F242 L248	E59-H61 IonicContact OE1-CD2 3.91Å; E59-H61 PolarHBondContact OE1-CD2 3.07Å; E59-H61 VanDerWaalsContact OE1-CD2 3.26Å; E59-H61 IonicContact OE1-CG 2.73Å; E59-H61 PolarHBondContact OE1-N 3.21Å; E59-H61 VanDerWaalsContact OE2-CA 3.25Å; E59-H61 WeakPolarHBondContact OE2-CA 3.48Å; E59-H61 VanDerWaalsContact OE2-CB 3.26Å; E59-H61 WeakPolarHBondContact OE2-CB 3.44Å; E59-H61 PolarHBondContact OE2-N 3.26Å; H61-S64 PolarHBondContact O-N 3.42Å; H61-A65 VanDerWaalsContact O-CB 3.31Å; H61-A65 WeakPolarHBondContact O-CB 3.43Å; H61-A65 PolarHBondContact O-N 3.33Å; H61-F242 HydrophobicContact CB-CE2 3.78Å; H61-F242 HydrophobicContact CB-CZ 3.9Å; H61-L248 HydrophobicContact CB-CD1 4.2Å
62	E	98.9	Very high	98.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.1	-50.1	174.8	-69.4	178.9	-159.7	0	0	110.3	E59 S64 A65 I66 P134 G135 C176 C177 A241 F242 I255	E59-E62 HydrophobicContact CB-CB 4.21Å; E59-E62 HydrophobicContact CB-CG 4.04Å; E59-E62 HydrophobicContact CG-CG 4.22Å; E59-E62 WeakPolarHBondContact OE2-CG 3.4Å; E59-E62 PolarHBondContact OE2-N 3Å; E62-S64 VanDerWaalsContact C-N 3.3Å; E62-S64 PolarHBondContact O-N 3.48Å; E62-A65 PolarHBondContact O-N 3.01Å; E62-I66 WeakPolarHBondContact O-CB 3.47Å; E62-I66 VanDerWaalsContact O-CG1 3.29Å; E62-I66 WeakPolarHBondContact O-CG1 3.35Å; E62-I66 PolarHBondContact O-N 2.89Å; E62-P134 HydrophobicContact CB-CB 4.34Å; E62-G135 VanDerWaalsContact OE2-CA 3.23Å; E62-G135 WeakPolarHBondContact OE2-CA 3.38Å; E62-G135 PolarHBondContact OE2-N 3.02Å; E62-C176 PolarHBondContact OE2-SG 3.44Å; E62-C177 WeakPolarHBondContact OE1-CB 3.19Å; E62-C177 PolarHBondContact OE1-SG 3.38Å; E62-C177 WeakPolarHBondContact OE2-CB 3.28Å; E62-A241 HydrophobicContact CG-CB 4.16Å; E62-F242 HydrophobicContact CG-CD2 3.69Å; E62-F242 HydrophobicContact CG-CE2 4.03Å; E62-F242 WeakPolarHBondContact OE1-CD2 3.21Å; E62-I255 HydrophobicContact CB-CD1 4Å; E62-I255 HydrophobicContact CG-CD1 3.75Å
63	A	98.9	Very high	98.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-43	175.7	0	0	0	0	0	111.7	L49 T58 E59 I66 L67 I112 P134	L49-A63 HydrophobicContact CD2-CB 4.37Å; T58-A63 HydrophobicContact CG2-CB 3.72Å; E59-A63 PolarHBondContact O-N 3Å; E59-A63 VanDerWaalsContact O-N 3.12Å; A63-I66 PolarHBondContact O-N 3.05Å; A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.26Å; A63-L67 PolarHBondContact O-N 2.94Å; A63-I112 HydrophobicContact CB-CD1 4.27Å; A63-I112 HydrophobicContact CB-CG2 4.05Å; A63-P134 HydrophobicContact CB-CG 4.34Å
64	S	98.8	Very high	98.5	Very high	65 Å²	65	42.4 Å²	42.4	46%	0.455	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-44.8	175.5	-174.5	0	0	0	0	111.9	I60 H61 E62 L67 V68	I60-S64 VanDerWaalsContact O-CB 3.29Å; I60-S64 WeakPolarHBondContact O-CB 3.46Å; I60-S64 PolarHBondContact O-N 3.24Å; H61-S64 PolarHBondContact O-N 3.42Å; E62-S64 VanDerWaalsContact C-N 3.3Å; E62-S64 PolarHBondContact O-N 3.48Å; S64-L67 PolarHBondContact O-N 2.89Å; S64-V68 VanDerWaalsContact O-CG2 3.29Å; S64-V68 WeakPolarHBondContact O-CG2 3.35Å; S64-V68 PolarHBondContact O-N 2.85Å
65	A	98.9	Very high	98.5	Very high	5 Å²	5	41 Å²	41	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-43.7	178.5	0	0	0	0	0	111.4	H61 E62 L67 V68 H69 I255	H61-A65 VanDerWaalsContact O-CB 3.31Å; H61-A65 WeakPolarHBondContact O-CB 3.43Å; H61-A65 PolarHBondContact O-N 3.33Å; E62-A65 PolarHBondContact O-N 3.01Å; A65-L67 PolarHBondContact O-N 3.18Å; A65-V68 PolarHBondContact O-N 3.29Å; A65-H69 PolarHBondContact O-CD2 2.78Å; A65-H69 PolarHBondContact O-N 2.69Å; A65-I255 HydrophobicContact CB-CB 4.2Å; A65-I255 HydrophobicContact CB-CD1 3.97Å; A65-I255 HydrophobicContact CB-CG2 3.81Å
66	I	98.9	Very high	98.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-49.4	175.4	-70.7	162.2	0	0	0	110.5	L47 E62 A63 V68 H69 L70 I132 P134 I255 M258 V259	L47-I66 HydrophobicContact CD1-CD1 4.47Å; L47-I66 HydrophobicContact CD1-CG2 3.73Å; E62-I66 WeakPolarHBondContact O-CB 3.47Å; E62-I66 VanDerWaalsContact O-CG1 3.29Å; E62-I66 WeakPolarHBondContact O-CG1 3.35Å; E62-I66 PolarHBondContact O-N 2.89Å; A63-I66 PolarHBondContact O-N 3.05Å; I66-V68 PolarHBondContact O-N 2.72Å; I66-H69 PolarHBondContact O-N 3.07Å; I66-L70 HydrophobicContact CG2-CD1 3.56Å; I66-L70 HydrophobicContact CG2-CG 4.15Å; I66-L70 WeakPolarHBondContact O-CB 3.35Å; I66-L70 VanDerWaalsContact O-CG 3.27Å; I66-L70 WeakPolarHBondContact O-CG 3.35Å; I66-L70 PolarHBondContact O-N 3.38Å; I66-I132 HydrophobicContact CD1-CG2 3.79Å; I66-I132 HydrophobicContact CG1-CG2 4.29Å; I66-I132 HydrophobicContact CG2-CD1 4.31Å; I66-I132 HydrophobicContact CG2-CG2 3.97Å; I66-P134 HydrophobicContact CD1-CB 3.86Å; I66-P134 HydrophobicContact CD1-CG 3.66Å; I66-I255 HydrophobicContact CB-CG2 4.46Å; I66-I255 HydrophobicContact CD1-CG2 4.5Å; I66-I255 HydrophobicContact CG1-CG2 3.5Å; I66-I255 VanDerWaalsContact CG1-CG2 3.5Å; I66-M258 HydrophobicContact CD1-CE 4.32Å; I66-M258 HydrophobicContact CG1-CE 4.13Å; I66-V259 HydrophobicContact CB-CG2 4.43Å; I66-V259 HydrophobicContact CG1-CG2 4.26Å; I66-V259 HydrophobicContact CG2-CG2 4.24Å
67	L	98.9	Very high	98.5	Very high	47 Å²	47	44 Å²	44	25%	0.246	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-41	179.6	-72.5	169.4	0	0	0	112.5	L47 A63 S64 A65 S71 V77 I79 I112	L47-L67 HydrophobicContact CD2-CD1 4.4Å; L47-L67 HydrophobicContact CD2-CD2 3.68Å; L47-L67 HydrophobicContact CD2-CG 3.88Å; A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.26Å; A63-L67 PolarHBondContact O-N 2.94Å; S64-L67 PolarHBondContact O-N 2.89Å; A65-L67 PolarHBondContact O-N 3.18Å; L67-S71 VanDerWaalsContact O-CB 3.3Å; L67-S71 WeakPolarHBondContact O-CB 3.33Å; L67-S71 PolarHBondContact O-N 2.99Å; L67-V77 HydrophobicContact CD2-CG1 3.98Å; L67-I79 HydrophobicContact CD2-CD1 4.19Å; L67-I112 HydrophobicContact CD1-CG2 4.33Å
68	V	98.8	Very high	98.5	Very high	54 Å²	54	47.9 Å²	47.9	33%	0.327	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-48	176.1	166.9	0	0	0	0	111	S64 A65 I66 S71 R72	S64-V68 VanDerWaalsContact O-CG2 3.29Å; S64-V68 WeakPolarHBondContact O-CG2 3.35Å; S64-V68 PolarHBondContact O-N 2.85Å; A65-V68 PolarHBondContact O-N 3.29Å; I66-V68 PolarHBondContact O-N 2.72Å; V68-S71 PolarHBondContact O-N 3.38Å; V68-R72 WeakPolarHBondContact O-CG 3.19Å; V68-R72 PolarHBondContact O-N 2.8Å
69	H	98.8	Very high	98.5	Very high	28 Å²	28	48.6 Å²	48.6	13%	0.13	28%	0.275	C	S	.	.	H	α-helix	trans	-72.4	-35.5	-177.7	-71.1	-66	0	0	0	113	A65 I66 S71 R72 G73 H252 G256 V259	A65-H69 PolarHBondContact O-CD2 2.78Å; A65-H69 PolarHBondContact O-N 2.69Å; I66-H69 PolarHBondContact O-N 3.07Å; H69-S71 VanDerWaalsContact C-N 3.34Å; H69-R72 PolarHBondContact O-N 2.93Å; H69-G73 PolarHBondContact O-N 3.08Å; H69-H252 AromaticContact CE1-CE1 3.36Å; H69-H252 PolarHBondContact CE1-CE1 3.05Å; H69-H252 AromaticContact CE1-ND1 3.95Å; H69-H252 AromaticContact CE1-NE2 3.97Å; H69-H252 AromaticContact NE2-CD2 3.97Å; H69-H252 AromaticContact NE2-CE1 3.09Å; H69-H252 PolarHBondContact NE2-CE1 3.07Å; H69-H252 AromaticContact NE2-CG 3.98Å; H69-H252 AromaticContact NE2-ND1 3.46Å; H69-H252 PolarHBondContact NE2-ND1 3.35Å; H69-H252 AromaticContact NE2-NE2 3.44Å; H69-H252 PolarHBondContact NE2-NE2 2.99Å; H69-H252 PolarHBondContact NE2-O 2.92Å; H69-G256 WeakPolarHBondContact CD2-CA 3.29Å; H69-G256 PolarHBondContact CD2-N 3.46Å; H69-G256 VanDerWaalsContact CE1-CA 3.47Å; H69-G256 WeakPolarHBondContact CE1-CA 3.2Å; H69-G256 VanDerWaalsContact CG-CA 3.49Å; H69-G256 WeakPolarHBondContact NE2-CA 3.36Å; H69-G256 PolarHBondContact NE2-N 3.35Å; H69-V259 HydrophobicContact CB-CB 3.9Å; H69-V259 HydrophobicContact CB-CG1 3.83Å; H69-V259 HydrophobicContact CB-CG2 4.16Å
70	L	98.7	Very high	98.5	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-43.9	171.3	-74.9	172.4	0	0	0	111.1	V45 I66 R72 G73 G74 A75 V77 I132 V259 L263	V45-L70 HydrophobicContact CB-CD1 4.41Å; V45-L70 HydrophobicContact CB-CD2 4.03Å; V45-L70 HydrophobicContact CG1-CD1 4.04Å; V45-L70 HydrophobicContact CG1-CD2 3.93Å; V45-L70 HydrophobicContact CG2-CD2 3.83Å; I66-L70 HydrophobicContact CG2-CD1 3.56Å; I66-L70 HydrophobicContact CG2-CG 4.15Å; I66-L70 WeakPolarHBondContact O-CB 3.35Å; I66-L70 VanDerWaalsContact O-CG 3.27Å; I66-L70 WeakPolarHBondContact O-CG 3.35Å; I66-L70 PolarHBondContact O-N 3.38Å; L70-R72 PolarHBondContact O-N 2.73Å; L70-G73 CarbonylContact O-C 3.44Å; L70-G73 PolarHBondContact O-N 2.91Å; L70-G74 PolarHBondContact O-N 3.22Å; L70-A75 HydrophobicContact CB-CB 4.29Å; L70-A75 HydrophobicContact CD2-CB 4.05Å; L70-A75 WeakPolarHBondContact O-CB 3.46Å; L70-A75 PolarHBondContact O-N 2.94Å; L70-V77 HydrophobicContact CB-CG2 3.77Å; L70-V77 HydrophobicContact CD1-CG1 4.29Å; L70-V77 HydrophobicContact CD1-CG2 3.7Å; L70-V77 HydrophobicContact CG-CG2 4.3Å; L70-I132 HydrophobicContact CD1-CD1 4.3Å; L70-I132 HydrophobicContact CD2-CD1 4.04Å; L70-I132 HydrophobicContact CG-CD1 4.46Å; L70-V259 HydrophobicContact CD2-CG1 3.67Å; L70-V259 HydrophobicContact CG-CG1 3.86Å; L70-L263 HydrophobicContact CD2-CD2 4.09Å; L70-L263 HydrophobicContact CD2-CG 4.46Å
71	S	98.3	Very high	98.5	Very high	86 Å²	86	44.5 Å²	44.5	60%	0.601	25%	0.254	S	S	*	.	H	α-helix	trans	-62.6	-41.3	175.7	178.8	0	0	0	0	112.1	L67 V68 H69 G73 G74	L67-S71 VanDerWaalsContact O-CB 3.3Å; L67-S71 WeakPolarHBondContact O-CB 3.33Å; L67-S71 PolarHBondContact O-N 2.99Å; V68-S71 PolarHBondContact O-N 3.38Å; H69-S71 VanDerWaalsContact C-N 3.34Å; S71-G73 VanDerWaalsContact C-N 3.3Å; S71-G73 PolarHBondContact O-N 2.81Å; S71-G74 PolarHBondContact O-N 3.41Å; S71-G74 VanDerWaalsContact O-N 3.15Å
72	R	97.8	Very high	98.5	Very high	179 Å²	179	39.6 Å²	39.6	68%	0.675	23%	0.232	S	C	*	.	H	α-helix	trans	-64.2	-35.3	174.8	-76.3	174.9	173.4	166	-2.3	112.5	V68 H69 L70 G74	V68-R72 WeakPolarHBondContact O-CG 3.19Å; V68-R72 PolarHBondContact O-N 2.8Å; H69-R72 PolarHBondContact O-N 2.93Å; L70-R72 PolarHBondContact O-N 2.73Å; R72-G74 PolarHBondContact O-N 3.39Å
73	G	96.6	Very high	98.5	Very high	48 Å²	48	44 Å²	44	50%	0.495	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	2.2	174.3	0	0	0	0	0	114.5	H69 L70 S71 A75	H69-G73 PolarHBondContact O-N 3.08Å; L70-G73 CarbonylContact O-C 3.44Å; L70-G73 PolarHBondContact O-N 2.91Å; S71-G73 VanDerWaalsContact C-N 3.3Å; S71-G73 PolarHBondContact O-N 2.81Å; G73-A75 VanDerWaalsContact C-N 3.25Å; G73-A75 PolarHBondContact O-N 3.48Å
74	G	96.8	Very high	98.5	Very high	47 Å²	47	46 Å²	46	49%	0.485	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	17.6	179.4	0	0	0	0	0	114.5	A42 L70 S71 R72	A42-G74 WeakPolarHBondContact CB-O 3.33Å; L70-G74 PolarHBondContact O-N 3.22Å; S71-G74 PolarHBondContact O-N 3.41Å; S71-G74 VanDerWaalsContact O-N 3.15Å; R72-G74 PolarHBondContact O-N 3.39Å
75	A	98.1	Very high	98.5	Very high	14 Å²	14	47.4 Å²	47.4	12%	0.116	28%	0.275	C	S	.	.			trans	-76.4	145.5	-178.6	0	0	0	0	0	112.5	A43 V45 L70 G73 L263	A43-A75 CarbonylContact O-C 3.58Å; A43-A75 VanDerWaalsContact O-CA 3.29Å; A43-A75 WeakPolarHBondContact O-CA 3.22Å; A43-A75 WeakPolarHBondContact O-CB 3.16Å; V45-A75 HydrophobicContact CG2-CB 4.05Å; L70-A75 HydrophobicContact CB-CB 4.29Å; L70-A75 HydrophobicContact CD2-CB 4.05Å; L70-A75 WeakPolarHBondContact O-CB 3.46Å; L70-A75 PolarHBondContact O-N 2.94Å; G73-A75 VanDerWaalsContact C-N 3.25Å; G73-A75 PolarHBondContact O-N 3.48Å; A75-L263 HydrophobicContact CB-CD2 3.98Å
76	E	98.1	Very high	98.4	Very high	106 Å²	106	47.8 Å²	47.8	50%	0.495	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.2	166.6	-71.5	179.9	-173.2	0	0	109.1	A42 A43 K44 V45	A42-E76 HydrophobicContact CB-CG 4Å; A43-E76 PolarHBondContact O-N 3.28Å; K44-E76 CarbonylContact C-O 3.55Å; K44-E76 WeakPolarHBondContact CA-O 3.33Å; K44-E76 WeakPolarHBondContact CE-OE2 3.4Å; K44-E76 HydrophobicContact CG-CB 4.19Å; V45-E76 PolarHBondContact N-O 3.32Å
77	V	98.6	Very high	98.4	Very high	54 Å²	54	50.9 Å²	50.9	33%	0.327	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129	-176.1	-172.7	0	0	0	0	111.1	V45 L47 L67 L70 I79	V45-V77 WeakPolarHBondContact O-CA 3.14Å; L47-V77 HydrophobicContact CB-CG1 4Å; L67-V77 HydrophobicContact CD2-CG1 3.98Å; L70-V77 HydrophobicContact CB-CG2 3.77Å; L70-V77 HydrophobicContact CD1-CG1 4.29Å; L70-V77 HydrophobicContact CD1-CG2 3.7Å; L70-V77 HydrophobicContact CG-CG2 4.3Å; V77-I79 HydrophobicContact CG1-CG1 4.14Å
78	Q	98.8	Very high	98.3	Very high	82 Å²	82	52.5 Å²	52.5	38%	0.383	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.1	165.4	-170.6	175.8	-6.1	0	0	109.5	V45 A46 L47 F80 T118 H128	V45-Q78 PolarHBondContact O-N 2.72Å; A46-Q78 CarbonylContact C-O 3.55Å; A46-Q78 WeakPolarHBondContact CA-O 3.3Å; L47-Q78 PolarHBondContact N-O 3.28Å; Q78-F80 HydrophobicContact CB-CE2 3.73Å; Q78-F80 HydrophobicContact CB-CZ 4.14Å; Q78-F80 HydrophobicContact CG-CD2 4.38Å; Q78-F80 HydrophobicContact CG-CE1 4.38Å; Q78-F80 HydrophobicContact CG-CE2 3.51Å; Q78-F80 HydrophobicContact CG-CZ 3.52Å; Q78-F80 VanDerWaalsContact NE2-CZ 3.34Å; Q78-F80 WeakPolarHBondContact O-CD2 3.46Å; Q78-F80 WeakPolarHBondContact O-CE2 3.45Å; Q78-T118 PolarHBondContact NE2-OG1 3.01Å; Q78-H128 PolarHBondContact OE1-NE2 3.46Å
79	I	98.9	Very high	98.2	Very high	15 Å²	15	50.2 Å²	50.2	8%	0.077	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	138	-173.2	-52.8	176.4	0	0	0	109.6	L47 L49 L67 V77 A113 I117 T118	L47-I79 HydrophobicContact CB-CG1 4.31Å; L47-I79 HydrophobicContact CD2-CG1 4.32Å; L47-I79 CarbonylContact O-C 3.33Å; L47-I79 WeakPolarHBondContact O-CA 3.47Å; L49-I79 HydrophobicContact CD1-CG2 3.42Å; L49-I79 VanDerWaalsContact CD1-CG2 3.42Å; L49-I79 HydrophobicContact CG-CG2 3.71Å; L67-I79 HydrophobicContact CD2-CD1 4.19Å; V77-I79 HydrophobicContact CG1-CG1 4.14Å; I79-A113 HydrophobicContact CB-CB 4.2Å; I79-A113 HydrophobicContact CD1-CB 3.74Å; I79-A113 HydrophobicContact CG2-CB 4.03Å; I79-I117 HydrophobicContact CB-CG1 4.41Å; I79-I117 HydrophobicContact CG2-CD1 3.97Å; I79-I117 HydrophobicContact CG2-CG1 4.04Å; I79-I117 WeakPolarHBondContact O-CA 3.32Å; I79-I117 WeakPolarHBondContact O-CG1 3.18Å; I79-T118 PolarHBondContact O-N 3.19Å
80	F	98.9	Very high	98.2	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.009	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155.4	-178.2	-60.4	-93.4	0	0	0	111.9	A46 L47 V48 L49 Q78 T118 L120 L123 H128	A46-F80 HydrophobicContact CB-CD2 4.07Å; A46-F80 HydrophobicContact CB-CE2 3.93Å; L47-F80 PolarHBondContact O-N 3.23Å; V48-F80 CarbonylContact C-O 3.5Å; V48-F80 WeakPolarHBondContact CA-O 3.38Å; V48-F80 HydrophobicContact CG2-CB 4.48Å; L49-F80 PolarHBondContact N-O 3.4Å; Q78-F80 HydrophobicContact CB-CE2 3.73Å; Q78-F80 HydrophobicContact CB-CZ 4.14Å; Q78-F80 HydrophobicContact CG-CD2 4.38Å; Q78-F80 HydrophobicContact CG-CE1 4.38Å; Q78-F80 HydrophobicContact CG-CE2 3.51Å; Q78-F80 HydrophobicContact CG-CZ 3.52Å; Q78-F80 VanDerWaalsContact NE2-CZ 3.34Å; Q78-F80 WeakPolarHBondContact O-CD2 3.46Å; Q78-F80 WeakPolarHBondContact O-CE2 3.45Å; F80-T118 WeakPolarHBondContact CA-O 3.47Å; F80-T118 HydrophobicContact CD1-CG2 4.17Å; F80-T118 HydrophobicContact CE1-CG2 3.92Å; F80-L120 HydrophobicContact CB-CD1 3.91Å; F80-L123 HydrophobicContact CD1-CB 3.83Å; F80-L123 HydrophobicContact CD2-CD1 4.24Å; F80-L123 HydrophobicContact CD2-CD2 4.2Å; F80-L123 HydrophobicContact CE1-CB 3.81Å; F80-L123 HydrophobicContact CE1-CD1 4.31Å; F80-L123 HydrophobicContact CE2-CB 4.49Å; F80-L123 HydrophobicContact CE2-CD1 3.72Å; F80-L123 HydrophobicContact CE2-CD2 4.5Å; F80-L123 HydrophobicContact CE2-CG 4.45Å; F80-L123 HydrophobicContact CG-CB 4.18Å; F80-L123 HydrophobicContact CG-CD2 4.36Å; F80-L123 HydrophobicContact CZ-CB 4.15Å; F80-L123 HydrophobicContact CZ-CD1 3.74Å; F80-L123 HydrophobicContact CZ-CG 4.45Å; F80-H128 AromaticContact CE2-NE2 3.68Å; F80-H128 AromaticContact CZ-CE1 3.77Å; F80-H128 AromaticContact CZ-NE2 3.82Å
81	A	98.9	Very high	98.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	149.1	167.7	0	0	0	0	0	109.5	L49 V105 L106 I117 T118 L120	L49-A81 HydrophobicContact CB-CB 4.38Å; A81-V105 HydrophobicContact CB-CG1 4.21Å; A81-L106 HydrophobicContact CB-CB 4.4Å; A81-L106 HydrophobicContact CB-CD1 4.04Å; A81-I117 HydrophobicContact CB-CD1 3.74Å; A81-T118 PolarHBondContact N-O 2.99Å; A81-L120 PolarHBondContact O-N 2.88Å
82	P	98.8	Very high	98.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.			trans	-68.9	138.7	176.6	28.2	-33.5	0	0	0	110.8	V84 V105 L106 L120 L143	P82-V84 VanDerWaalsContact C-N 3.28Å; P82-V84 HydrophobicContact CB-CG1 4.38Å; P82-V84 HydrophobicContact CB-CG2 4.08Å; P82-V84 HydrophobicContact CG-CG2 4.07Å; P82-V84 PolarHBondContact O-N 2.8Å; P82-V105 HydrophobicContact CG-CG1 3.81Å; P82-V105 WeakPolarHBondContact O-CB 3.2Å; P82-L106 PolarHBondContact O-N 3.4Å; P82-L120 HydrophobicContact CB-CB 4.38Å; P82-L120 HydrophobicContact CB-CD2 4.26Å; P82-L120 HydrophobicContact CG-CD2 4.5Å; P82-L143 HydrophobicContact CG-CD2 3.8Å
83	D	98.8	Very high	98	Very high	93 Å²	93	48.3 Å²	48.3	50%	0.497	28%	0.282	S	S	.	.	S	Bend	trans	-81.7	74	174.9	-167.7	7.6	0	0	0	111.1	N104 L106	D83-N104 PolarHBondContact OD1-ND2 3.24Å; D83-N104 PolarHBondContact OD1-OD1 2.94Å; D83-L106 HydrophobicContact CB-CB 4.36Å; D83-L106 HydrophobicContact CB-CD2 3.91Å
84	V	98.7	Very high	98	Very high	40 Å²	40	53 Å²	53	24%	0.242	29%	0.289	C	S	.	.	S	Bend	trans	-135.8	155.9	-178.1	-60.9	0	0	0	0	111.4	P82 N104 V105	P82-V84 VanDerWaalsContact C-N 3.28Å; P82-V84 HydrophobicContact CB-CG1 4.38Å; P82-V84 HydrophobicContact CB-CG2 4.08Å; P82-V84 HydrophobicContact CG-CG2 4.07Å; P82-V84 PolarHBondContact O-N 2.8Å; V84-N104 PolarHBondContact O-ND2 3.24Å; V84-V105 HydrophobicContact CG2-CB 4.14Å; V84-V105 HydrophobicContact CG2-CG2 3.91Å; V84-V105 WeakPolarHBondContact O-CB 3.44Å; V84-V105 WeakPolarHBondContact O-CG2 3.49Å; V84-V105 PolarHBondContact O-N 3.28Å
85	P	98.5	Very high	97.9	Very high	96 Å²	96	52.5 Å²	52.5	62%	0.623	28%	0.284	S	S	*	.	B	Isolated β-bridge	trans	-58.7	144.4	168.4	-21.1	33.1	0	0	0	111.6
86	Q	98.4	Very high	97.8	Very high	12 Å²	12	57.6 Å²	57.6	6%	0.056	31%	0.305	C	S	.	.			trans	-66	144.9	164.5	-71.6	-177.1	-169.8	0	0	109.5	H88 R103 V105	Q86-H88 VanDerWaalsContact C-N 3.33Å; Q86-H88 WeakPolarHBondContact CB-O 3.41Å; Q86-H88 PolarHBondContact NE2-O 2.78Å; Q86-H88 VanDerWaalsContact NE2-O 3.14Å; Q86-H88 PolarHBondContact O-N 2.88Å; Q86-R103 PolarHBondContact N-O 3.38Å; Q86-V105 HydrophobicContact CB-CG2 4.46Å; Q86-V105 HydrophobicContact CG-CG2 3.71Å
87	M	97.4	Very high	97.7	Very high	66 Å²	66	54.9 Å²	54.9	33%	0.325	30%	0.297	S	S	.	.	S	Bend	trans	-60.3	-44.3	175.4	176.9	-178.1	-80.5	0	0	111.7	K141 N142 V148	M87-K141 HydrophobicContact CB-CB 4.11Å; M87-K141 WeakPolarHBondContact CE-O 3.47Å; M87-K141 HydrophobicContact SD-CB 3.9Å; M87-K141 HydrophobicContact SD-CD 4.48Å; M87-K141 HydrophobicContact SD-CG 3.94Å; M87-N142 PolarHBondContact N-OD1 3.01Å; M87-V148 HydrophobicContact CE-CG2 4.01Å; M87-V148 HydrophobicContact SD-CG2 3.9Å
88	H	96.6	Very high	97.5	Very high	81 Å²	81	53.6 Å²	53.6	38%	0.375	29%	0.291	S	S	.	.			trans	-137	158.6	174.4	-64	136	0	0	0	109.7	D56 Q86 I90	D56-H88 WeakPolarHBondContact CB-O 3.46Å; Q86-H88 VanDerWaalsContact C-N 3.33Å; Q86-H88 WeakPolarHBondContact CB-O 3.41Å; Q86-H88 PolarHBondContact NE2-O 2.78Å; Q86-H88 VanDerWaalsContact NE2-O 3.14Å; Q86-H88 PolarHBondContact O-N 2.88Å; H88-I90 HydrophobicContact CB-CD1 3.97Å; H88-I90 HydrophobicContact CB-CG1 4.39Å
89	V	98.1	Very high	97.2	Very high	6 Å²	6	57.7 Å²	57.7	4%	0.036	31%	0.309	C	S	.	.			trans	-109.1	127	162.5	-179.5	0	0	0	0	106.8	P97 S98 E101 R103	V89-P97 CarbonylContact O-C 3.6Å; V89-P97 WeakPolarHBondContact O-CA 3.36Å; V89-S98 PolarHBondContact O-N 2.88Å; V89-E101 HydrophobicContact CB-CB 4.03Å; V89-E101 HydrophobicContact CG1-CB 3.92Å; V89-E101 HydrophobicContact CG2-CB 4.19Å; V89-R103 HydrophobicContact CG1-CG 4.32Å; V89-R103 HydrophobicContact CG2-CB 3.92Å; V89-R103 HydrophobicContact CG2-CG 3.72Å
90	I	98	Very high	96.9	Very high	14 Å²	14	62.7 Å²	62.7	7%	0.072	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127	-173.8	-58.2	-65.2	0	0	0	110.4	Y55 D56 H88 H92 P97	Y55-I90 HydrophobicContact CD2-CG2 3.96Å; Y55-I90 HydrophobicContact CG-CG2 4.18Å; D56-I90 HydrophobicContact CB-CB 4.26Å; D56-I90 HydrophobicContact CB-CG1 3.92Å; D56-I90 PolarHBondContact OD2-N 2.82Å; H88-I90 HydrophobicContact CB-CD1 3.97Å; H88-I90 HydrophobicContact CB-CG1 4.39Å; I90-H92 PolarHBondContact O-N 3.4Å; I90-H92 PolarHBondContact O-ND1 3.48Å; I90-P97 HydrophobicContact CD1-CB 4.15Å; I90-P97 HydrophobicContact CD1-CG 3.87Å
91	D	97.4	Very high	96.8	Very high	39 Å²	39	67 Å²	67	21%	0.209	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	102	163.1	-178.4	-16.3	0	0	0	108.2	T93 K94 G95 Q96	D91-T93 PolarHBondContact O-N 3.47Å; D91-T93 WeakPolarHBondContact OD1-CB 3.33Å; D91-T93 PolarHBondContact OD1-N 2.88Å; D91-T93 PolarHBondContact OD1-OG1 2.83Å; D91-K94 HydrophobicContact CB-CB 4.38Å; D91-K94 CarbonylContact O-C 3.52Å; D91-K94 PolarHBondContact O-N 3.24Å; D91-K94 WeakPolarHBondContact OD2-CE 3.21Å; D91-K94 IonicContact OD2-NZ 2.73Å; D91-K94 PolarHBondContact OD2-NZ 2.58Å; D91-G95 PolarHBondContact O-N 2.8Å; D91-Q96 PolarHBondContact N-O 2.85Å
92	H	97.1	Very high	96.7	Very high	75 Å²	75	71.9 Å²	71.9	35%	0.347	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.7	-176.3	-76.5	59.9	0	0	0	113.3	G53 V54 Y55 D56 I90 K94	G53-H92 WeakPolarHBondContact CA-NE2 3.4Å; V54-H92 PolarHBondContact N-NE2 3.4Å; V54-H92 VanDerWaalsContact N-NE2 3.17Å; Y55-H92 HydrophobicContact CD2-CB 4.31Å; Y55-H92 AromaticContact CD2-CD2 3.45Å; Y55-H92 VanDerWaalsContact CD2-CD2 3.45Å; Y55-H92 WeakPolarHBondContact CD2-CD2 3.37Å; Y55-H92 AromaticContact CD2-CG 3.78Å; Y55-H92 AromaticContact CD2-NE2 3.8Å; Y55-H92 PolarHBondContact N-NE2 2.94Å; Y55-H92 VanDerWaalsContact N-NE2 3.13Å; D56-H92 IonicContact OD1-CE1 3.29Å; D56-H92 PolarHBondContact OD1-CE1 3.02Å; D56-H92 IonicContact OD2-CE1 3.24Å; I90-H92 PolarHBondContact O-N 3.4Å; I90-H92 PolarHBondContact O-ND1 3.48Å; H92-K94 VanDerWaalsContact C-N 3.34Å
93	T	97.1	Very high	96.7	Very high	124 Å²	124	76.1 Å²	76.1	76%	0.761	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-23.9	174.8	71.5	0	0	0	0	112.4	D91	D91-T93 PolarHBondContact O-N 3.47Å; D91-T93 WeakPolarHBondContact OD1-CB 3.33Å; D91-T93 PolarHBondContact OD1-N 2.88Å; D91-T93 PolarHBondContact OD1-OG1 2.83Å
94	K	95.5	Very high	96.7	Very high	148 Å²	148	73.4 Å²	73.4	64%	0.643	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-20.1	179.9	-59.4	-172.5	-172	108.2	0	113.2	D91 H92 Q96	D91-K94 HydrophobicContact CB-CB 4.38Å; D91-K94 CarbonylContact O-C 3.52Å; D91-K94 PolarHBondContact O-N 3.24Å; D91-K94 WeakPolarHBondContact OD2-CE 3.21Å; D91-K94 IonicContact OD2-NZ 2.73Å; D91-K94 PolarHBondContact OD2-NZ 2.58Å; H92-K94 VanDerWaalsContact C-N 3.34Å; K94-Q96 HydrophobicContact CB-CB 4.32Å; K94-Q96 HydrophobicContact CB-CG 4.36Å; K94-Q96 PolarHBondContact O-N 2.93Å
95	G	94.5	Very high	96.7	Very high	36 Å²	36	71.5 Å²	71.5	37%	0.371	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	22.4	-171.4	0	0	0	0	0	113.4	D91	D91-G95 PolarHBondContact O-N 2.8Å
96	Q	95.9	Very high	96.7	Very high	120 Å²	120	68.2 Å²	68.2	56%	0.561	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.8	-174.1	-64.3	-59.7	-22.5	0	0	112.1	D91 K94	D91-Q96 PolarHBondContact N-O 2.85Å; K94-Q96 HydrophobicContact CB-CB 4.32Å; K94-Q96 HydrophobicContact CB-CG 4.36Å; K94-Q96 PolarHBondContact O-N 2.93Å
97	P	96	Very high	96.8	Very high	50 Å²	50	71.7 Å²	71.7	33%	0.325	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.2	173.4	-21.6	33.2	0	0	0	113.7	V89 I90 E99	V89-P97 CarbonylContact O-C 3.6Å; V89-P97 WeakPolarHBondContact O-CA 3.36Å; I90-P97 HydrophobicContact CD1-CB 4.15Å; I90-P97 HydrophobicContact CD1-CG 3.87Å; P97-E99 WeakPolarHBondContact CB-OE1 3.32Å
98	S	95.5	Very high	96.8	Very high	27 Å²	27	69.2 Å²	69.2	19%	0.189	38%	0.377	C	S	.	.			trans	-94.4	87.7	166	-69.2	0	0	0	0	109	V89 S100 E101	V89-S98 PolarHBondContact O-N 2.88Å; S98-S100 PolarHBondContact O-N 2.84Å; S98-E101 PolarHBondContact O-N 3.11Å
99	E	91.8	Very high	96.9	Very high	167 Å²	167	65.3 Å²	65.3	78%	0.78	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.7	-173.9	-61.1	-62.2	153	0	0	114.6	P97	P97-E99 WeakPolarHBondContact CB-OE1 3.32Å
100	S	93.9	Very high	97	Very high	121 Å²	121	66.2 Å²	66.2	85%	0.846	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.9	178.9	58.7	0	0	0	0	114.2	S98	S98-S100 PolarHBondContact O-N 2.84Å
101	E	95.9	Very high	97	Very high	91 Å²	91	73 Å²	73	43%	0.425	39%	0.392	S	S	.	.			trans	-106.6	143.1	-177	-70.8	-176.2	-139.6	0	0	111.9	V89 S98 R103	V89-E101 HydrophobicContact CB-CB 4.03Å; V89-E101 HydrophobicContact CG1-CB 3.92Å; V89-E101 HydrophobicContact CG2-CB 4.19Å; S98-E101 PolarHBondContact O-N 3.11Å; E101-R103 IonicContact OE2-CZ 3.61Å; E101-R103 IonicContact OE2-NE 3.71Å; E101-R103 IonicContact OE2-NH2 3.63Å; E101-R103 PolarHBondContact OE2-NH2 2.65Å
102	S	97.2	Very high	97.1	Very high	104 Å²	104	72.5 Å²	72.5	73%	0.727	39%	0.389	S	S	*	.			trans	-131.3	140.7	168.2	-173	0	0	0	0	109.3
103	R	98.6	Very high	97.2	Very high	88 Å²	88	69.2 Å²	69.2	33%	0.332	38%	0.375	S	S	.	.			trans	-137.6	156.4	179.5	-65	-177.9	-169.5	-171.8	12.6	110.2	Q86 V89 E101 E108	Q86-R103 PolarHBondContact N-O 3.38Å; V89-R103 HydrophobicContact CG1-CG 4.32Å; V89-R103 HydrophobicContact CG2-CB 3.92Å; V89-R103 HydrophobicContact CG2-CG 3.72Å; E101-R103 IonicContact OE2-CZ 3.61Å; E101-R103 IonicContact OE2-NE 3.71Å; E101-R103 IonicContact OE2-NH2 3.63Å; E101-R103 PolarHBondContact OE2-NH2 2.65Å; R103-E108 HydrophobicContact CB-CG 3.81Å; R103-E108 HydrophobicContact CG-CG 4.3Å; R103-E108 IonicContact NH1-OE2 2.76Å; R103-E108 PolarHBondContact NH1-OE2 2.95Å
104	N	98.8	Very high	97.2	Very high	36 Å²	36	73.9 Å²	73.9	19%	0.193	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-107.2	136.2	179.3	170.5	-81.5	0	0	0	110.4	D83 V84 L106 T107 E108	D83-N104 PolarHBondContact OD1-ND2 3.24Å; D83-N104 PolarHBondContact OD1-OD1 2.94Å; V84-N104 PolarHBondContact O-ND2 3.24Å; N104-L106 PolarHBondContact O-N 3.02Å; N104-L106 WeakPolarHBondContact OD1-CB 3.39Å; N104-L106 PolarHBondContact OD1-N 3.26Å; N104-T107 PolarHBondContact O-N 3.35Å; N104-T107 PolarHBondContact OD1-N 3.07Å; N104-T107 PolarHBondContact OD1-OG1 3.38Å; N104-T107 VanDerWaalsContact OD1-OG1 3.07Å; N104-E108 WeakPolarHBondContact O-CG 3.39Å; N104-E108 PolarHBondContact O-N 3.37Å
105	V	98.9	Very high	97.4	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-48.2	-175.1	167.8	0	0	0	0	112	S50 A81 P82 V84 Q86 S109 N142	S50-V105 VanDerWaalsContact C-CG1 3.5Å; A81-V105 HydrophobicContact CB-CG1 4.21Å; P82-V105 HydrophobicContact CG-CG1 3.81Å; P82-V105 WeakPolarHBondContact O-CB 3.2Å; V84-V105 HydrophobicContact CG2-CB 4.14Å; V84-V105 HydrophobicContact CG2-CG2 3.91Å; V84-V105 WeakPolarHBondContact O-CB 3.44Å; V84-V105 WeakPolarHBondContact O-CG2 3.49Å; V84-V105 PolarHBondContact O-N 3.28Å; Q86-V105 HydrophobicContact CB-CG2 4.46Å; Q86-V105 HydrophobicContact CG-CG2 3.71Å; V105-S109 WeakPolarHBondContact O-CB 3.32Å; V105-S109 PolarHBondContact O-N 2.88Å; V105-S109 PolarHBondContact O-OG 3.18Å; V105-N142 HydrophobicContact CG2-CB 3.83Å
106	L	98.9	Very high	97.5	Very high	27 Å²	27	76.2 Å²	76.2	14%	0.141	40%	0.395	C	S	.	.	H	α-helix	trans	-63.6	-45.9	178.2	174.5	62.9	0	0	0	111.5	A81 P82 D83 N104 S109 A110 I117 D119	A81-L106 HydrophobicContact CB-CB 4.4Å; A81-L106 HydrophobicContact CB-CD1 4.04Å; P82-L106 PolarHBondContact O-N 3.4Å; D83-L106 HydrophobicContact CB-CB 4.36Å; D83-L106 HydrophobicContact CB-CD2 3.91Å; N104-L106 PolarHBondContact O-N 3.02Å; N104-L106 WeakPolarHBondContact OD1-CB 3.39Å; N104-L106 PolarHBondContact OD1-N 3.26Å; L106-S109 PolarHBondContact O-N 3.25Å; L106-A110 PolarHBondContact O-N 3.13Å; L106-I117 HydrophobicContact CD1-CB 4.39Å; L106-I117 HydrophobicContact CD1-CD1 3.9Å; L106-I117 HydrophobicContact CD1-CG1 3.74Å; L106-I117 HydrophobicContact CD1-CG2 3.86Å; L106-D119 HydrophobicContact CD2-CB 4.27Å
107	T	98.9	Very high	97.7	Very high	86 Å²	86	72.1 Å²	72.1	53%	0.528	38%	0.376	S	S	.	.	H	α-helix	trans	-61.1	-47	-179.4	-58.9	0	0	0	0	111.5	N104 A110	N104-T107 PolarHBondContact O-N 3.35Å; N104-T107 PolarHBondContact OD1-N 3.07Å; N104-T107 PolarHBondContact OD1-OG1 3.38Å; N104-T107 VanDerWaalsContact OD1-OG1 3.07Å; T107-A110 VanDerWaalsContact O-CB 3.24Å; T107-A110 WeakPolarHBondContact O-CB 3.26Å; T107-A110 PolarHBondContact O-N 3.21Å
108	E	98.9	Very high	97.8	Very high	13 Å²	13	71.5 Å²	71.5	6%	0.061	37%	0.372	C	S	.	.	H	α-helix	trans	-72.3	-37	179.6	-66.9	-60.6	100.9	0	0	111.8	C52 R103 N104 A110 R111	C52-E108 HydrophobicContact CB-CB 4.3Å; C52-E108 VanDerWaalsContact CB-O 3.25Å; C52-E108 WeakPolarHBondContact CB-O 3.28Å; R103-E108 HydrophobicContact CB-CG 3.81Å; R103-E108 HydrophobicContact CG-CG 4.3Å; R103-E108 IonicContact NH1-OE2 2.76Å; R103-E108 PolarHBondContact NH1-OE2 2.95Å; N104-E108 WeakPolarHBondContact O-CG 3.39Å; N104-E108 PolarHBondContact O-N 3.37Å; E108-A110 PolarHBondContact O-N 2.95Å; E108-R111 VanDerWaalsContact CD-NE 3.31Å; E108-R111 VanDerWaalsContact O-CB 3.23Å; E108-R111 WeakPolarHBondContact O-CB 3.27Å; E108-R111 VanDerWaalsContact O-CG 3.23Å; E108-R111 WeakPolarHBondContact O-CG 3.4Å; E108-R111 PolarHBondContact O-N 3.36Å; E108-R111 IonicContact OE1-CZ 3.35Å; E108-R111 IonicContact OE1-NE 3.76Å; E108-R111 PolarHBondContact OE1-NE 3Å; E108-R111 IonicContact OE1-NH2 3.26Å; E108-R111 PolarHBondContact OE1-NH2 3.34Å; E108-R111 IonicContact OE2-CZ 3.67Å; E108-R111 IonicContact OE2-NE 2.9Å; E108-R111 PolarHBondContact OE2-NE 2.81Å; E108-R111 IonicContact OE2-NH2 3.52Å; E108-R111 PolarHBondContact OE2-NH2 3.31Å
109	S	98.9	Very high	98	Very high	0 Å²	0	72 Å²	72	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-60.9	-27.4	174.1	-61.9	0	0	0	0	112.7	G51 V105 L106 R111 I112 A113	G51-S109 WeakPolarHBondContact CA-OG 3.13Å; G51-S109 PolarHBondContact N-OG 3.19Å; G51-S109 PolarHBondContact O-OG 2.85Å; V105-S109 WeakPolarHBondContact O-CB 3.32Å; V105-S109 PolarHBondContact O-N 2.88Å; V105-S109 PolarHBondContact O-OG 3.18Å; L106-S109 PolarHBondContact O-N 3.25Å; S109-R111 PolarHBondContact O-N 2.83Å; S109-R111 VanDerWaalsContact O-N 3.13Å; S109-I112 PolarHBondContact O-N 3.33Å; S109-I112 VanDerWaalsContact O-N 3.13Å; S109-A113 PolarHBondContact O-N 3.21Å; S109-A113 VanDerWaalsContact O-N 3.15Å
110	A	98.8	Very high	98.3	Very high	25 Å²	25	64.1 Å²	64.1	21%	0.207	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-22.1	175.3	0	0	0	0	0	113.1	L106 T107 E108 A113 R114 G115 I117	L106-A110 PolarHBondContact O-N 3.13Å; T107-A110 VanDerWaalsContact O-CB 3.24Å; T107-A110 WeakPolarHBondContact O-CB 3.26Å; T107-A110 PolarHBondContact O-N 3.21Å; E108-A110 PolarHBondContact O-N 2.95Å; A110-A113 CarbonylContact O-C 3.59Å; A110-A113 PolarHBondContact O-N 3.16Å; A110-R114 PolarHBondContact O-N 3.41Å; A110-G115 PolarHBondContact O-N 3.25Å; A110-I117 HydrophobicContact CB-CG2 3.69Å
111	R	98.9	Very high	98.5	Very high	156 Å²	156	60.5 Å²	60.5	59%	0.589	31%	0.313	S	S	*	.	H	α-helix	trans	-62.5	-49.3	173.7	-61	174.1	-175.4	-76.5	-7.7	111.3	C52 E108 S109 A113 R114	C52-R111 HydrophobicContact CB-CB 4.4Å; E108-R111 VanDerWaalsContact CD-NE 3.31Å; E108-R111 VanDerWaalsContact O-CB 3.23Å; E108-R111 WeakPolarHBondContact O-CB 3.27Å; E108-R111 VanDerWaalsContact O-CG 3.23Å; E108-R111 WeakPolarHBondContact O-CG 3.4Å; E108-R111 PolarHBondContact O-N 3.36Å; E108-R111 IonicContact OE1-CZ 3.35Å; E108-R111 IonicContact OE1-NE 3.76Å; E108-R111 PolarHBondContact OE1-NE 3Å; E108-R111 IonicContact OE1-NH2 3.26Å; E108-R111 PolarHBondContact OE1-NH2 3.34Å; E108-R111 IonicContact OE2-CZ 3.67Å; E108-R111 IonicContact OE2-NE 2.9Å; E108-R111 PolarHBondContact OE2-NE 2.81Å; E108-R111 IonicContact OE2-NH2 3.52Å; E108-R111 PolarHBondContact OE2-NH2 3.31Å; S109-R111 PolarHBondContact O-N 2.83Å; S109-R111 VanDerWaalsContact O-N 3.13Å; R111-A113 VanDerWaalsContact C-N 3.34Å; R111-R114 PolarHBondContact O-N 3.05Å
112	I	98.8	Very high	98.7	Very high	28 Å²	28	63.5 Å²	63.5	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-44.5	175.6	-62.8	174.4	0	0	0	109.6	L49 C52 T58 I60 A63 L67 S109 R114	L49-I112 HydrophobicContact CD1-CB 3.98Å; L49-I112 HydrophobicContact CD1-CD1 4.32Å; L49-I112 HydrophobicContact CD1-CG2 3.98Å; C52-I112 HydrophobicContact CB-CD1 4.31Å; C52-I112 HydrophobicContact CB-CG1 4.31Å; T58-I112 HydrophobicContact CG2-CD1 4.04Å; I60-I112 HydrophobicContact CG1-CD1 4.39Å; A63-I112 HydrophobicContact CB-CD1 4.27Å; A63-I112 HydrophobicContact CB-CG2 4.05Å; L67-I112 HydrophobicContact CD1-CG2 4.33Å; S109-I112 PolarHBondContact O-N 3.33Å; S109-I112 VanDerWaalsContact O-N 3.13Å; I112-R114 PolarHBondContact O-N 3.39Å
113	A	98.6	Very high	98.7	Very high	6 Å²	6	58.6 Å²	58.6	5%	0.05	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-3.1	-176.4	0	0	0	0	0	114.9	I79 S109 A110 R111 G115 K116 I117	I79-A113 HydrophobicContact CB-CB 4.2Å; I79-A113 HydrophobicContact CD1-CB 3.74Å; I79-A113 HydrophobicContact CG2-CB 4.03Å; S109-A113 PolarHBondContact O-N 3.21Å; S109-A113 VanDerWaalsContact O-N 3.15Å; A110-A113 CarbonylContact O-C 3.59Å; A110-A113 PolarHBondContact O-N 3.16Å; R111-A113 VanDerWaalsContact C-N 3.34Å; A113-G115 PolarHBondContact O-N 3Å; A113-K116 WeakPolarHBondContact O-CB 3.5Å; A113-K116 PolarHBondContact O-N 2.88Å; A113-I117 HydrophobicContact CB-CB 3.75Å; A113-I117 HydrophobicContact CB-CD1 4.34Å; A113-I117 HydrophobicContact CB-CG1 4.44Å
114	R	98.4	Very high	98.7	Very high	222 Å²	222	56.4 Å²	56.4	84%	0.838	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	42.2	-173.2	-55.3	175.1	58.4	78.8	2.1	112.2	A110 R111 I112 K116	A110-R114 PolarHBondContact O-N 3.41Å; R111-R114 PolarHBondContact O-N 3.05Å; I112-R114 PolarHBondContact O-N 3.39Å; R114-K116 PolarHBondContact O-N 3.04Å
115	G	98.4	Very high	98.6	Very high	58 Å²	58	54.9 Å²	54.9	60%	0.598	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-7.1	-177.8	0	0	0	0	0	115.7	A110 A113 I117	A110-G115 PolarHBondContact O-N 3.25Å; A113-G115 PolarHBondContact O-N 3Å; G115-I117 VanDerWaalsContact C-N 3.35Å; G115-I117 PolarHBondContact O-N 3.07Å
116	K	98.6	Very high	98.5	Very high	175 Å²	175	58.6 Å²	58.6	76%	0.761	31%	0.312	S	S	*	.			trans	-91.5	65.5	-179.9	-61.6	-176.8	-178.8	-178	0	111.4	A113 R114	A113-K116 WeakPolarHBondContact O-CB 3.5Å; A113-K116 PolarHBondContact O-N 2.88Å; R114-K116 PolarHBondContact O-N 3.04Å
117	I	98.8	Very high	98.5	Very high	34 Å²	34	62.6 Å²	62.6	17%	0.174	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.3	-177.9	-166	163.5	0	0	0	111.1	L49 I79 A81 L106 A110 A113 G115	L49-I117 HydrophobicContact CD1-CD1 4.41Å; I79-I117 HydrophobicContact CB-CG1 4.41Å; I79-I117 HydrophobicContact CG2-CD1 3.97Å; I79-I117 HydrophobicContact CG2-CG1 4.04Å; I79-I117 WeakPolarHBondContact O-CA 3.32Å; I79-I117 WeakPolarHBondContact O-CG1 3.18Å; A81-I117 HydrophobicContact CB-CD1 3.74Å; L106-I117 HydrophobicContact CD1-CB 4.39Å; L106-I117 HydrophobicContact CD1-CD1 3.9Å; L106-I117 HydrophobicContact CD1-CG1 3.74Å; L106-I117 HydrophobicContact CD1-CG2 3.86Å; A110-I117 HydrophobicContact CB-CG2 3.69Å; A113-I117 HydrophobicContact CB-CB 3.75Å; A113-I117 HydrophobicContact CB-CD1 4.34Å; A113-I117 HydrophobicContact CB-CG1 4.44Å; G115-I117 VanDerWaalsContact C-N 3.35Å; G115-I117 PolarHBondContact O-N 3.07Å
118	T	98.8	Very high	98.5	Very high	38 Å²	38	59 Å²	59	23%	0.233	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	148	177.9	-51.9	0	0	0	0	110	Q78 I79 F80 A81 L120 K122	Q78-T118 PolarHBondContact NE2-OG1 3.01Å; I79-T118 PolarHBondContact O-N 3.19Å; F80-T118 WeakPolarHBondContact CA-O 3.47Å; F80-T118 HydrophobicContact CD1-CG2 4.17Å; F80-T118 HydrophobicContact CE1-CG2 3.92Å; A81-T118 PolarHBondContact N-O 2.99Å; T118-L120 PolarHBondContact O-N 3.31Å; T118-K122 HydrophobicContact CG2-CB 3.89Å; T118-K122 HydrophobicContact CG2-CD 3.72Å; T118-K122 HydrophobicContact CG2-CG 4.33Å
119	D	98.8	Very high	98.4	Very high	38 Å²	38	59.7 Å²	59.7	20%	0.203	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	131.4	168.6	-178.6	-5	0	0	0	111.1	L106 A121 K122	L106-D119 HydrophobicContact CD2-CB 4.27Å; D119-A121 PolarHBondContact O-N 3.26Å; D119-A121 WeakPolarHBondContact OD1-CB 3.41Å; D119-A121 PolarHBondContact OD1-N 2.83Å; D119-K122 WeakPolarHBondContact O-CB 3.03Å; D119-K122 PolarHBondContact O-N 2.89Å
120	L	98.9	Very high	98.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-57.8	-28.5	179	-174.8	63.7	0	0	0	112.7	V48 F80 A81 P82 T118 K122 L123 E158 V159 R161 V162	V48-L120 HydrophobicContact CB-CD1 4.48Å; V48-L120 HydrophobicContact CG1-CD1 3.79Å; V48-L120 HydrophobicContact CG1-CD2 4.05Å; V48-L120 HydrophobicContact CG2-CD1 3.84Å; F80-L120 HydrophobicContact CB-CD1 3.91Å; A81-L120 PolarHBondContact O-N 2.88Å; P82-L120 HydrophobicContact CB-CB 4.38Å; P82-L120 HydrophobicContact CB-CD2 4.26Å; P82-L120 HydrophobicContact CG-CD2 4.5Å; T118-L120 PolarHBondContact O-N 3.31Å; L120-K122 PolarHBondContact O-N 2.92Å; L120-L123 HydrophobicContact CD1-CB 4.13Å; L120-L123 HydrophobicContact CD1-CD2 3.82Å; L120-L123 WeakPolarHBondContact O-CB 3.45Å; L120-L123 PolarHBondContact O-N 3.32Å; L120-E158 HydrophobicContact CD2-CB 3.83Å; L120-E158 HydrophobicContact CG-CB 4.07Å; L120-V159 HydrophobicContact CD2-CG2 3.68Å; L120-R161 PolarHBondContact O-NH2 2.89Å; L120-R161 VanDerWaalsContact O-NH2 3.07Å; L120-V162 HydrophobicContact CD1-CG2 3.98Å; L120-V162 HydrophobicContact CG-CG2 4.38Å
121	A	98.6	Very high	98.4	Very high	46 Å²	46	58.5 Å²	58.5	38%	0.38	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-52.8	-28.6	172.9	0	0	0	0	0	113	D119 E158 R161	D119-A121 PolarHBondContact O-N 3.26Å; D119-A121 WeakPolarHBondContact OD1-CB 3.41Å; D119-A121 PolarHBondContact OD1-N 2.83Å; A121-E158 WeakPolarHBondContact CB-OE1 3.4Å; A121-R161 PolarHBondContact O-NH2 3.05Å
122	K	98.6	Very high	98.5	Very high	153 Å²	153	51.1 Å²	51.1	67%	0.665	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-90.4	-8.2	-177.6	-58.2	177.8	-178.1	173	0	113.7	T118 D119 L120 S124	T118-K122 HydrophobicContact CG2-CB 3.89Å; T118-K122 HydrophobicContact CG2-CD 3.72Å; T118-K122 HydrophobicContact CG2-CG 4.33Å; D119-K122 WeakPolarHBondContact O-CB 3.03Å; D119-K122 PolarHBondContact O-N 2.89Å; L120-K122 PolarHBondContact O-N 2.92Å; K122-S124 PolarHBondContact O-N 3.37Å
123	L	98.6	Very high	98.5	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.271	C	S	.	.			trans	-69.9	125.1	176.3	176.4	54.6	0	0	0	109.8	A46 V48 F80 L120 H128 R161 V162 F166	A46-L123 HydrophobicContact CB-CD1 3.68Å; A46-L123 HydrophobicContact CB-CD2 3.85Å; A46-L123 HydrophobicContact CB-CG 4.46Å; V48-L123 HydrophobicContact CG2-CD2 3.97Å; F80-L123 HydrophobicContact CD1-CB 3.83Å; F80-L123 HydrophobicContact CD2-CD1 4.24Å; F80-L123 HydrophobicContact CD2-CD2 4.2Å; F80-L123 HydrophobicContact CE1-CB 3.81Å; F80-L123 HydrophobicContact CE1-CD1 4.31Å; F80-L123 HydrophobicContact CE2-CB 4.49Å; F80-L123 HydrophobicContact CE2-CD1 3.72Å; F80-L123 HydrophobicContact CE2-CD2 4.5Å; F80-L123 HydrophobicContact CE2-CG 4.45Å; F80-L123 HydrophobicContact CG-CB 4.18Å; F80-L123 HydrophobicContact CG-CD2 4.36Å; F80-L123 HydrophobicContact CZ-CB 4.15Å; F80-L123 HydrophobicContact CZ-CD1 3.74Å; F80-L123 HydrophobicContact CZ-CG 4.45Å; L120-L123 HydrophobicContact CD1-CB 4.13Å; L120-L123 HydrophobicContact CD1-CD2 3.82Å; L120-L123 WeakPolarHBondContact O-CB 3.45Å; L120-L123 PolarHBondContact O-N 3.32Å; L123-H128 WeakPolarHBondContact CD1-ND1 3.38Å; L123-R161 PolarHBondContact O-NH1 3.49Å; L123-R161 PolarHBondContact O-NH2 2.86Å; L123-R161 VanDerWaalsContact O-NH2 3.15Å; L123-V162 HydrophobicContact CB-CG2 4.26Å; L123-V162 HydrophobicContact CD2-CB 4.44Å; L123-V162 HydrophobicContact CD2-CG1 3.65Å; L123-V162 HydrophobicContact CD2-CG2 3.84Å; L123-V162 HydrophobicContact CG-CG1 4.46Å; L123-V162 HydrophobicContact CG-CG2 4.09Å; L123-F166 HydrophobicContact CD1-CE2 4.22Å; L123-F166 HydrophobicContact CD1-CZ 4.24Å; L123-F166 HydrophobicContact CD2-CE2 4.18Å; L123-F166 HydrophobicContact CG-CE2 4.21Å
124	S	97	Very high	98.5	Very high	42 Å²	42	49.5 Å²	49.5	29%	0.294	27%	0.268	S	S	.	.			trans	-122.9	134	169.8	176.5	0	0	0	0	110.1	K122 A126 N127 H128	K122-S124 PolarHBondContact O-N 3.37Å; S124-A126 PolarHBondContact O-N 3.05Å; S124-A126 PolarHBondContact OG-N 3.32Å; S124-N127 PolarHBondContact O-N 2.95Å; S124-H128 PolarHBondContact O-ND1 3.22Å
125	A	97.9	Very high	98.5	Very high	5 Å²	5	39 Å²	39	4%	0.041	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-60.5	-22.2	174.2	0	0	0	0	0	112.7	N127 E165 F166 K171	A125-N127 PolarHBondContact O-N 2.66Å; A125-E165 HydrophobicContact CB-CB 3.77Å; A125-E165 PolarHBondContact N-OE2 3.05Å; A125-F166 HydrophobicContact CB-CD1 4.42Å; A125-F166 HydrophobicContact CB-CD2 3.69Å; A125-F166 HydrophobicContact CB-CE2 3.84Å; A125-F166 HydrophobicContact CB-CG 4.02Å; A125-F166 HydrophobicContact CB-CZ 4.27Å; A125-K171 PolarHBondContact O-NZ 3.4Å
126	A	97.6	Very high	98.5	Very high	78 Å²	78	36.3 Å²	36.3	65%	0.645	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-62.8	-30.1	178.7	0	0	0	0	0	113.1	S124	S124-A126 PolarHBondContact O-N 3.05Å; S124-A126 PolarHBondContact OG-N 3.32Å
127	N	97.3	Very high	98.5	Very high	111 Å²	111	30.9 Å²	30.9	59%	0.594	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-97.9	-1.2	-172	-63.2	-32.6	0	0	0	114.3	S124 A125	S124-N127 PolarHBondContact O-N 2.95Å; A125-N127 PolarHBondContact O-N 2.66Å
128	H	98.6	Very high	98.5	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.042	17%	0.169	C	C	.	.			trans	-132.8	157.1	-174.9	-63.5	81.8	0	0	0	110.2	K44 Q78 F80 L123 S124 F166 K171	K44-H128 CarbonylContact O-C 3.38Å; Q78-H128 PolarHBondContact OE1-NE2 3.46Å; F80-H128 AromaticContact CE2-NE2 3.68Å; F80-H128 AromaticContact CZ-CE1 3.77Å; F80-H128 AromaticContact CZ-NE2 3.82Å; L123-H128 WeakPolarHBondContact CD1-ND1 3.38Å; S124-H128 PolarHBondContact O-ND1 3.22Å; H128-F166 HydrophobicContact CB-CE1 3.96Å; H128-F166 HydrophobicContact CB-CZ 3.75Å; H128-K171 WeakPolarHBondContact O-CD 3.4Å; H128-K171 WeakPolarHBondContact O-CE 3.22Å; H128-K171 PolarHBondContact O-NZ 3.18Å
129	D	98.7	Very high	98.5	Very high	29 Å²	29	27.4 Å²	27.4	16%	0.155	16%	0.158	C	C	.	.	S	Bend	trans	-99.4	-23.3	178.7	-56	-59.9	0	0	0	112.3	K44 K171 P172 T266 K268	K44-D129 PolarHBondContact N-OD2 3.47Å; K44-D129 PolarHBondContact O-N 2.97Å; D129-K171 WeakPolarHBondContact O-CB 3.47Å; D129-P172 WeakPolarHBondContact O-CD 3.21Å; D129-T266 HydrophobicContact CB-CG2 4.07Å; D129-K268 VanDerWaalsContact CG-CE 3.42Å; D129-K268 WeakPolarHBondContact OD1-CE 3.29Å; D129-K268 IonicContact OD1-NZ 2.76Å; D129-K268 PolarHBondContact OD1-NZ 3.48Å; D129-K268 VanDerWaalsContact OD1-NZ 3.08Å; D129-K268 VanDerWaalsContact OD2-CE 3.29Å; D129-K268 WeakPolarHBondContact OD2-CE 3.17Å; D129-K268 IonicContact OD2-NZ 3.74Å; D129-K268 PolarHBondContact OD2-NZ 2.67Å
130	A	98.9	Very high	98.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161.9	177.8	0	0	0	0	0	112.2	K44 V45 A46 F166 P172 V262 T266	K44-A130 PolarHBondContact O-N 3.47Å; V45-A130 HydrophobicContact CG1-CB 4.31Å; V45-A130 HydrophobicContact CG2-CB 4.18Å; A46-A130 PolarHBondContact N-O 2.92Å; A130-F166 WeakPolarHBondContact O-CE1 3.41Å; A130-P172 WeakPolarHBondContact CA-O 3.41Å; A130-P172 HydrophobicContact CB-CG 3.88Å; A130-P172 WeakPolarHBondContact CB-O 3.23Å; A130-V262 HydrophobicContact CB-CG1 3.6Å; A130-T266 HydrophobicContact CB-CG2 4.03Å
131	A	98.9	Very high	98.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.6	169.6	0	0	0	0	0	110.7	A46 F133 F166 P172 I173 G174	A46-A131 HydrophobicContact CB-CB 4.47Å; A46-A131 CarbonylContact O-C 3.58Å; A46-A131 WeakPolarHBondContact O-CA 3.49Å; A131-F133 HydrophobicContact CB-CE2 4.03Å; A131-F166 HydrophobicContact CB-CD1 3.8Å; A131-F166 HydrophobicContact CB-CD2 4.03Å; A131-F166 HydrophobicContact CB-CE1 3.77Å; A131-F166 HydrophobicContact CB-CE2 3.96Å; A131-F166 HydrophobicContact CB-CG 3.94Å; A131-F166 HydrophobicContact CB-CZ 3.82Å; A131-P172 PolarHBondContact N-O 2.78Å; A131-P172 VanDerWaalsContact N-O 3.11Å; A131-I173 CarbonylContact O-C 3.54Å; A131-I173 VanDerWaalsContact O-CA 3.27Å; A131-I173 WeakPolarHBondContact O-CA 3.25Å; A131-G174 PolarHBondContact O-N 2.88Å
132	I	99	Very high	98.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136	176.6	-59.5	-176.9	0	0	0	110.3	V45 A46 L47 V48 I66 L70 G174 M258 V259 V262	V45-I132 HydrophobicContact CG1-CD1 3.95Å; V45-I132 HydrophobicContact CG1-CG1 3.94Å; A46-I132 PolarHBondContact O-N 2.79Å; L47-I132 HydrophobicContact CD1-CB 4.16Å; L47-I132 HydrophobicContact CD1-CG2 4.14Å; V48-I132 PolarHBondContact N-O 3.02Å; I66-I132 HydrophobicContact CD1-CG2 3.79Å; I66-I132 HydrophobicContact CG1-CG2 4.29Å; I66-I132 HydrophobicContact CG2-CD1 4.31Å; I66-I132 HydrophobicContact CG2-CG2 3.97Å; L70-I132 HydrophobicContact CD1-CD1 4.3Å; L70-I132 HydrophobicContact CD2-CD1 4.04Å; L70-I132 HydrophobicContact CG-CD1 4.46Å; I132-G174 CarbonylContact C-O 3.01Å; I132-G174 VanDerWaalsContact CA-O 3.25Å; I132-G174 WeakPolarHBondContact CA-O 3.35Å; I132-M258 HydrophobicContact CG2-CE 3.81Å; I132-V259 HydrophobicContact CD1-CG2 4.19Å; I132-V262 HydrophobicContact CD1-CB 4.41Å; I132-V262 HydrophobicContact CD1-CG1 4.08Å; I132-V262 HydrophobicContact CD1-CG2 4.47Å; I132-V262 HydrophobicContact CG1-CG1 4.2Å
133	F	98.9	Very high	98.5	Very high	1 Å²	1	18.7 Å²	18.7	0%	0.004	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	106.8	178.2	-64.4	-101.4	0	0	0	109.3	V48 A131 L143 V159 V162 L163 I173 G174 L175 C176 A179 L182	V48-F133 HydrophobicContact CB-CD1 3.64Å; V48-F133 HydrophobicContact CB-CE1 3.47Å; V48-F133 VanDerWaalsContact CB-CE1 3.47Å; V48-F133 HydrophobicContact CB-CG 4.33Å; V48-F133 HydrophobicContact CB-CZ 4.02Å; V48-F133 HydrophobicContact CG1-CD1 3.9Å; V48-F133 HydrophobicContact CG1-CE1 3.53Å; V48-F133 HydrophobicContact CG1-CZ 4.38Å; V48-F133 HydrophobicContact CG2-CD1 4.35Å; V48-F133 HydrophobicContact CG2-CE1 3.78Å; V48-F133 HydrophobicContact CG2-CE2 4.41Å; V48-F133 HydrophobicContact CG2-CZ 3.81Å; A131-F133 HydrophobicContact CB-CE2 4.03Å; F133-L143 HydrophobicContact CD1-CD1 4.16Å; F133-V159 HydrophobicContact CE1-CG1 4Å; F133-V162 HydrophobicContact CZ-CG1 3.94Å; F133-L163 HydrophobicContact CD2-CD2 4.35Å; F133-L163 HydrophobicContact CE2-CD2 3.73Å; F133-L163 HydrophobicContact CE2-CG 4.49Å; F133-L163 HydrophobicContact CZ-CD2 4Å; F133-L163 HydrophobicContact CZ-CG 4.29Å; F133-I173 HydrophobicContact CD2-CG2 4.16Å; F133-I173 HydrophobicContact CE2-CG2 4.14Å; F133-G174 PolarHBondContact N-O 3Å; F133-L175 HydrophobicContact CB-CD2 4.22Å; F133-L175 HydrophobicContact CB-CG 4.26Å; F133-L175 HydrophobicContact CD2-CD2 4.35Å; F133-L175 HydrophobicContact CD2-CG 4.38Å; F133-L175 HydrophobicContact CG-CD2 4.42Å; F133-L175 WeakPolarHBondContact O-CA 3.28Å; F133-C176 PolarHBondContact O-N 3.34Å; F133-A179 HydrophobicContact CB-CB 4.14Å; F133-L182 HydrophobicContact CD1-CD1 4.26Å
134	P	98.9	Very high	98.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.112	C	C	.	.			trans	-63.8	161.5	167.4	-13.6	28.6	0	0	0	110.9	L47 V48 L49 T58 E62 A63 I66	L47-P134 HydrophobicContact CD1-CG 3.77Å; V48-P134 WeakPolarHBondContact O-CD 3.49Å; L49-P134 HydrophobicContact CD2-CG 3.89Å; T58-P134 HydrophobicContact CG2-CB 3.76Å; T58-P134 HydrophobicContact CG2-CG 4.08Å; E62-P134 HydrophobicContact CB-CB 4.34Å; A63-P134 HydrophobicContact CB-CG 4.34Å; I66-P134 HydrophobicContact CD1-CB 3.86Å; I66-P134 HydrophobicContact CD1-CG 3.66Å
135	G	98.8	Very high	98.6	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.109	C	C	.	.			trans	-83.9	-141.4	170.6	0	0	0	0	0	113.2	T58 E59 E62 C176	T58-G135 WeakPolarHBondContact CA-O 3.43Å; E59-G135 PolarHBondContact N-O 2.77Å; E59-G135 VanDerWaalsContact N-O 3.15Å; E62-G135 VanDerWaalsContact OE2-CA 3.23Å; E62-G135 WeakPolarHBondContact OE2-CA 3.38Å; E62-G135 PolarHBondContact OE2-N 3.02Å; G135-C176 PolarHBondContact N-O 3.31Å
136	G	98.6	Very high	98.6	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.021	11%	0.112	C	C	.	.	S	Bend	trans	86.4	154.3	-158.5	0	0	0	0	0	111.5	G57 G138 A139 I178	G57-G136 CarbonylContact O-C 3.6Å; G57-G136 WeakPolarHBondContact O-CA 3.25Å; G136-G138 PolarHBondContact O-N 3.21Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G136-A139 WeakPolarHBondContact O-CB 3.49Å; G136-A139 PolarHBondContact O-N 2.96Å; G136-I178 VanDerWaalsContact O-CG2 3.29Å; G136-I178 WeakPolarHBondContact O-CG2 3.24Å
137	F	98.6	Very high	98.6	Very high	61 Å²	61	18.2 Å²	18.2	27%	0.268	10%	0.1	S	C	.	.	H	α-helix	trans	-62.9	-18.2	-178.6	-79	-82.8	0	0	0	112.7	V54 Y55 A139 A140 K141 Y206	V54-F137 WeakPolarHBondContact O-CB 3.48Å; V54-F137 WeakPolarHBondContact O-CD2 3.26Å; V54-F137 PolarHBondContact O-N 3.49Å; Y55-F137 HydrophobicContact CD1-CD2 4.06Å; Y55-F137 HydrophobicContact CD1-CE2 4.22Å; Y55-F137 WeakPolarHBondContact O-CB 3.43Å; F137-A139 PolarHBondContact O-N 3.41Å; F137-A140 CarbonylContact O-C 3.58Å; F137-A140 WeakPolarHBondContact O-CA 3.48Å; F137-A140 PolarHBondContact O-N 3.43Å; F137-K141 HydrophobicContact CB-CD 4.14Å; F137-K141 VanDerWaalsContact O-CB 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.37Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.29Å; F137-K141 PolarHBondContact O-N 2.95Å; F137-Y206 HydrophobicContact CZ-CE1 4.03Å
138	G	98.8	Very high	98.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-30.5	169.5	0	0	0	0	0	113.5	S50 G57 G136 A140 K141 N142 L143	S50-G138 VanDerWaalsContact CB-C 3.5Å; S50-G138 VanDerWaalsContact OG-C 3.28Å; S50-G138 WeakPolarHBondContact OG-CA 3.45Å; G57-G138 WeakPolarHBondContact O-CA 3.19Å; G57-G138 PolarHBondContact O-N 2.9Å; G136-G138 PolarHBondContact O-N 3.21Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G138-A140 VanDerWaalsContact C-N 3.28Å; G138-A140 PolarHBondContact O-N 3.23Å; G138-K141 PolarHBondContact O-N 3.35Å; G138-N142 WeakPolarHBondContact O-CA 3.33Å; G138-N142 VanDerWaalsContact O-CB 3.3Å; G138-N142 WeakPolarHBondContact O-CB 3.3Å; G138-N142 PolarHBondContact O-N 3.18Å; G138-L143 PolarHBondContact O-N 2.85Å
139	A	98.8	Very high	98.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-35.4	171.8	0	0	0	0	0	111.8	S50 G136 F137 L143 S144 I178 A179	S50-A139 PolarHBondContact OG-N 2.92Å; G136-A139 WeakPolarHBondContact O-CB 3.49Å; G136-A139 PolarHBondContact O-N 2.96Å; F137-A139 PolarHBondContact O-N 3.41Å; A139-L143 HydrophobicContact CB-CD1 4.38Å; A139-S144 PolarHBondContact O-N 3.32Å; A139-S144 PolarHBondContact O-OG 2.85Å; A139-I178 HydrophobicContact CB-CG2 4.08Å; A139-A179 HydrophobicContact CB-CB 4.22Å
140	A	98.4	Very high	98.5	Very high	2 Å²	2	20.2 Å²	20.2	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-87.4	-16.5	178.5	0	0	0	0	0	114.3	F137 G138 S144 T145 F146 A147 I178	F137-A140 CarbonylContact O-C 3.58Å; F137-A140 WeakPolarHBondContact O-CA 3.48Å; F137-A140 PolarHBondContact O-N 3.43Å; G138-A140 VanDerWaalsContact C-N 3.28Å; G138-A140 PolarHBondContact O-N 3.23Å; A140-S144 CarbonylContact C-O 3.52Å; A140-S144 WeakPolarHBondContact CA-OG 3.37Å; A140-S144 CarbonylContact O-C 3.45Å; A140-T145 CarbonylContact O-C 3.45Å; A140-F146 HydrophobicContact CB-CB 4.17Å; A140-F146 HydrophobicContact CB-CD1 4.11Å; A140-F146 PolarHBondContact O-N 3.25Å; A140-A147 HydrophobicContact CB-CB 3.92Å; A140-A147 WeakPolarHBondContact O-CB 3.36Å; A140-A147 PolarHBondContact O-N 3.02Å; A140-I178 HydrophobicContact CB-CG1 4.23Å
141	K	98.4	Very high	98.3	Very high	39 Å²	39	25.9 Å²	25.9	17%	0.17	15%	0.145	C	C	.	.	H	α-helix	trans	-112.7	-35.3	-174.7	-69.6	177.5	-179.5	175.3	0	114.2	Y55 M87 F137 G138 S144 A147	Y55-K141 PolarHBondContact O-NZ 3.01Å; M87-K141 HydrophobicContact CB-CB 4.11Å; M87-K141 WeakPolarHBondContact CE-O 3.47Å; M87-K141 HydrophobicContact SD-CB 3.9Å; M87-K141 HydrophobicContact SD-CD 4.48Å; M87-K141 HydrophobicContact SD-CG 3.94Å; F137-K141 HydrophobicContact CB-CD 4.14Å; F137-K141 VanDerWaalsContact O-CB 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.37Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.29Å; F137-K141 PolarHBondContact O-N 2.95Å; G138-K141 PolarHBondContact O-N 3.35Å; K141-S144 CarbonylContact C-O 3.57Å; K141-S144 VanDerWaalsContact CA-O 3.31Å; K141-S144 WeakPolarHBondContact CA-O 3.43Å; K141-S144 PolarHBondContact N-O 3.01Å; K141-S144 VanDerWaalsContact O-O 3.05Å; K141-A147 HydrophobicContact CG-CB 3.52Å
142	N	98.8	Very high	98.1	Very high	12 Å²	12	31.4 Å²	31.4	6%	0.064	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-40.7	-171.8	-53.5	-30	0	0	0	111.7	S50 D56 M87 V105 G138 S144	S50-N142 PolarHBondContact O-ND2 3.38Å; D56-N142 PolarHBondContact O-ND2 2.95Å; M87-N142 PolarHBondContact N-OD1 3.01Å; V105-N142 HydrophobicContact CG2-CB 3.83Å; G138-N142 WeakPolarHBondContact O-CA 3.33Å; G138-N142 VanDerWaalsContact O-CB 3.3Å; G138-N142 WeakPolarHBondContact O-CB 3.3Å; G138-N142 PolarHBondContact O-N 3.18Å; N142-S144 VanDerWaalsContact C-N 3.31Å; N142-S144 PolarHBondContact N-O 2.86Å
143	L	98.9	Very high	98.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.176	C	C	.	.	S	Bend	trans	-81.7	-15.9	173.8	-53.1	-171.3	0	0	0	112.4	P82 F133 G138 A139 N156 V159 L182	P82-L143 HydrophobicContact CG-CD2 3.8Å; F133-L143 HydrophobicContact CD1-CD1 4.16Å; G138-L143 PolarHBondContact O-N 2.85Å; A139-L143 HydrophobicContact CB-CD1 4.38Å; L143-N156 WeakPolarHBondContact O-CB 3.27Å; L143-N156 PolarHBondContact O-N 3.24Å; L143-V159 HydrophobicContact CB-CG2 4.03Å; L143-V159 HydrophobicContact CD2-CG2 3.86Å; L143-V159 HydrophobicContact CG-CG2 4.37Å; L143-L182 HydrophobicContact CB-CD1 4.1Å; L143-L182 HydrophobicContact CB-CD2 4.21Å; L143-L182 HydrophobicContact CD1-CD1 4.01Å
144	S	98.8	Very high	98.1	Very high	5 Å²	5	38.8 Å²	38.8	4%	0.035	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-156.2	176.8	174.4	66.6	0	0	0	0	110.3	A139 A140 K141 N142 F146 K154	A139-S144 PolarHBondContact O-N 3.32Å; A139-S144 PolarHBondContact O-OG 2.85Å; A140-S144 CarbonylContact C-O 3.52Å; A140-S144 WeakPolarHBondContact CA-OG 3.37Å; A140-S144 CarbonylContact O-C 3.45Å; K141-S144 CarbonylContact C-O 3.57Å; K141-S144 VanDerWaalsContact CA-O 3.31Å; K141-S144 WeakPolarHBondContact CA-O 3.43Å; K141-S144 PolarHBondContact N-O 3.01Å; K141-S144 VanDerWaalsContact O-O 3.05Å; N142-S144 VanDerWaalsContact C-N 3.31Å; N142-S144 PolarHBondContact N-O 2.86Å; S144-F146 WeakPolarHBondContact OG-CB 3.31Å; S144-F146 PolarHBondContact OG-N 2.91Å; S144-K154 CarbonylContact C-O 3.5Å; S144-K154 WeakPolarHBondContact CA-O 3.47Å; S144-K154 VanDerWaalsContact CB-O 3.28Å; S144-K154 WeakPolarHBondContact CB-O 3.44Å
145	T	98.6	Very high	98.1	Very high	38 Å²	38	39.5 Å²	39.5	23%	0.233	21%	0.211	C	C	.	.	S	Bend	trans	-100.3	16.9	170.5	62	0	0	0	0	112.9	A140 A147 V148 D149 C153 K154	A140-T145 CarbonylContact O-C 3.45Å; T145-A147 VanDerWaalsContact C-N 3.26Å; T145-A147 PolarHBondContact O-N 3.23Å; T145-V148 PolarHBondContact O-N 2.9Å; T145-D149 WeakPolarHBondContact CB-OD2 3.25Å; T145-D149 PolarHBondContact O-N 2.84Å; T145-D149 PolarHBondContact OG1-OD2 3.43Å; T145-C153 WeakPolarHBondContact OG1-CA 3.18Å; T145-K154 PolarHBondContact N-O 3.24Å; T145-K154 PolarHBondContact OG1-N 2.93Å
146	F	98.6	Very high	98.1	Very high	24 Å²	24	41.2 Å²	41.2	11%	0.105	22%	0.22	C	C	.	.	H	α-helix	trans	-55.2	-36.6	-173.9	-177.1	-94.5	0	0	0	114.1	A140 S144 V148 G150 C153 I178 V181 T209 A212 L216	A140-F146 HydrophobicContact CB-CB 4.17Å; A140-F146 HydrophobicContact CB-CD1 4.11Å; A140-F146 PolarHBondContact O-N 3.25Å; S144-F146 WeakPolarHBondContact OG-CB 3.31Å; S144-F146 PolarHBondContact OG-N 2.91Å; F146-V148 PolarHBondContact O-N 3.25Å; F146-G150 VanDerWaalsContact CD2-O 3.22Å; F146-G150 WeakPolarHBondContact CD2-O 3.47Å; F146-G150 WeakPolarHBondContact O-CA 3.27Å; F146-G150 PolarHBondContact O-N 3.21Å; F146-C153 HydrophobicContact CB-CB 4.1Å; F146-I178 HydrophobicContact CD1-CD1 4.36Å; F146-I178 HydrophobicContact CD1-CG1 4.47Å; F146-I178 HydrophobicContact CE1-CD1 3.93Å; F146-V181 HydrophobicContact CB-CG2 4.15Å; F146-V181 HydrophobicContact CD1-CG1 4.22Å; F146-V181 HydrophobicContact CD1-CG2 4.22Å; F146-V181 HydrophobicContact CD2-CB 4.02Å; F146-V181 HydrophobicContact CD2-CG1 4.19Å; F146-V181 HydrophobicContact CD2-CG2 4.18Å; F146-V181 HydrophobicContact CE1-CG1 3.94Å; F146-V181 HydrophobicContact CE2-CB 4.15Å; F146-V181 HydrophobicContact CE2-CG1 3.89Å; F146-V181 HydrophobicContact CG-CB 4.22Å; F146-V181 HydrophobicContact CG-CG1 4.35Å; F146-V181 HydrophobicContact CG-CG2 3.91Å; F146-V181 HydrophobicContact CZ-CB 4.48Å; F146-V181 HydrophobicContact CZ-CG1 3.76Å; F146-T209 HydrophobicContact CZ-CG2 4.42Å; F146-A212 HydrophobicContact CE2-CB 3.87Å; F146-A212 HydrophobicContact CZ-CB 3.71Å; F146-L216 HydrophobicContact CE2-CD1 4.3Å
147	A	97.3	Very high	98.1	Very high	48 Å²	48	49.7 Å²	49.7	40%	0.397	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-23.1	179.6	0	0	0	0	0	113.5	A140 K141 T145	A140-A147 HydrophobicContact CB-CB 3.92Å; A140-A147 WeakPolarHBondContact O-CB 3.36Å; A140-A147 PolarHBondContact O-N 3.02Å; K141-A147 HydrophobicContact CG-CB 3.52Å; T145-A147 VanDerWaalsContact C-N 3.26Å; T145-A147 PolarHBondContact O-N 3.23Å
148	V	97.4	Very high	98.1	Very high	100 Å²	100	49.3 Å²	49.3	61%	0.606	26%	0.256	S	S	*	.	H	α-helix	trans	-107.6	-45.6	-178.7	-178.1	0	0	0	0	110.8	M87 T145 F146	M87-V148 HydrophobicContact CE-CG2 4.01Å; M87-V148 HydrophobicContact SD-CG2 3.9Å; T145-V148 PolarHBondContact O-N 2.9Å; F146-V148 PolarHBondContact O-N 3.25Å
149	D	98.1	Very high	98.1	Very high	68 Å²	68	49.3 Å²	49.3	36%	0.364	26%	0.256	S	S	.	.	H	α-helix	trans	-98.5	-7.4	-169.6	-61.7	-23.9	0	0	0	113.3	T145 K151 D152 C153	T145-D149 WeakPolarHBondContact CB-OD2 3.25Å; T145-D149 PolarHBondContact O-N 2.84Å; T145-D149 PolarHBondContact OG1-OD2 3.43Å; D149-K151 PolarHBondContact O-N 2.96Å; D149-D152 PolarHBondContact O-N 3.49Å; D149-C153 HydrophobicContact CB-CB 4.07Å
150	G	96.9	Very high	98.1	Very high	24 Å²	24	52.5 Å²	52.5	25%	0.247	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	53.3	-124.4	-178.5	0	0	0	0	0	112.6	F146 D152 C153	F146-G150 VanDerWaalsContact CD2-O 3.22Å; F146-G150 WeakPolarHBondContact CD2-O 3.47Å; F146-G150 WeakPolarHBondContact O-CA 3.27Å; F146-G150 PolarHBondContact O-N 3.21Å; G150-D152 PolarHBondContact O-N 3.42Å; G150-C153 WeakPolarHBondContact O-CB 3.11Å; G150-C153 PolarHBondContact O-N 3.34Å; G150-C153 PolarHBondContact O-SG 3.27Å; G150-C153 VanDerWaalsContact O-SG 3.34Å
151	K	93.9	Very high	98.1	Very high	118 Å²	118	55.9 Å²	55.9	51%	0.513	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-64	-24.1	179.1	66.6	178.2	-176.7	174.6	0	113.9	D149 C153 K185 A215 L216	D149-K151 PolarHBondContact O-N 2.96Å; K151-C153 PolarHBondContact O-N 2.94Å; K151-K185 PolarHBondContact O-NZ 2.99Å; K151-A215 HydrophobicContact CB-CB 4.19Å; K151-A215 HydrophobicContact CD-CB 4.17Å; K151-L216 HydrophobicContact CB-CD2 4.42Å; K151-L216 WeakPolarHBondContact O-CD2 3.35Å
152	D	96.6	Very high	98.1	Very high	117 Å²	117	54 Å²	54	63%	0.626	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-87.7	6.5	-178.8	-62	-49.2	0	0	0	111.9	D149 G150	D149-D152 PolarHBondContact O-N 3.49Å; G150-D152 PolarHBondContact O-N 3.42Å
153	C	98.3	Very high	98.1	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.014	27%	0.272	C	S	.	.			trans	-58.5	158.7	-178	74.4	0	0	0	0	114.5	T145 F146 D149 G150 K151 K185	T145-C153 WeakPolarHBondContact OG1-CA 3.18Å; F146-C153 HydrophobicContact CB-CB 4.1Å; D149-C153 HydrophobicContact CB-CB 4.07Å; G150-C153 WeakPolarHBondContact O-CB 3.11Å; G150-C153 PolarHBondContact O-N 3.34Å; G150-C153 PolarHBondContact O-SG 3.27Å; G150-C153 VanDerWaalsContact O-SG 3.34Å; K151-C153 PolarHBondContact O-N 2.94Å; C153-K185 WeakPolarHBondContact O-CE 3.49Å; C153-K185 PolarHBondContact O-NZ 3Å
154	K	98.4	Very high	98.1	Very high	154 Å²	154	57.1 Å²	57.1	67%	0.67	29%	0.288	S	S	*	.			trans	-110.1	142.7	168.9	-63.3	174.5	-175.3	170.6	0	108.5	S144 T145	S144-K154 CarbonylContact C-O 3.5Å; S144-K154 WeakPolarHBondContact CA-O 3.47Å; S144-K154 VanDerWaalsContact CB-O 3.28Å; S144-K154 WeakPolarHBondContact CB-O 3.44Å; T145-K154 PolarHBondContact N-O 3.24Å; T145-K154 PolarHBondContact OG1-N 2.93Å
155	V	98.8	Very high	98.1	Very high	14 Å²	14	59.4 Å²	59.4	9%	0.085	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-91.7	143.6	170.1	176.3	0	0	0	0	108	K157 V159 E160 L182 K185 V186	V155-K157 PolarHBondContact O-N 2.9Å; V155-V159 HydrophobicContact CG1-CB 3.78Å; V155-V159 HydrophobicContact CG1-CG1 3.62Å; V155-E160 HydrophobicContact CB-CB 4.41Å; V155-E160 HydrophobicContact CG1-CB 4.08Å; V155-L182 HydrophobicContact CG1-CD2 4.32Å; V155-L182 HydrophobicContact CG2-CD2 4.14Å; V155-K185 HydrophobicContact CG2-CB 3.97Å; V155-K185 HydrophobicContact CG2-CG 3.87Å; V155-V186 HydrophobicContact CB-CG2 4.12Å; V155-V186 HydrophobicContact CG1-CG2 4.17Å; V155-V186 HydrophobicContact CG2-CG2 3.92Å
156	N	98.8	Very high	98.1	Very high	36 Å²	36	57.6 Å²	57.6	19%	0.193	29%	0.287	C	S	.	.			trans	-53.6	136.3	172.9	174.3	-65.4	0	0	0	109.4	L143 E158 V159 E160	L143-N156 WeakPolarHBondContact O-CB 3.27Å; L143-N156 PolarHBondContact O-N 3.24Å; N156-E158 PolarHBondContact O-N 2.71Å; N156-E158 WeakPolarHBondContact OD1-CB 3.22Å; N156-E158 PolarHBondContact OD1-N 3.19Å; N156-V159 HydrophobicContact CB-CB 4.18Å; N156-V159 HydrophobicContact CB-CG2 3.88Å; N156-V159 WeakPolarHBondContact O-CB 3.3Å; N156-V159 PolarHBondContact O-N 2.96Å; N156-V159 PolarHBondContact OD1-N 3.03Å; N156-E160 PolarHBondContact O-N 2.94Å
157	K	98.6	Very high	98.1	Very high	181 Å²	181	59.4 Å²	59.4	79%	0.787	30%	0.295	S	S	*	.	H	α-helix	trans	-58	-35.4	-172.6	-67.1	-178.6	179.8	177	0	113.4	V155 R161	V155-K157 PolarHBondContact O-N 2.9Å; K157-R161 WeakPolarHBondContact O-CB 3.15Å; K157-R161 PolarHBondContact O-N 3.07Å
158	E	98.6	Very high	98.2	Very high	52 Å²	52	64.4 Å²	64.4	24%	0.243	31%	0.311	C	S	.	.	H	α-helix	trans	-74	-39.1	178.7	-60.6	179.6	162.5	0	0	111.4	L120 A121 N156 R161 V162	L120-E158 HydrophobicContact CD2-CB 3.83Å; L120-E158 HydrophobicContact CG-CB 4.07Å; A121-E158 WeakPolarHBondContact CB-OE1 3.4Å; N156-E158 PolarHBondContact O-N 2.71Å; N156-E158 WeakPolarHBondContact OD1-CB 3.22Å; N156-E158 PolarHBondContact OD1-N 3.19Å; E158-R161 PolarHBondContact O-N 3.21Å; E158-V162 WeakPolarHBondContact O-CB 3.39Å; E158-V162 VanDerWaalsContact O-CG2 3.26Å; E158-V162 WeakPolarHBondContact O-CG2 3.3Å; E158-V162 PolarHBondContact O-N 2.99Å
159	V	98.8	Very high	98.2	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-45.8	174.3	177.3	0	0	0	0	110.4	L120 F133 L143 V155 N156 R161 V162 L163 L182	L120-V159 HydrophobicContact CD2-CG2 3.68Å; F133-V159 HydrophobicContact CE1-CG1 4Å; L143-V159 HydrophobicContact CB-CG2 4.03Å; L143-V159 HydrophobicContact CD2-CG2 3.86Å; L143-V159 HydrophobicContact CG-CG2 4.37Å; V155-V159 HydrophobicContact CG1-CB 3.78Å; V155-V159 HydrophobicContact CG1-CG1 3.62Å; N156-V159 HydrophobicContact CB-CB 4.18Å; N156-V159 HydrophobicContact CB-CG2 3.88Å; N156-V159 WeakPolarHBondContact O-CB 3.3Å; N156-V159 PolarHBondContact O-N 2.96Å; N156-V159 PolarHBondContact OD1-N 3.03Å; V159-R161 VanDerWaalsContact C-N 3.34Å; V159-R161 PolarHBondContact O-N 2.95Å; V159-V162 PolarHBondContact O-N 2.81Å; V159-L163 HydrophobicContact CG1-CD1 4.02Å; V159-L163 HydrophobicContact CG1-CG 4.47Å; V159-L163 WeakPolarHBondContact O-CG 3.38Å; V159-L163 PolarHBondContact O-N 3.27Å; V159-L182 HydrophobicContact CG1-CD1 4.2Å
160	E	98.9	Very high	98.3	Very high	67 Å²	67	60.7 Å²	60.7	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-44.8	175.9	-177.4	-179.2	167.9	0	0	111.4	V155 N156 K164 V186	V155-E160 HydrophobicContact CB-CB 4.41Å; V155-E160 HydrophobicContact CG1-CB 4.08Å; N156-E160 PolarHBondContact O-N 2.94Å; E160-K164 HydrophobicContact CG-CD 4.16Å; E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 WeakPolarHBondContact O-CG 3.35Å; E160-K164 PolarHBondContact O-N 3.46Å; E160-K164 WeakPolarHBondContact OE1-CE 3.23Å; E160-K164 IonicContact OE1-NZ 3.26Å; E160-K164 PolarHBondContact OE1-NZ 2.9Å; E160-V186 HydrophobicContact CB-CG2 4.34Å; E160-V186 HydrophobicContact CG-CG1 4.01Å; E160-V186 HydrophobicContact CG-CG2 4.02Å
161	R	98.8	Very high	98.3	Very high	73 Å²	73	61.7 Å²	61.7	28%	0.275	30%	0.301	S	S	.	.	H	α-helix	trans	-58	-51.4	174.6	177.5	-173.3	64.2	78.2	-0.7	111.1	L120 A121 L123 K157 E158 V159 L163 K164 E165	L120-R161 PolarHBondContact O-NH2 2.89Å; L120-R161 VanDerWaalsContact O-NH2 3.07Å; A121-R161 PolarHBondContact O-NH2 3.05Å; L123-R161 PolarHBondContact O-NH1 3.49Å; L123-R161 PolarHBondContact O-NH2 2.86Å; L123-R161 VanDerWaalsContact O-NH2 3.15Å; K157-R161 WeakPolarHBondContact O-CB 3.15Å; K157-R161 PolarHBondContact O-N 3.07Å; E158-R161 PolarHBondContact O-N 3.21Å; V159-R161 VanDerWaalsContact C-N 3.34Å; V159-R161 PolarHBondContact O-N 2.95Å; R161-L163 PolarHBondContact O-N 3.34Å; R161-K164 PolarHBondContact O-N 2.92Å; R161-E165 WeakPolarHBondContact CD-OE1 3.33Å; R161-E165 HydrophobicContact CG-CG 4.28Å; R161-E165 WeakPolarHBondContact CG-OE1 3.42Å; R161-E165 IonicContact CZ-OE1 2.87Å; R161-E165 IonicContact NE-OE1 3.5Å; R161-E165 VanDerWaalsContact NH1-CD 3.29Å; R161-E165 IonicContact NH1-OE1 3.52Å; R161-E165 PolarHBondContact NH1-OE1 3.13Å; R161-E165 IonicContact NH1-OE2 3.64Å; R161-E165 PolarHBondContact NH1-OE2 3.42Å; R161-E165 WeakPolarHBondContact O-CB 3.22Å; R161-E165 WeakPolarHBondContact O-CG 3.41Å; R161-E165 PolarHBondContact O-N 3.24Å
162	V	98.9	Very high	98.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-48.3	-178.8	166.7	0	0	0	0	111	L120 L123 F133 E158 V159 K164 E165 F166	L120-V162 HydrophobicContact CD1-CG2 3.98Å; L120-V162 HydrophobicContact CG-CG2 4.38Å; L123-V162 HydrophobicContact CB-CG2 4.26Å; L123-V162 HydrophobicContact CD2-CB 4.44Å; L123-V162 HydrophobicContact CD2-CG1 3.65Å; L123-V162 HydrophobicContact CD2-CG2 3.84Å; L123-V162 HydrophobicContact CG-CG1 4.46Å; L123-V162 HydrophobicContact CG-CG2 4.09Å; F133-V162 HydrophobicContact CZ-CG1 3.94Å; E158-V162 WeakPolarHBondContact O-CB 3.39Å; E158-V162 VanDerWaalsContact O-CG2 3.26Å; E158-V162 WeakPolarHBondContact O-CG2 3.3Å; E158-V162 PolarHBondContact O-N 2.99Å; V159-V162 PolarHBondContact O-N 2.81Å; V162-K164 VanDerWaalsContact C-N 3.3Å; V162-K164 PolarHBondContact O-N 2.91Å; V162-E165 PolarHBondContact O-N 3.32Å; V162-F166 HydrophobicContact CG1-CD2 3.83Å; V162-F166 HydrophobicContact CG1-CE2 3.92Å; V162-F166 WeakPolarHBondContact O-CD2 3.49Å; V162-F166 PolarHBondContact O-N 3.33Å
163	L	98.9	Very high	98.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-43.5	177.9	-72	170.5	0	0	0	111.8	F133 V159 R161 H167 I173 L182 V186	F133-L163 HydrophobicContact CD2-CD2 4.35Å; F133-L163 HydrophobicContact CE2-CD2 3.73Å; F133-L163 HydrophobicContact CE2-CG 4.49Å; F133-L163 HydrophobicContact CZ-CD2 4Å; F133-L163 HydrophobicContact CZ-CG 4.29Å; V159-L163 HydrophobicContact CG1-CD1 4.02Å; V159-L163 HydrophobicContact CG1-CG 4.47Å; V159-L163 WeakPolarHBondContact O-CG 3.38Å; V159-L163 PolarHBondContact O-N 3.27Å; R161-L163 PolarHBondContact O-N 3.34Å; L163-H167 VanDerWaalsContact O-CB 3.22Å; L163-H167 WeakPolarHBondContact O-CB 3.2Å; L163-H167 PolarHBondContact O-N 3.26Å; L163-I173 HydrophobicContact CD2-CD1 4.14Å; L163-I173 HydrophobicContact CD2-CG2 3.85Å; L163-L182 HydrophobicContact CD1-CB 3.92Å; L163-V186 HydrophobicContact CB-CG1 4.01Å; L163-V186 HydrophobicContact CD1-CB 4.18Å; L163-V186 HydrophobicContact CD1-CG2 4Å
164	K	98.8	Very high	98.7	Very high	79 Å²	79	50.6 Å²	50.6	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-44.8	176.5	-75.4	174.1	172.7	173.9	0	112.4	E160 R161 V162 H167 Q168 V186	E160-K164 HydrophobicContact CG-CD 4.16Å; E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 WeakPolarHBondContact O-CG 3.35Å; E160-K164 PolarHBondContact O-N 3.46Å; E160-K164 WeakPolarHBondContact OE1-CE 3.23Å; E160-K164 IonicContact OE1-NZ 3.26Å; E160-K164 PolarHBondContact OE1-NZ 2.9Å; R161-K164 PolarHBondContact O-N 2.92Å; V162-K164 VanDerWaalsContact C-N 3.3Å; V162-K164 PolarHBondContact O-N 2.91Å; K164-H167 PolarHBondContact O-N 3.12Å; K164-Q168 VanDerWaalsContact O-CB 3.26Å; K164-Q168 WeakPolarHBondContact O-CB 3.32Å; K164-Q168 WeakPolarHBondContact O-CG 3.25Å; K164-Q168 PolarHBondContact O-N 3.3Å; K164-V186 HydrophobicContact CD-CG1 4.39Å; K164-V186 HydrophobicContact CG-CG1 3.76Å
165	E	98.7	Very high	98.8	Very high	53 Å²	53	43.2 Å²	43.2	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-46.8	-179.9	-77.4	180	-159.9	0	0	112	A125 R161 V162 A169	A125-E165 HydrophobicContact CB-CB 3.77Å; A125-E165 PolarHBondContact N-OE2 3.05Å; R161-E165 WeakPolarHBondContact CD-OE1 3.33Å; R161-E165 HydrophobicContact CG-CG 4.28Å; R161-E165 WeakPolarHBondContact CG-OE1 3.42Å; R161-E165 IonicContact CZ-OE1 2.87Å; R161-E165 IonicContact NE-OE1 3.5Å; R161-E165 VanDerWaalsContact NH1-CD 3.29Å; R161-E165 IonicContact NH1-OE1 3.52Å; R161-E165 PolarHBondContact NH1-OE1 3.13Å; R161-E165 IonicContact NH1-OE2 3.64Å; R161-E165 PolarHBondContact NH1-OE2 3.42Å; R161-E165 WeakPolarHBondContact O-CB 3.22Å; R161-E165 WeakPolarHBondContact O-CG 3.41Å; R161-E165 PolarHBondContact O-N 3.24Å; V162-E165 PolarHBondContact O-N 3.32Å; E165-A169 VanDerWaalsContact O-CB 3.25Å; E165-A169 WeakPolarHBondContact O-CB 3.45Å; E165-A169 PolarHBondContact O-N 3.4Å
166	F	98.9	Very high	98.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-42.7	178.3	-84.4	-98	0	0	0	111.8	A46 L123 A125 H128 A130 A131 V162 A169 G170 K171 I173	A46-F166 HydrophobicContact CB-CZ 4.23Å; L123-F166 HydrophobicContact CD1-CE2 4.22Å; L123-F166 HydrophobicContact CD1-CZ 4.24Å; L123-F166 HydrophobicContact CD2-CE2 4.18Å; L123-F166 HydrophobicContact CG-CE2 4.21Å; A125-F166 HydrophobicContact CB-CD1 4.42Å; A125-F166 HydrophobicContact CB-CD2 3.69Å; A125-F166 HydrophobicContact CB-CE2 3.84Å; A125-F166 HydrophobicContact CB-CG 4.02Å; A125-F166 HydrophobicContact CB-CZ 4.27Å; H128-F166 HydrophobicContact CB-CE1 3.96Å; H128-F166 HydrophobicContact CB-CZ 3.75Å; A130-F166 WeakPolarHBondContact O-CE1 3.41Å; A131-F166 HydrophobicContact CB-CD1 3.8Å; A131-F166 HydrophobicContact CB-CD2 4.03Å; A131-F166 HydrophobicContact CB-CE1 3.77Å; A131-F166 HydrophobicContact CB-CE2 3.96Å; A131-F166 HydrophobicContact CB-CG 3.94Å; A131-F166 HydrophobicContact CB-CZ 3.82Å; V162-F166 HydrophobicContact CG1-CD2 3.83Å; V162-F166 HydrophobicContact CG1-CE2 3.92Å; V162-F166 WeakPolarHBondContact O-CD2 3.49Å; V162-F166 PolarHBondContact O-N 3.33Å; F166-A169 PolarHBondContact O-N 2.97Å; F166-G170 PolarHBondContact O-N 3.23Å; F166-K171 HydrophobicContact CB-CB 4.47Å; F166-K171 HydrophobicContact CD1-CB 3.75Å; F166-K171 HydrophobicContact CD1-CD 4.37Å; F166-K171 PolarHBondContact O-N 3.29Å; F166-I173 HydrophobicContact CB-CD1 3.94Å; F166-I173 HydrophobicContact CB-CG1 3.88Å
167	H	98.8	Very high	98.7	Very high	61 Å²	61	41.3 Å²	41.3	28%	0.282	21%	0.205	S	C	.	.	H	α-helix	trans	-62.3	-47.7	176.6	178.5	-107.9	0	0	0	112.1	L163 K164 A169 G170 I173 L187 N234	L163-H167 VanDerWaalsContact O-CB 3.22Å; L163-H167 WeakPolarHBondContact O-CB 3.2Å; L163-H167 PolarHBondContact O-N 3.26Å; K164-H167 PolarHBondContact O-N 3.12Å; H167-A169 VanDerWaalsContact C-N 3.29Å; H167-A169 PolarHBondContact O-N 3.14Å; H167-G170 PolarHBondContact O-N 3.13Å; H167-I173 HydrophobicContact CB-CD1 4.31Å; H167-L187 HydrophobicContact CB-CD1 4.3Å; H167-L187 HydrophobicContact CB-CD2 3.77Å; H167-N234 PolarHBondContact NE2-OD1 3.46Å
168	Q	98.5	Very high	98.7	Very high	154 Å²	154	33.4 Å²	33.4	72%	0.72	17%	0.171	S	C	*	.	H	α-helix	trans	-63	-34.8	177.6	-73.3	169.7	9	0	0	112.6	K164 G170	K164-Q168 VanDerWaalsContact O-CB 3.26Å; K164-Q168 WeakPolarHBondContact O-CB 3.32Å; K164-Q168 WeakPolarHBondContact O-CG 3.25Å; K164-Q168 PolarHBondContact O-N 3.3Å; Q168-G170 PolarHBondContact O-N 3.15Å
169	A	98.4	Very high	98.8	Very high	56 Å²	56	31 Å²	31	46%	0.463	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-2.1	174.9	0	0	0	0	0	113.3	E165 F166 H167 K171	E165-A169 VanDerWaalsContact O-CB 3.25Å; E165-A169 WeakPolarHBondContact O-CB 3.45Å; E165-A169 PolarHBondContact O-N 3.4Å; F166-A169 PolarHBondContact O-N 2.97Å; H167-A169 VanDerWaalsContact C-N 3.29Å; H167-A169 PolarHBondContact O-N 3.14Å; A169-K171 VanDerWaalsContact C-N 3.26Å; A169-K171 HydrophobicContact CB-CD 4.07Å; A169-K171 HydrophobicContact CB-CG 3.97Å; A169-K171 PolarHBondContact O-N 2.8Å
170	G	98.3	Very high	98.8	Very high	34 Å²	34	31 Å²	31	35%	0.351	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	34.2	-176.5	0	0	0	0	0	112.7	F166 H167 Q168 K235	F166-G170 PolarHBondContact O-N 3.23Å; H167-G170 PolarHBondContact O-N 3.13Å; Q168-G170 PolarHBondContact O-N 3.15Å; G170-K235 WeakPolarHBondContact O-CD 3.22Å; G170-K235 WeakPolarHBondContact O-CE 3.45Å; G170-K235 PolarHBondContact O-NZ 2.81Å
171	K	98.8	Very high	98.8	Very high	45 Å²	45	27.8 Å²	27.8	20%	0.196	15%	0.145	C	C	.	.			trans	-103.1	136.6	-179.4	-68.1	-174.7	177.5	-172.9	0	110.4	A125 H128 D129 F166 A169	A125-K171 PolarHBondContact O-NZ 3.4Å; H128-K171 WeakPolarHBondContact O-CD 3.4Å; H128-K171 WeakPolarHBondContact O-CE 3.22Å; H128-K171 PolarHBondContact O-NZ 3.18Å; D129-K171 WeakPolarHBondContact O-CB 3.47Å; F166-K171 HydrophobicContact CB-CB 4.47Å; F166-K171 HydrophobicContact CD1-CB 3.75Å; F166-K171 HydrophobicContact CD1-CD 4.37Å; F166-K171 PolarHBondContact O-N 3.29Å; A169-K171 VanDerWaalsContact C-N 3.26Å; A169-K171 HydrophobicContact CB-CD 4.07Å; A169-K171 HydrophobicContact CB-CG 3.97Å; A169-K171 PolarHBondContact O-N 2.8Å
172	P	98.9	Very high	98.8	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.013	13%	0.132	C	C	.	.			trans	-64.2	144.4	-174.5	24.6	-35	0	0	0	113.4	D129 A130 A131 K235 V262 L265 T266	D129-P172 WeakPolarHBondContact O-CD 3.21Å; A130-P172 WeakPolarHBondContact CA-O 3.41Å; A130-P172 HydrophobicContact CB-CG 3.88Å; A130-P172 WeakPolarHBondContact CB-O 3.23Å; A131-P172 PolarHBondContact N-O 2.78Å; A131-P172 VanDerWaalsContact N-O 3.11Å; P172-K235 CarbonylContact C-O 3.54Å; P172-K235 VanDerWaalsContact CA-O 3.22Å; P172-K235 WeakPolarHBondContact CA-O 3.31Å; P172-K235 HydrophobicContact CB-CB 4.31Å; P172-V262 HydrophobicContact CB-CG1 4.25Å; P172-V262 HydrophobicContact CG-CG1 4.29Å; P172-V262 WeakPolarHBondContact CG-O 3.23Å; P172-L265 HydrophobicContact CB-CB 3.72Å; P172-L265 HydrophobicContact CB-CD1 4.26Å; P172-L265 HydrophobicContact CG-CB 3.9Å; P172-T266 HydrophobicContact CG-CG2 3.75Å
173	I	98.9	Very high	98.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.7	176.6	-53.5	171.3	0	0	0	108.4	A131 F133 L163 F166 H167 L175 L187 K235 V236 V237	A131-I173 CarbonylContact O-C 3.54Å; A131-I173 VanDerWaalsContact O-CA 3.27Å; A131-I173 WeakPolarHBondContact O-CA 3.25Å; F133-I173 HydrophobicContact CD2-CG2 4.16Å; F133-I173 HydrophobicContact CE2-CG2 4.14Å; L163-I173 HydrophobicContact CD2-CD1 4.14Å; L163-I173 HydrophobicContact CD2-CG2 3.85Å; F166-I173 HydrophobicContact CB-CD1 3.94Å; F166-I173 HydrophobicContact CB-CG1 3.88Å; H167-I173 HydrophobicContact CB-CD1 4.31Å; I173-L175 HydrophobicContact CB-CD1 4.48Å; I173-L175 HydrophobicContact CG2-CD1 3.67Å; I173-L175 HydrophobicContact CG2-CG 4.14Å; I173-L187 HydrophobicContact CD1-CD1 4.22Å; I173-K235 PolarHBondContact N-O 3.03Å; I173-V236 HydrophobicContact CB-CG2 4.44Å; I173-V236 WeakPolarHBondContact O-CA 3.2Å; I173-V237 PolarHBondContact O-N 3.45Å
174	G	98.9	Very high	98.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.1	173.5	0	0	0	0	0	111.8	A131 I132 F133 V237	A131-G174 PolarHBondContact O-N 2.88Å; I132-G174 CarbonylContact C-O 3.01Å; I132-G174 VanDerWaalsContact CA-O 3.25Å; I132-G174 WeakPolarHBondContact CA-O 3.35Å; F133-G174 PolarHBondContact N-O 3Å; G174-V237 CarbonylContact C-O 3.59Å; G174-V237 VanDerWaalsContact CA-O 3.3Å; G174-V237 WeakPolarHBondContact CA-O 3.36Å
175	L	98.9	Very high	98.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	133.2	173.6	-45.9	93.2	0	0	0	111	F133 I173 A179 P180 L182 A183 V236 V237 T238 T239	F133-L175 HydrophobicContact CB-CD2 4.22Å; F133-L175 HydrophobicContact CB-CG 4.26Å; F133-L175 HydrophobicContact CD2-CD2 4.35Å; F133-L175 HydrophobicContact CD2-CG 4.38Å; F133-L175 HydrophobicContact CG-CD2 4.42Å; F133-L175 WeakPolarHBondContact O-CA 3.28Å; I173-L175 HydrophobicContact CB-CD1 4.48Å; I173-L175 HydrophobicContact CG2-CD1 3.67Å; I173-L175 HydrophobicContact CG2-CG 4.14Å; L175-A179 HydrophobicContact CB-CB 3.99Å; L175-A179 HydrophobicContact CD2-CB 4.37Å; L175-A179 VanDerWaalsContact CD2-O 3.22Å; L175-A179 WeakPolarHBondContact CD2-O 3.44Å; L175-P180 HydrophobicContact CB-CG 4.07Å; L175-L182 HydrophobicContact CD2-CB 4.3Å; L175-A183 HydrophobicContact CD1-CB 3.91Å; L175-A183 HydrophobicContact CD2-CB 4Å; L175-V236 HydrophobicContact CD1-CG1 3.81Å; L175-V237 PolarHBondContact N-O 2.97Å; L175-T238 HydrophobicContact CB-CG2 4.14Å; L175-T238 HydrophobicContact CD1-CG2 4.06Å; L175-T238 WeakPolarHBondContact O-CA 3.39Å; L175-T238 WeakPolarHBondContact O-CB 3.05Å; L175-T239 PolarHBondContact O-N 3.19Å
176	C	98.6	Very high	98.7	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	161.9	176.1	63	0	0	0	0	113.2	E62 F133 G135 I178 A179 T239 A241 M258	E62-C176 PolarHBondContact OE2-SG 3.44Å; F133-C176 PolarHBondContact O-N 3.34Å; G135-C176 PolarHBondContact N-O 3.31Å; C176-I178 PolarHBondContact O-N 3.46Å; C176-A179 VanDerWaalsContact O-CB 3.3Å; C176-A179 WeakPolarHBondContact O-CB 3.48Å; C176-A179 PolarHBondContact O-N 2.95Å; C176-A179 VanDerWaalsContact O-N 3.13Å; C176-T239 VanDerWaalsContact CA-O 3.3Å; C176-T239 WeakPolarHBondContact CA-O 3.3Å; C176-T239 HydrophobicContact CB-CG2 3.49Å; C176-T239 VanDerWaalsContact CB-CG2 3.49Å; C176-A241 HydrophobicContact CB-CB 4.12Å; C176-M258 HydrophobicContact CB-SD 3.98Å
177	C	98.7	Very high	98.7	Very high	10 Å²	10	23.3 Å²	23.3	7%	0.068	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-121.5	176.3	-176.6	0	0	0	0	112	E62 P180 T239 P240 A241 M243	E62-C177 WeakPolarHBondContact OE1-CB 3.19Å; E62-C177 PolarHBondContact OE1-SG 3.38Å; E62-C177 WeakPolarHBondContact OE2-CB 3.28Å; C177-P180 WeakPolarHBondContact O-CD 3.38Å; C177-T239 PolarHBondContact N-O 2.97Å; C177-P240 VanDerWaalsContact CA-O 3.24Å; C177-P240 WeakPolarHBondContact CA-O 3.42Å; C177-A241 HydrophobicContact CB-CB 4.04Å; C177-M243 HydrophobicContact CB-CG 4.25Å
178	I	98.8	Very high	98.4	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.077	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-16.7	179.3	-165.2	57.8	0	0	0	113	G136 A139 A140 F146 C176 P180 V181 T209 M243	G136-I178 VanDerWaalsContact O-CG2 3.29Å; G136-I178 WeakPolarHBondContact O-CG2 3.24Å; A139-I178 HydrophobicContact CB-CG2 4.08Å; A140-I178 HydrophobicContact CB-CG1 4.23Å; F146-I178 HydrophobicContact CD1-CD1 4.36Å; F146-I178 HydrophobicContact CD1-CG1 4.47Å; F146-I178 HydrophobicContact CE1-CD1 3.93Å; C176-I178 PolarHBondContact O-N 3.46Å; I178-P180 VanDerWaalsContact C-N 3.31Å; I178-V181 HydrophobicContact CD1-CG1 3.84Å; I178-V181 HydrophobicContact CG1-CG1 4.39Å; I178-V181 WeakPolarHBondContact O-CG1 3.31Å; I178-V181 WeakPolarHBondContact O-CG2 3.29Å; I178-V181 PolarHBondContact O-N 3.32Å; I178-T209 HydrophobicContact CD1-CG2 3.48Å; I178-T209 VanDerWaalsContact CD1-CG2 3.48Å; I178-M243 HydrophobicContact CB-SD 4.22Å; I178-M243 HydrophobicContact CD1-CE 3.98Å; I178-M243 HydrophobicContact CD1-SD 4.42Å
179	A	98.9	Very high	98.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.5	-177.4	0	0	0	0	0	115.9	F133 A139 L175 C176 V181 L182	F133-A179 HydrophobicContact CB-CB 4.14Å; A139-A179 HydrophobicContact CB-CB 4.22Å; L175-A179 HydrophobicContact CB-CB 3.99Å; L175-A179 HydrophobicContact CD2-CB 4.37Å; L175-A179 VanDerWaalsContact CD2-O 3.22Å; L175-A179 WeakPolarHBondContact CD2-O 3.44Å; C176-A179 VanDerWaalsContact O-CB 3.3Å; C176-A179 WeakPolarHBondContact O-CB 3.48Å; C176-A179 PolarHBondContact O-N 2.95Å; C176-A179 VanDerWaalsContact O-N 3.13Å; A179-V181 PolarHBondContact O-N 3.49Å; A179-L182 VanDerWaalsContact O-CB 3.26Å; A179-L182 WeakPolarHBondContact O-CB 3.45Å; A179-L182 VanDerWaalsContact O-CG 3.27Å; A179-L182 WeakPolarHBondContact O-CG 3.35Å; A179-L182 PolarHBondContact O-N 3.38Å
180	P	98.9	Very high	98.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-53.2	-22.5	173.5	-30.2	37.9	0	0	0	115.7	L175 C177 I178 L182 A183 A184 V192 T193 V194 T238	L175-P180 HydrophobicContact CB-CG 4.07Å; C177-P180 WeakPolarHBondContact O-CD 3.38Å; I178-P180 VanDerWaalsContact C-N 3.31Å; P180-L182 PolarHBondContact O-N 3.48Å; P180-A183 PolarHBondContact O-N 3.15Å; P180-A184 PolarHBondContact O-N 2.81Å; P180-V192 HydrophobicContact CB-CB 4.03Å; P180-V192 HydrophobicContact CB-CG1 4.28Å; P180-V192 HydrophobicContact CB-CG2 4.26Å; P180-T193 WeakPolarHBondContact CG-O 3.3Å; P180-V194 HydrophobicContact CB-CG1 3.87Å; P180-V194 HydrophobicContact CG-CG1 4.05Å; P180-T238 HydrophobicContact CB-CG2 4.01Å; P180-T238 HydrophobicContact CG-CG2 3.76Å
181	V	98.8	Very high	98.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-28.9	173.5	-56.4	0	0	0	0	112.4	F146 I178 A179 K185 T209 I213	F146-V181 HydrophobicContact CB-CG2 4.15Å; F146-V181 HydrophobicContact CD1-CG1 4.22Å; F146-V181 HydrophobicContact CD1-CG2 4.22Å; F146-V181 HydrophobicContact CD2-CB 4.02Å; F146-V181 HydrophobicContact CD2-CG1 4.19Å; F146-V181 HydrophobicContact CD2-CG2 4.18Å; F146-V181 HydrophobicContact CE1-CG1 3.94Å; F146-V181 HydrophobicContact CE2-CB 4.15Å; F146-V181 HydrophobicContact CE2-CG1 3.89Å; F146-V181 HydrophobicContact CG-CB 4.22Å; F146-V181 HydrophobicContact CG-CG1 4.35Å; F146-V181 HydrophobicContact CG-CG2 3.91Å; F146-V181 HydrophobicContact CZ-CB 4.48Å; F146-V181 HydrophobicContact CZ-CG1 3.76Å; I178-V181 HydrophobicContact CD1-CG1 3.84Å; I178-V181 HydrophobicContact CG1-CG1 4.39Å; I178-V181 WeakPolarHBondContact O-CG1 3.31Å; I178-V181 WeakPolarHBondContact O-CG2 3.29Å; I178-V181 PolarHBondContact O-N 3.32Å; A179-V181 PolarHBondContact O-N 3.49Å; V181-K185 WeakPolarHBondContact O-CB 3.29Å; V181-K185 PolarHBondContact O-N 3.42Å; V181-T209 HydrophobicContact CG1-CG2 3.99Å; V181-I213 HydrophobicContact CB-CD1 4.29Å; V181-I213 HydrophobicContact CG1-CD1 3.79Å
182	L	98.9	Very high	98.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.1	-49.2	176.9	-56	175.5	0	0	0	110.5	F133 L143 V155 V159 L163 L175 A179 P180 K185 V186	F133-L182 HydrophobicContact CD1-CD1 4.26Å; L143-L182 HydrophobicContact CB-CD1 4.1Å; L143-L182 HydrophobicContact CB-CD2 4.21Å; L143-L182 HydrophobicContact CD1-CD1 4.01Å; V155-L182 HydrophobicContact CG1-CD2 4.32Å; V155-L182 HydrophobicContact CG2-CD2 4.14Å; V159-L182 HydrophobicContact CG1-CD1 4.2Å; L163-L182 HydrophobicContact CD1-CB 3.92Å; L175-L182 HydrophobicContact CD2-CB 4.3Å; A179-L182 VanDerWaalsContact O-CB 3.26Å; A179-L182 WeakPolarHBondContact O-CB 3.45Å; A179-L182 VanDerWaalsContact O-CG 3.27Å; A179-L182 WeakPolarHBondContact O-CG 3.35Å; A179-L182 PolarHBondContact O-N 3.38Å; P180-L182 PolarHBondContact O-N 3.48Å; L182-K185 PolarHBondContact O-N 2.98Å; L182-V186 WeakPolarHBondContact O-CB 3.43Å; L182-V186 VanDerWaalsContact O-CG2 3.3Å; L182-V186 WeakPolarHBondContact O-CG2 3.4Å; L182-V186 PolarHBondContact O-N 3.41Å; L182-V186 VanDerWaalsContact O-N 3.13Å
183	A	98.8	Very high	98.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.7	-43.3	176.4	0	0	0	0	0	110.9	L175 P180 K185 V186 L187	L175-A183 HydrophobicContact CD1-CB 3.91Å; L175-A183 HydrophobicContact CD2-CB 4Å; P180-A183 PolarHBondContact O-N 3.15Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.31Å; A183-V186 PolarHBondContact O-N 3.11Å; A183-L187 HydrophobicContact CB-CD1 4.38Å; A183-L187 WeakPolarHBondContact O-CB 3.39Å; A183-L187 PolarHBondContact O-N 2.89Å
184	A	98.6	Very high	98.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-39.7	178.1	0	0	0	0	0	112.9	P180 I213 L216 A218	P180-A184 PolarHBondContact O-N 2.81Å; A184-I213 HydrophobicContact CB-CD1 3.64Å; A184-I213 HydrophobicContact CB-CG2 4.4Å; A184-L216 HydrophobicContact CB-CB 4.16Å; A184-L216 HydrophobicContact CB-CD1 4.13Å; A184-A218 HydrophobicContact CB-CB 3.51Å
185	K	98.5	Very high	98.3	Very high	82 Å²	82	22.2 Å²	22.2	36%	0.357	11%	0.105	S	C	.	.	H	α-helix	trans	-70.7	-37.4	177.3	-176.3	66.9	-177	-154	0	113.1	K151 C153 V155 V181 L182 A183 L216	K151-K185 PolarHBondContact O-NZ 2.99Å; C153-K185 WeakPolarHBondContact O-CE 3.49Å; C153-K185 PolarHBondContact O-NZ 3Å; V155-K185 HydrophobicContact CG2-CB 3.97Å; V155-K185 HydrophobicContact CG2-CG 3.87Å; V181-K185 WeakPolarHBondContact O-CB 3.29Å; V181-K185 PolarHBondContact O-N 3.42Å; L182-K185 PolarHBondContact O-N 2.98Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.31Å; K185-L216 HydrophobicContact CB-CD2 4.34Å; K185-L216 HydrophobicContact CD-CD2 3.48Å; K185-L216 VanDerWaalsContact CD-CD2 3.48Å
186	V	98.6	Very high	98.2	Very high	21 Å²	21	23.5 Å²	23.5	13%	0.127	11%	0.111	C	C	.	.	H	α-helix	trans	-94.9	-35.8	-168.1	177.6	0	0	0	0	112.8	V155 E160 L163 K164 L182 A183	V155-V186 HydrophobicContact CB-CG2 4.12Å; V155-V186 HydrophobicContact CG1-CG2 4.17Å; V155-V186 HydrophobicContact CG2-CG2 3.92Å; E160-V186 HydrophobicContact CB-CG2 4.34Å; E160-V186 HydrophobicContact CG-CG1 4.01Å; E160-V186 HydrophobicContact CG-CG2 4.02Å; L163-V186 HydrophobicContact CB-CG1 4.01Å; L163-V186 HydrophobicContact CD1-CB 4.18Å; L163-V186 HydrophobicContact CD1-CG2 4Å; K164-V186 HydrophobicContact CD-CG1 4.39Å; K164-V186 HydrophobicContact CG-CG1 3.76Å; L182-V186 WeakPolarHBondContact O-CB 3.43Å; L182-V186 VanDerWaalsContact O-CG2 3.3Å; L182-V186 WeakPolarHBondContact O-CG2 3.4Å; L182-V186 PolarHBondContact O-N 3.41Å; L182-V186 VanDerWaalsContact O-N 3.13Å; A183-V186 PolarHBondContact O-N 3.11Å
187	L	98.2	Very high	98.2	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	13%	0.126	C	C	.	.	S	Bend	trans	-108.8	107.8	-172.1	-52.8	-178.8	0	0	0	110	H167 I173 A183 G189 V190 V236	H167-L187 HydrophobicContact CB-CD1 4.3Å; H167-L187 HydrophobicContact CB-CD2 3.77Å; I173-L187 HydrophobicContact CD1-CD1 4.22Å; A183-L187 HydrophobicContact CB-CD1 4.38Å; A183-L187 WeakPolarHBondContact O-CB 3.39Å; A183-L187 PolarHBondContact O-N 2.89Å; L187-G189 PolarHBondContact O-N 3.46Å; L187-V190 HydrophobicContact CB-CB 4.04Å; L187-V190 HydrophobicContact CB-CG1 4.26Å; L187-V190 VanDerWaalsContact O-CG1 3.28Å; L187-V190 WeakPolarHBondContact O-CG1 3.48Å; L187-V190 PolarHBondContact O-N 3.15Å; L187-V236 HydrophobicContact CD1-CG2 3.99Å
188	R	92.8	Very high	98	Very high	246 Å²	246	32.8 Å²	32.8	93%	0.928	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	129.6	-175.9	-69.9	-171.9	176.7	-148.3	-0.4	112	V190	R188-V190 PolarHBondContact O-N 2.86Å
189	G	95.5	Very high	97.8	Very high	35 Å²	35	37.1 Å²	37.1	36%	0.361	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	17.5	174.3	0	0	0	0	0	114.5	L187 G217	L187-G189 PolarHBondContact O-N 3.46Å; G189-G217 WeakPolarHBondContact CA-O 3.5Å; G189-G217 PolarHBondContact N-O 3.31Å
190	V	98.6	Very high	97.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.			trans	-63.6	148	173.9	69.2	0	0	0	0	111	L187 R188 V192 A218 K219 N234 V236	L187-V190 HydrophobicContact CB-CB 4.04Å; L187-V190 HydrophobicContact CB-CG1 4.26Å; L187-V190 VanDerWaalsContact O-CG1 3.28Å; L187-V190 WeakPolarHBondContact O-CG1 3.48Å; L187-V190 PolarHBondContact O-N 3.15Å; R188-V190 PolarHBondContact O-N 2.86Å; V190-V192 HydrophobicContact CG1-CG1 4.18Å; V190-V192 HydrophobicContact CG2-CG1 4.18Å; V190-A218 HydrophobicContact CG1-CB 3.78Å; V190-A218 WeakPolarHBondContact O-CA 3.15Å; V190-A218 WeakPolarHBondContact O-CB 3.45Å; V190-K219 PolarHBondContact O-N 2.87Å; V190-N234 HydrophobicContact CG2-CB 4.33Å; V190-V236 HydrophobicContact CG2-CB 3.81Å; V190-V236 HydrophobicContact CG2-CG1 3.96Å; V190-V236 HydrophobicContact CG2-CG2 3.71Å
191	E	98.8	Very high	97.2	Very high	45 Å²	45	45.1 Å²	45.1	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.2	174.5	-50	-172.1	160.7	0	0	110	K219 F221 H229 D231	E191-K219 WeakPolarHBondContact CA-O 3.47Å; E191-K219 HydrophobicContact CG-CB 4.27Å; E191-K219 HydrophobicContact CG-CD 4.21Å; E191-K219 IonicContact OE1-NZ 3.32Å; E191-K219 PolarHBondContact OE1-NZ 2.91Å; E191-F221 HydrophobicContact CB-CD2 4.01Å; E191-F221 HydrophobicContact CB-CE2 3.65Å; E191-F221 HydrophobicContact CG-CE2 3.81Å; E191-H229 WeakPolarHBondContact CB-NE2 3.38Å; E191-H229 IonicContact OE2-NE2 3.96Å; E191-D231 HydrophobicContact CB-CB 3.9Å; E191-D231 PolarHBondContact N-OD2 2.78Å
192	V	98.9	Very high	97	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	162.5	-177.9	-61.5	0	0	0	0	111.5	P180 V190 I213 K219 H220 F221 V236 T238	P180-V192 HydrophobicContact CB-CB 4.03Å; P180-V192 HydrophobicContact CB-CG1 4.28Å; P180-V192 HydrophobicContact CB-CG2 4.26Å; V190-V192 HydrophobicContact CG1-CG1 4.18Å; V190-V192 HydrophobicContact CG2-CG1 4.18Å; V192-I213 HydrophobicContact CG2-CD1 4.08Å; V192-I213 HydrophobicContact CG2-CG1 4.35Å; V192-I213 HydrophobicContact CG2-CG2 3.48Å; V192-I213 VanDerWaalsContact CG2-CG2 3.48Å; V192-K219 PolarHBondContact N-O 2.96Å; V192-H220 CarbonylContact O-C 2.98Å; V192-H220 VanDerWaalsContact O-CA 3.32Å; V192-H220 WeakPolarHBondContact O-CA 3.49Å; V192-F221 PolarHBondContact O-N 2.98Å; V192-V236 HydrophobicContact CG1-CG1 4.18Å; V192-T238 WeakPolarHBondContact CA-OG1 3.29Å; V192-T238 HydrophobicContact CB-CG2 4.01Å; V192-T238 HydrophobicContact CG1-CG2 3.86Å
193	T	98.8	Very high	96.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.			trans	-120.1	144.8	164.3	-170.9	0	0	0	0	110.4	P180 G195 F221 K223 H229 T238 P240	P180-T193 WeakPolarHBondContact CG-O 3.3Å; T193-G195 PolarHBondContact OG1-N 3.34Å; T193-G195 VanDerWaalsContact OG1-N 3.07Å; T193-F221 WeakPolarHBondContact CB-O 3.23Å; T193-F221 PolarHBondContact OG1-O 3.18Å; T193-K223 HydrophobicContact CG2-CB 3.97Å; T193-K223 HydrophobicContact CG2-CG 3.85Å; T193-K223 WeakPolarHBondContact OG1-CB 3.3Å; T193-H229 HydrophobicContact CG2-CB 3.84Å; T193-T238 WeakPolarHBondContact CG2-O 3.39Å; T193-T238 PolarHBondContact N-OG1 3.36Å; T193-P240 HydrophobicContact CG2-CG 4.31Å
194	V	98.6	Very high	96.9	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.024	26%	0.26	C	S	.	.			trans	-121.4	16.3	162.9	-66.9	0	0	0	0	110.9	P180 T209 A210 I213 H220 M243	P180-V194 HydrophobicContact CB-CG1 3.87Å; P180-V194 HydrophobicContact CG-CG1 4.05Å; V194-T209 HydrophobicContact CB-CG2 4.21Å; V194-T209 HydrophobicContact CG1-CG2 4.07Å; V194-T209 HydrophobicContact CG2-CG2 3.89Å; V194-A210 HydrophobicContact CG2-CB 4.46Å; V194-I213 HydrophobicContact CG1-CD1 4.31Å; V194-I213 HydrophobicContact CG1-CG1 4.2Å; V194-I213 HydrophobicContact CG2-CG1 4.34Å; V194-H220 WeakPolarHBondContact CG2-NE2 3.4Å; V194-H220 PolarHBondContact N-NE2 3.49Å; V194-H220 VanDerWaalsContact N-NE2 3.16Å; V194-M243 HydrophobicContact CB-CE 4.14Å; V194-M243 VanDerWaalsContact O-CB 3.28Å; V194-M243 WeakPolarHBondContact O-CB 3.25Å
195	G	98.3	Very high	96.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	108.5	-130.2	-174.7	0	0	0	0	0	112.5	T193 W204 H220 V222 K223 P240	T193-G195 PolarHBondContact OG1-N 3.34Å; T193-G195 VanDerWaalsContact OG1-N 3.07Å; G195-W204 VanDerWaalsContact CA-CZ3 3.41Å; G195-H220 PolarHBondContact O-CE1 3.3Å; G195-H220 VanDerWaalsContact O-CE1 3.23Å; G195-H220 PolarHBondContact O-NE2 3.17Å; G195-V222 WeakPolarHBondContact O-CA 3.46Å; G195-K223 PolarHBondContact O-N 3.13Å; G195-P240 VanDerWaalsContact CA-CG 3.5Å
196	H	97.9	Very high	96.7	Very high	26 Å²	26	53 Å²	53	12%	0.12	28%	0.279	C	S	.	.			trans	-97	163.3	-179.3	-93.2	-113.1	0	0	0	113.3	E200 W204 A207 E224	H196-E200 IonicContact CE1-OE1 2.89Å; H196-E200 IonicContact ND1-OE1 2.98Å; H196-W204 HydrophobicContact CB-CB 4.35Å; H196-W204 HydrophobicContact CB-CD2 3.74Å; H196-W204 HydrophobicContact CB-CE3 4.37Å; H196-W204 HydrophobicContact CB-CG 3.7Å; H196-W204 HydrophobicContact CB-CZ2 4.4Å; H196-W204 AromaticContact CD2-CE2 3.35Å; H196-W204 AromaticContact CD2-CZ2 3.34Å; H196-W204 WeakPolarHBondContact CD2-CZ2 3.4Å; H196-W204 AromaticContact CD2-NE1 3.35Å; H196-W204 PolarHBondContact CD2-NE1 2.98Å; H196-W204 VanDerWaalsContact CD2-NE1 3.35Å; H196-W204 AromaticContact CG-CD1 3.89Å; H196-W204 AromaticContact CG-CE2 3.72Å; H196-W204 AromaticContact CG-NE1 3.45Å; H196-W204 AromaticContact NE2-NE1 3.91Å; H196-A207 WeakPolarHBondContact O-CA 3.21Å; H196-E224 IonicContact CD2-OE1 3.14Å; H196-E224 IonicContact CE1-OE1 3.76Å; H196-E224 IonicContact NE2-OE1 3.79Å; H196-E224 PolarHBondContact NE2-OE1 3.29Å
197	E	97.6	Very high	96.6	Very high	68 Å²	68	52.5 Å²	52.5	32%	0.318	28%	0.276	S	S	.	.	S	Bend	trans	-94.6	-12	177.9	-48.8	-163.3	151.9	0	0	113	A210 K214 H220 V222	E197-A210 HydrophobicContact CB-CB 4.14Å; E197-A210 HydrophobicContact CG-CB 3.82Å; E197-K214 WeakPolarHBondContact OE1-CE 3.39Å; E197-K214 IonicContact OE1-NZ 3.68Å; E197-K214 PolarHBondContact OE1-NZ 3.45Å; E197-K214 IonicContact OE2-NZ 2.99Å; E197-K214 PolarHBondContact OE2-NZ 2.86Å; E197-H220 WeakPolarHBondContact CG-ND1 3.29Å; E197-H220 IonicContact OE1-CE1 2.61Å; E197-H220 IonicContact OE1-CG 3.08Å; E197-H220 IonicContact OE1-ND1 2.69Å; E197-H220 PolarHBondContact OE1-ND1 3.35Å; E197-V222 HydrophobicContact CG-CG2 3.73Å
198	Q	95.9	Very high	96.5	Very high	138 Å²	138	55 Å²	55	65%	0.645	30%	0.303	S	S	*	.	S	Bend	trans	-123.5	144.2	-178.4	-63.4	176.5	22.9	0	0	110.4
199	E	93.8	Very high	96.8	Very high	105 Å²	105	44 Å²	44	49%	0.491	26%	0.264	S	S	.	.			trans	-69.2	134.4	167.5	-157.4	-58.7	107	0	0	108	G201 G202	E199-G201 PolarHBondContact OE1-N 2.75Å; E199-G201 PolarHBondContact OE2-N 3.1Å; E199-G202 WeakPolarHBondContact OE1-CA 3.46Å; E199-G202 PolarHBondContact OE1-N 2.91Å; E199-G202 PolarHBondContact OE2-N 3.27Å
200	E	94.3	Very high	96.9	Very high	85 Å²	85	42.3 Å²	42.3	40%	0.397	25%	0.246	S	C	.	.			trans	-130.9	74.6	-177.7	-65.9	-175.4	164.8	0	0	110.5	H196 G202 K203	H196-E200 IonicContact CE1-OE1 2.89Å; H196-E200 IonicContact ND1-OE1 2.98Å; E200-G202 VanDerWaalsContact C-N 3.31Å; E200-G202 PolarHBondContact O-N 3.28Å; E200-K203 HydrophobicContact CB-CB 4.28Å; E200-K203 VanDerWaalsContact O-CB 3.23Å; E200-K203 WeakPolarHBondContact O-CB 3.16Å; E200-K203 PolarHBondContact O-N 3.43Å; E200-K203 VanDerWaalsContact O-N 3.09Å
201	G	91.9	Very high	96.8	Very high	84 Å²	84	47.5 Å²	47.5	87%	0.866	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	33.4	170.8	0	0	0	0	0	113.9	E199	E199-G201 PolarHBondContact OE1-N 2.75Å; E199-G201 PolarHBondContact OE2-N 3.1Å
202	G	94.1	Very high	96.8	Very high	26 Å²	26	46.2 Å²	46.2	27%	0.268	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-11.1	-175.9	0	0	0	0	0	114.3	E199 E200 W204 Q245	E199-G202 WeakPolarHBondContact OE1-CA 3.46Å; E199-G202 PolarHBondContact OE1-N 2.91Å; E199-G202 PolarHBondContact OE2-N 3.27Å; E200-G202 VanDerWaalsContact C-N 3.31Å; E200-G202 PolarHBondContact O-N 3.28Å; G202-W204 VanDerWaalsContact C-N 3.34Å; G202-W204 PolarHBondContact O-N 2.88Å; G202-Q245 VanDerWaalsContact O-CG 3.27Å; G202-Q245 WeakPolarHBondContact O-CG 3.43Å; G202-Q245 PolarHBondContact O-NE2 2.88Å
203	K	96.6	Very high	96.8	Very high	66 Å²	66	46.2 Å²	46.2	29%	0.287	27%	0.268	S	S	.	.	S	Bend	trans	-65.7	-35.1	-175.4	-173.2	-178.7	170.8	-164.4	0	112.7	E200 P205 E224 C244 Q245	E200-K203 HydrophobicContact CB-CB 4.28Å; E200-K203 VanDerWaalsContact O-CB 3.23Å; E200-K203 WeakPolarHBondContact O-CB 3.16Å; E200-K203 PolarHBondContact O-N 3.43Å; E200-K203 VanDerWaalsContact O-N 3.09Å; K203-P205 WeakPolarHBondContact O-CD 3.43Å; K203-E224 IonicContact NZ-OE1 2.86Å; K203-E224 IonicContact NZ-OE2 2.74Å; K203-E224 PolarHBondContact NZ-OE2 2.84Å; K203-C244 CarbonylContact O-C 3.51Å; K203-C244 WeakPolarHBondContact O-CA 3.47Å; K203-Q245 PolarHBondContact O-N 3.47Å
204	W	97.8	Very high	96.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.008	28%	0.284	C	S	.	.			trans	-126.3	70.2	-174.8	-63.3	110.3	0	0	0	111.3	G195 H196 G202 Y206 A207 K223 P240 C244	G195-W204 VanDerWaalsContact CA-CZ3 3.41Å; H196-W204 HydrophobicContact CB-CB 4.35Å; H196-W204 HydrophobicContact CB-CD2 3.74Å; H196-W204 HydrophobicContact CB-CE3 4.37Å; H196-W204 HydrophobicContact CB-CG 3.7Å; H196-W204 HydrophobicContact CB-CZ2 4.4Å; H196-W204 AromaticContact CD2-CE2 3.35Å; H196-W204 AromaticContact CD2-CZ2 3.34Å; H196-W204 WeakPolarHBondContact CD2-CZ2 3.4Å; H196-W204 AromaticContact CD2-NE1 3.35Å; H196-W204 PolarHBondContact CD2-NE1 2.98Å; H196-W204 VanDerWaalsContact CD2-NE1 3.35Å; H196-W204 AromaticContact CG-CD1 3.89Å; H196-W204 AromaticContact CG-CE2 3.72Å; H196-W204 AromaticContact CG-NE1 3.45Å; H196-W204 AromaticContact NE2-NE1 3.91Å; G202-W204 VanDerWaalsContact C-N 3.34Å; G202-W204 PolarHBondContact O-N 2.88Å; W204-Y206 PolarHBondContact O-N 3.33Å; W204-A207 HydrophobicContact CB-CB 4.28Å; W204-A207 WeakPolarHBondContact O-CB 3.42Å; W204-A207 PolarHBondContact O-N 2.78Å; W204-K223 WeakPolarHBondContact CH2-O 3.29Å; W204-P240 HydrophobicContact CH2-CB 3.98Å; W204-P240 HydrophobicContact CH2-CG 4.23Å; W204-P240 HydrophobicContact CZ3-CB 3.76Å; W204-P240 HydrophobicContact CZ3-CG 4.43Å; W204-C244 HydrophobicContact CD2-CB 4.4Å; W204-C244 HydrophobicContact CE3-CB 3.81Å; W204-C244 HydrophobicContact CH2-CB 3.63Å; W204-C244 HydrophobicContact CZ2-CB 4.23Å; W204-C244 HydrophobicContact CZ3-CB 3.39Å
205	P	97	Very high	96.7	Very high	59 Å²	59	52.7 Å²	52.7	38%	0.383	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.7	-172.4	26.3	-34.7	0	0	0	113.9	K203 Q245	K203-P205 WeakPolarHBondContact O-CD 3.43Å; P205-Q245 HydrophobicContact CG-CG 4.36Å
206	Y	96.8	Very high	96.6	Very high	97 Å²	97	53.9 Å²	53.9	38%	0.38	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	22.1	-177.3	-52.3	-68.2	0	0	0	113.6	F137 W204 G208 T209 M243	F137-Y206 HydrophobicContact CZ-CE1 4.03Å; W204-Y206 PolarHBondContact O-N 3.33Å; Y206-G208 PolarHBondContact O-N 3Å; Y206-G208 VanDerWaalsContact O-N 3.09Å; Y206-T209 VanDerWaalsContact O-CB 3.25Å; Y206-T209 WeakPolarHBondContact O-CB 3.31Å; Y206-T209 PolarHBondContact O-N 3.07Å; Y206-T209 PolarHBondContact O-OG1 3.43Å; Y206-M243 VanDerWaalsContact CB-CE 3.44Å; Y206-M243 HydrophobicContact CD2-SD 3.97Å; Y206-M243 HydrophobicContact CG-CE 4.27Å; Y206-M243 HydrophobicContact CG-SD 4.24Å
207	A	96.9	Very high	96.5	Very high	10 Å²	10	55 Å²	55	8%	0.083	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-30.7	-176.6	0	0	0	0	0	114.4	H196 W204 T209 A210	H196-A207 WeakPolarHBondContact O-CA 3.21Å; W204-A207 HydrophobicContact CB-CB 4.28Å; W204-A207 WeakPolarHBondContact O-CB 3.42Å; W204-A207 PolarHBondContact O-N 2.78Å; A207-T209 PolarHBondContact O-N 3.33Å; A207-A210 WeakPolarHBondContact O-CB 3.13Å; A207-A210 PolarHBondContact O-N 2.89Å; A207-A210 VanDerWaalsContact O-N 3.07Å
208	G	96.6	Very high	96.5	Very high	58 Å²	58	52.1 Å²	52.1	60%	0.598	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.2	175.1	0	0	0	0	0	114.6	Y206 A210 E211	Y206-G208 PolarHBondContact O-N 3Å; Y206-G208 VanDerWaalsContact O-N 3.09Å; G208-A210 PolarHBondContact O-N 3.3Å; G208-E211 PolarHBondContact O-N 3.33Å
209	T	97.6	Very high	96.7	Very high	16 Å²	16	50.8 Å²	50.8	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-31.9	174.1	-52.2	0	0	0	0	111.8	F146 I178 V181 V194 Y206 A207 E211 A212 I213 M243	F146-T209 HydrophobicContact CZ-CG2 4.42Å; I178-T209 HydrophobicContact CD1-CG2 3.48Å; I178-T209 VanDerWaalsContact CD1-CG2 3.48Å; V181-T209 HydrophobicContact CG1-CG2 3.99Å; V194-T209 HydrophobicContact CB-CG2 4.21Å; V194-T209 HydrophobicContact CG1-CG2 4.07Å; V194-T209 HydrophobicContact CG2-CG2 3.89Å; Y206-T209 VanDerWaalsContact O-CB 3.25Å; Y206-T209 WeakPolarHBondContact O-CB 3.31Å; Y206-T209 PolarHBondContact O-N 3.07Å; Y206-T209 PolarHBondContact O-OG1 3.43Å; A207-T209 PolarHBondContact O-N 3.33Å; T209-E211 VanDerWaalsContact C-N 3.28Å; T209-E211 PolarHBondContact O-N 3.09Å; T209-A212 WeakPolarHBondContact O-CB 3.42Å; T209-A212 PolarHBondContact O-N 3.16Å; T209-A212 VanDerWaalsContact O-N 3.09Å; T209-I213 WeakPolarHBondContact O-CG1 3.25Å; T209-I213 PolarHBondContact O-N 2.98Å; T209-M243 HydrophobicContact CG2-CE 4.03Å; T209-M243 WeakPolarHBondContact OG1-CE 3.45Å
210	A	98.1	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-39.3	178.3	0	0	0	0	0	112.4	V194 E197 A207 G208 I213 K214	V194-A210 HydrophobicContact CG2-CB 4.46Å; E197-A210 HydrophobicContact CB-CB 4.14Å; E197-A210 HydrophobicContact CG-CB 3.82Å; A207-A210 WeakPolarHBondContact O-CB 3.13Å; A207-A210 PolarHBondContact O-N 2.89Å; A207-A210 VanDerWaalsContact O-N 3.07Å; G208-A210 PolarHBondContact O-N 3.3Å; A210-I213 WeakPolarHBondContact O-CB 3.43Å; A210-I213 PolarHBondContact O-N 3.45Å; A210-K214 WeakPolarHBondContact O-CG 3.49Å; A210-K214 PolarHBondContact O-N 3.14Å; A210-K214 VanDerWaalsContact O-N 3.12Å
211	E	97.6	Very high	97.1	Very high	108 Å²	108	46.2 Å²	46.2	51%	0.505	29%	0.289	S	S	.	.	H	α-helix	trans	-69.3	-36.3	176.2	-67.6	-53.7	123.6	0	0	112.1	G208 T209 K214 A215	G208-E211 PolarHBondContact O-N 3.33Å; T209-E211 VanDerWaalsContact C-N 3.28Å; T209-E211 PolarHBondContact O-N 3.09Å; E211-K214 PolarHBondContact O-N 2.73Å; E211-K214 IonicContact OE1-NZ 2.71Å; E211-K214 PolarHBondContact OE1-NZ 2.87Å; E211-A215 WeakPolarHBondContact O-CB 3.32Å; E211-A215 PolarHBondContact O-N 3.32Å
212	A	97.6	Very high	97.4	Very high	19 Å²	19	45.4 Å²	45.4	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-40.8	173.4	0	0	0	0	0	111.6	F146 T209 K214 A215 L216	F146-A212 HydrophobicContact CE2-CB 3.87Å; F146-A212 HydrophobicContact CZ-CB 3.71Å; T209-A212 WeakPolarHBondContact O-CB 3.42Å; T209-A212 PolarHBondContact O-N 3.16Å; T209-A212 VanDerWaalsContact O-N 3.09Å; A212-K214 VanDerWaalsContact C-N 3.34Å; A212-K214 PolarHBondContact O-N 2.69Å; A212-A215 PolarHBondContact O-N 3.07Å; A212-L216 WeakPolarHBondContact O-CB 3.47Å; A212-L216 VanDerWaalsContact O-CG 3.23Å; A212-L216 WeakPolarHBondContact O-CG 3.05Å; A212-L216 PolarHBondContact O-N 2.89Å
213	I	98.4	Very high	97.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.2	-47.1	173.5	-67.6	-63.4	0	0	0	111	V181 A184 V192 V194 T209 A210 L216 A218 H220	V181-I213 HydrophobicContact CB-CD1 4.29Å; V181-I213 HydrophobicContact CG1-CD1 3.79Å; A184-I213 HydrophobicContact CB-CD1 3.64Å; A184-I213 HydrophobicContact CB-CG2 4.4Å; V192-I213 HydrophobicContact CG2-CD1 4.08Å; V192-I213 HydrophobicContact CG2-CG1 4.35Å; V192-I213 HydrophobicContact CG2-CG2 3.48Å; V192-I213 VanDerWaalsContact CG2-CG2 3.48Å; V194-I213 HydrophobicContact CG1-CD1 4.31Å; V194-I213 HydrophobicContact CG1-CG1 4.2Å; V194-I213 HydrophobicContact CG2-CG1 4.34Å; T209-I213 WeakPolarHBondContact O-CG1 3.25Å; T209-I213 PolarHBondContact O-N 2.98Å; A210-I213 WeakPolarHBondContact O-CB 3.43Å; A210-I213 PolarHBondContact O-N 3.45Å; I213-L216 PolarHBondContact O-N 2.98Å; I213-A218 HydrophobicContact CG2-CB 3.79Å; I213-A218 PolarHBondContact O-N 2.96Å; I213-H220 HydrophobicContact CG2-CB 4.06Å
214	K	98.1	Very high	97.7	Very high	76 Å²	76	46.6 Å²	46.6	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-44.4	177.3	-66	169.3	-169.2	170.7	0	111.5	E197 A210 E211 A212 L216 G217 A218 H220	E197-K214 WeakPolarHBondContact OE1-CE 3.39Å; E197-K214 IonicContact OE1-NZ 3.68Å; E197-K214 PolarHBondContact OE1-NZ 3.45Å; E197-K214 IonicContact OE2-NZ 2.99Å; E197-K214 PolarHBondContact OE2-NZ 2.86Å; A210-K214 WeakPolarHBondContact O-CG 3.49Å; A210-K214 PolarHBondContact O-N 3.14Å; A210-K214 VanDerWaalsContact O-N 3.12Å; E211-K214 PolarHBondContact O-N 2.73Å; E211-K214 IonicContact OE1-NZ 2.71Å; E211-K214 PolarHBondContact OE1-NZ 2.87Å; A212-K214 VanDerWaalsContact C-N 3.34Å; A212-K214 PolarHBondContact O-N 2.69Å; K214-L216 VanDerWaalsContact C-N 3.26Å; K214-L216 PolarHBondContact O-N 3.05Å; K214-G217 PolarHBondContact O-N 2.85Å; K214-A218 WeakPolarHBondContact CA-O 3.38Å; K214-H220 HydrophobicContact CG-CB 4.37Å
215	A	97.5	Very high	97.7	Very high	63 Å²	63	47.2 Å²	47.2	52%	0.521	27%	0.27	S	S	.	.	H	α-helix	trans	-64.7	-28.1	178.3	0	0	0	0	0	113.5	K151 E211 A212 G217	K151-A215 HydrophobicContact CB-CB 4.19Å; K151-A215 HydrophobicContact CD-CB 4.17Å; E211-A215 WeakPolarHBondContact O-CB 3.32Å; E211-A215 PolarHBondContact O-N 3.32Å; A212-A215 PolarHBondContact O-N 3.07Å; A215-G217 PolarHBondContact O-N 2.87Å
216	L	97.2	Very high	97.7	Very high	26 Å²	26	46.7 Å²	46.7	14%	0.136	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.3	173.5	-71.8	172.1	0	0	0	113.3	F146 K151 A184 K185 A212 I213 K214	F146-L216 HydrophobicContact CE2-CD1 4.3Å; K151-L216 HydrophobicContact CB-CD2 4.42Å; K151-L216 WeakPolarHBondContact O-CD2 3.35Å; A184-L216 HydrophobicContact CB-CB 4.16Å; A184-L216 HydrophobicContact CB-CD1 4.13Å; K185-L216 HydrophobicContact CB-CD2 4.34Å; K185-L216 HydrophobicContact CD-CD2 3.48Å; K185-L216 VanDerWaalsContact CD-CD2 3.48Å; A212-L216 WeakPolarHBondContact O-CB 3.47Å; A212-L216 VanDerWaalsContact O-CG 3.23Å; A212-L216 WeakPolarHBondContact O-CG 3.05Å; A212-L216 PolarHBondContact O-N 2.89Å; I213-L216 PolarHBondContact O-N 2.98Å; K214-L216 VanDerWaalsContact C-N 3.26Å; K214-L216 PolarHBondContact O-N 3.05Å
217	G	95.4	Very high	97.7	Very high	48 Å²	48	45.9 Å²	45.9	50%	0.495	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	15.2	178.6	0	0	0	0	0	114.3	G189 K214 A215	G189-G217 WeakPolarHBondContact CA-O 3.5Å; G189-G217 PolarHBondContact N-O 3.31Å; K214-G217 PolarHBondContact O-N 2.85Å; A215-G217 PolarHBondContact O-N 2.87Å
218	A	98.3	Very high	97.8	Very high	8 Å²	8	46.3 Å²	46.3	7%	0.066	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-97.7	166.3	171	0	0	0	0	0	111.1	A184 V190 I213 K214	A184-A218 HydrophobicContact CB-CB 3.51Å; V190-A218 HydrophobicContact CG1-CB 3.78Å; V190-A218 WeakPolarHBondContact O-CA 3.15Å; V190-A218 WeakPolarHBondContact O-CB 3.45Å; I213-A218 HydrophobicContact CG2-CB 3.79Å; I213-A218 PolarHBondContact O-N 2.96Å; K214-A218 WeakPolarHBondContact CA-O 3.38Å
219	K	98.6	Very high	97.9	Very high	110 Å²	110	44.5 Å²	44.5	48%	0.478	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.4	173.4	-57.9	-175.6	-160	160	0	109.7	V190 E191 V192 F221	V190-K219 PolarHBondContact O-N 2.87Å; E191-K219 WeakPolarHBondContact CA-O 3.47Å; E191-K219 HydrophobicContact CG-CB 4.27Å; E191-K219 HydrophobicContact CG-CD 4.21Å; E191-K219 IonicContact OE1-NZ 3.32Å; E191-K219 PolarHBondContact OE1-NZ 2.91Å; V192-K219 PolarHBondContact N-O 2.96Å; K219-F221 HydrophobicContact CB-CD2 4.47Å; K219-F221 HydrophobicContact CB-CE2 3.89Å; K219-F221 HydrophobicContact CD-CE2 4.49Å
220	H	98.8	Very high	98	Very high	18 Å²	18	45.4 Å²	45.4	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	138	173.5	-176.8	-104.6	0	0	0	110.9	V192 V194 G195 E197 I213 K214	V192-H220 CarbonylContact O-C 2.98Å; V192-H220 VanDerWaalsContact O-CA 3.32Å; V192-H220 WeakPolarHBondContact O-CA 3.49Å; V194-H220 WeakPolarHBondContact CG2-NE2 3.4Å; V194-H220 PolarHBondContact N-NE2 3.49Å; V194-H220 VanDerWaalsContact N-NE2 3.16Å; G195-H220 PolarHBondContact O-CE1 3.3Å; G195-H220 VanDerWaalsContact O-CE1 3.23Å; G195-H220 PolarHBondContact O-NE2 3.17Å; E197-H220 WeakPolarHBondContact CG-ND1 3.29Å; E197-H220 IonicContact OE1-CE1 2.61Å; E197-H220 IonicContact OE1-CG 3.08Å; E197-H220 IonicContact OE1-ND1 2.69Å; E197-H220 PolarHBondContact OE1-ND1 3.35Å; I213-H220 HydrophobicContact CG2-CB 4.06Å; K214-H220 HydrophobicContact CG-CB 4.37Å
221	F	98.7	Very high	98	Very high	76 Å²	76	45.6 Å²	45.6	33%	0.333	26%	0.257	S	S	.	.			trans	-122.9	128.4	172.1	-74.1	-97.7	0	0	0	109.7	E191 V192 T193 K219 K223 H229	E191-F221 HydrophobicContact CB-CD2 4.01Å; E191-F221 HydrophobicContact CB-CE2 3.65Å; E191-F221 HydrophobicContact CG-CE2 3.81Å; V192-F221 PolarHBondContact O-N 2.98Å; T193-F221 WeakPolarHBondContact CB-O 3.23Å; T193-F221 PolarHBondContact OG1-O 3.18Å; K219-F221 HydrophobicContact CB-CD2 4.47Å; K219-F221 HydrophobicContact CB-CE2 3.89Å; K219-F221 HydrophobicContact CD-CE2 4.49Å; F221-K223 PolarHBondContact O-N 3.13Å; F221-H229 AromaticContact CD1-CE1 3.84Å; F221-H229 AromaticContact CD2-CE1 3.64Å; F221-H229 AromaticContact CD2-NE2 3.47Å; F221-H229 WeakPolarHBondContact CD2-NE2 3.33Å; F221-H229 AromaticContact CE2-NE2 3.88Å; F221-H229 AromaticContact CG-CE1 3.5Å; F221-H229 AromaticContact CG-ND1 3.92Å; F221-H229 AromaticContact CG-NE2 3.81Å
222	V	98.6	Very high	98	Very high	68 Å²	68	46.7 Å²	46.7	41%	0.412	26%	0.262	S	S	.	.			trans	-67.4	131.1	176.8	174.8	0	0	0	0	110.2	G195 E197	G195-V222 WeakPolarHBondContact O-CA 3.46Å; E197-V222 HydrophobicContact CG-CG2 3.73Å
223	K	98.4	Very high	98	Very high	48 Å²	48	54.9 Å²	54.9	21%	0.209	29%	0.294	C	S	.	.			trans	-140.3	143.5	175.1	-71	-59.2	-171.2	179.8	0	111	T193 G195 W204 F221 E227 H229 P240	T193-K223 HydrophobicContact CG2-CB 3.97Å; T193-K223 HydrophobicContact CG2-CG 3.85Å; T193-K223 WeakPolarHBondContact OG1-CB 3.3Å; G195-K223 PolarHBondContact O-N 3.13Å; W204-K223 WeakPolarHBondContact CH2-O 3.29Å; F221-K223 PolarHBondContact O-N 3.13Å; K223-E227 HydrophobicContact CB-CB 4.14Å; K223-E227 HydrophobicContact CD-CB 3.91Å; K223-E227 HydrophobicContact CG-CB 4.44Å; K223-E227 IonicContact NZ-OE1 3.04Å; K223-E227 PolarHBondContact NZ-OE1 2.97Å; K223-E227 VanDerWaalsContact NZ-OE1 3.14Å; K223-H229 HydrophobicContact CG-CB 4.09Å; K223-P240 HydrophobicContact CB-CG 4.12Å
224	E	98	Very high	98.1	Very high	69 Å²	69	55.9 Å²	55.9	32%	0.322	30%	0.3	S	S	.	.			trans	-73.4	162.8	168.3	-69.7	-61	142.3	0	0	111.4	H196 K203 A226 E227	H196-E224 IonicContact CD2-OE1 3.14Å; H196-E224 IonicContact CE1-OE1 3.76Å; H196-E224 IonicContact NE2-OE1 3.79Å; H196-E224 PolarHBondContact NE2-OE1 3.29Å; K203-E224 IonicContact NZ-OE1 2.86Å; K203-E224 IonicContact NZ-OE2 2.74Å; K203-E224 PolarHBondContact NZ-OE2 2.84Å; E224-A226 PolarHBondContact O-N 2.93Å; E224-A226 VanDerWaalsContact O-N 3.13Å; E224-E227 HydrophobicContact CB-CG 4.31Å; E224-E227 WeakPolarHBondContact CB-OE2 3.48Å; E224-E227 PolarHBondContact N-OE2 3.33Å; E224-E227 WeakPolarHBondContact O-CB 3.33Å; E224-E227 PolarHBondContact O-N 3.26Å
225	V	97.8	Very high	98.1	Very high	14 Å²	14	55.6 Å²	55.6	9%	0.085	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.5	-173.8	64.7	0	0	0	0	114.4	C244 A246 H250 I251	V225-C244 HydrophobicContact CB-CB 3.86Å; V225-C244 HydrophobicContact CG2-CB 3.81Å; V225-A246 HydrophobicContact CB-CB 4.33Å; V225-A246 HydrophobicContact CG1-CB 3.93Å; V225-A246 HydrophobicContact CG2-CB 3.97Å; V225-H250 HydrophobicContact CG1-CB 3.9Å; V225-I251 HydrophobicContact CG2-CB 4.46Å; V225-I251 HydrophobicContact CG2-CG1 3.63Å
226	A	96.1	Very high	98.2	Very high	49 Å²	49	52.6 Å²	52.6	41%	0.405	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.3	-179.6	0	0	0	0	0	113.3	E224	E224-A226 PolarHBondContact O-N 2.93Å; E224-A226 VanDerWaalsContact O-N 3.13Å
227	E	97.8	Very high	98.2	Very high	79 Å²	79	51.3 Å²	51.3	37%	0.369	27%	0.267	S	S	.	.			trans	-103.8	158.8	-178.3	-63.1	-176.5	86	0	0	112.6	K223 E224 T239 P240	K223-E227 HydrophobicContact CB-CB 4.14Å; K223-E227 HydrophobicContact CD-CB 3.91Å; K223-E227 HydrophobicContact CG-CB 4.44Å; K223-E227 IonicContact NZ-OE1 3.04Å; K223-E227 PolarHBondContact NZ-OE1 2.97Å; K223-E227 VanDerWaalsContact NZ-OE1 3.14Å; E224-E227 HydrophobicContact CB-CG 4.31Å; E224-E227 WeakPolarHBondContact CB-OE2 3.48Å; E224-E227 PolarHBondContact N-OE2 3.33Å; E224-E227 WeakPolarHBondContact O-CB 3.33Å; E224-E227 PolarHBondContact O-N 3.26Å; E227-T239 WeakPolarHBondContact O-CB 3.4Å; E227-T239 PolarHBondContact O-OG1 3.33Å; E227-P240 WeakPolarHBondContact O-CD 3.22Å
228	A	98.6	Very high	98.4	Very high	20 Å²	20	49 Å²	49	17%	0.165	24%	0.243	C	C	.	.			trans	-121.9	145.9	166.3	0	0	0	0	0	110.4	V237 T238 A257 M258	A228-V237 HydrophobicContact CB-CG1 4.21Å; A228-T238 CarbonylContact C-O 3.5Å; A228-T238 WeakPolarHBondContact CA-O 3.27Å; A228-A257 HydrophobicContact CB-CB 4.33Å; A228-M258 HydrophobicContact CB-CB 4.19Å
229	H	98.9	Very high	98.4	Very high	20 Å²	20	48.7 Å²	48.7	9%	0.093	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	139.7	168.3	-173.7	64.1	0	0	0	110.1	E191 T193 F221 K223 V237 T238	E191-H229 WeakPolarHBondContact CB-NE2 3.38Å; E191-H229 IonicContact OE2-NE2 3.96Å; T193-H229 HydrophobicContact CG2-CB 3.84Å; F221-H229 AromaticContact CD1-CE1 3.84Å; F221-H229 AromaticContact CD2-CE1 3.64Å; F221-H229 AromaticContact CD2-NE2 3.47Å; F221-H229 WeakPolarHBondContact CD2-NE2 3.33Å; F221-H229 AromaticContact CE2-NE2 3.88Å; F221-H229 AromaticContact CG-CE1 3.5Å; F221-H229 AromaticContact CG-ND1 3.92Å; F221-H229 AromaticContact CG-NE2 3.81Å; K223-H229 HydrophobicContact CG-CB 4.09Å; H229-V237 CarbonylContact O-C 3.46Å; H229-V237 VanDerWaalsContact O-CA 3.32Å; H229-V237 WeakPolarHBondContact O-CA 3.47Å; H229-T238 PolarHBondContact N-O 2.95Å; H229-T238 PolarHBondContact O-N 3.45Å
230	V	98.9	Very high	98.4	Very high	35 Å²	35	43.4 Å²	43.4	21%	0.212	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	112	179	-177.1	0	0	0	0	109.4	Q232 V237 K261 L265	V230-Q232 HydrophobicContact CG1-CG 4.12Å; V230-Q232 PolarHBondContact O-N 2.77Å; V230-V237 HydrophobicContact CG1-CG2 4.38Å; V230-V237 HydrophobicContact CG2-CG1 4.19Å; V230-V237 HydrophobicContact CG2-CG2 4.35Å; V230-K261 HydrophobicContact CG2-CB 4Å; V230-K261 HydrophobicContact CG2-CD 4.3Å; V230-K261 HydrophobicContact CG2-CG 3.94Å; V230-L265 HydrophobicContact CG1-CD1 4.08Å
231	D	98.8	Very high	98.4	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	96.5	163.5	-174.5	-25.5	0	0	0	108.9	E191 K233 N234 K235 V236	E191-D231 HydrophobicContact CB-CB 3.9Å; E191-D231 PolarHBondContact N-OD2 2.78Å; D231-K233 PolarHBondContact O-N 3.39Å; D231-K233 WeakPolarHBondContact OD1-CB 3.24Å; D231-K233 PolarHBondContact OD1-N 3.43Å; D231-N234 PolarHBondContact O-N 2.65Å; D231-N234 PolarHBondContact OD1-N 3.12Å; D231-N234 PolarHBondContact OD1-ND2 2.83Å; D231-N234 WeakPolarHBondContact OD2-CB 3.26Å; D231-N234 PolarHBondContact OD2-ND2 3.08Å; D231-K235 WeakPolarHBondContact O-CA 3.25Å; D231-K235 PolarHBondContact O-N 3.09Å; D231-V236 HydrophobicContact CB-CB 4.18Å; D231-V236 PolarHBondContact N-O 3.46Å; D231-V236 PolarHBondContact O-N 3.44Å
232	Q	98.3	Very high	98.4	Very high	130 Å²	130	41.9 Å²	41.9	61%	0.607	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-30.2	-177.8	-69.8	-69.3	31.1	0	0	113.4	V230	V230-Q232 HydrophobicContact CG1-CG 4.12Å; V230-Q232 PolarHBondContact O-N 2.77Å
233	K	97.9	Very high	98.4	Very high	191 Å²	191	39 Å²	39	83%	0.83	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-44	-177.5	180	-176.9	174.6	-175	0	110.7	D231	D231-K233 PolarHBondContact O-N 3.39Å; D231-K233 WeakPolarHBondContact OD1-CB 3.24Å; D231-K233 PolarHBondContact OD1-N 3.43Å
234	N	98.5	Very high	98.4	Very high	22 Å²	22	36.8 Å²	36.8	12%	0.118	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4.6	-178.1	-63.8	-66.8	0	0	0	113.4	H167 V190 D231 V236	H167-N234 PolarHBondContact NE2-OD1 3.46Å; V190-N234 HydrophobicContact CG2-CB 4.33Å; D231-N234 PolarHBondContact O-N 2.65Å; D231-N234 PolarHBondContact OD1-N 3.12Å; D231-N234 PolarHBondContact OD1-ND2 2.83Å; D231-N234 WeakPolarHBondContact OD2-CB 3.26Å; D231-N234 PolarHBondContact OD2-ND2 3.08Å; N234-V236 VanDerWaalsContact C-N 3.26Å; N234-V236 HydrophobicContact CB-CG2 4.1Å; N234-V236 PolarHBondContact O-N 3.21Å
235	K	98.8	Very high	98.4	Very high	69 Å²	69	39.8 Å²	39.8	30%	0.3	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	42.8	-172.4	-60.4	-174.5	177.5	-171.3	0	112.7	G170 P172 I173 D231 L265	G170-K235 WeakPolarHBondContact O-CD 3.22Å; G170-K235 WeakPolarHBondContact O-CE 3.45Å; G170-K235 PolarHBondContact O-NZ 2.81Å; P172-K235 CarbonylContact C-O 3.54Å; P172-K235 VanDerWaalsContact CA-O 3.22Å; P172-K235 WeakPolarHBondContact CA-O 3.31Å; P172-K235 HydrophobicContact CB-CB 4.31Å; I173-K235 PolarHBondContact N-O 3.03Å; D231-K235 WeakPolarHBondContact O-CA 3.25Å; D231-K235 PolarHBondContact O-N 3.09Å; K235-L265 HydrophobicContact CB-CD1 4.36Å
236	V	98.9	Very high	98.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.3	176.9	174.3	0	0	0	0	108.8	I173 L175 L187 V190 V192 D231 N234 T238	I173-V236 HydrophobicContact CB-CG2 4.44Å; I173-V236 WeakPolarHBondContact O-CA 3.2Å; L175-V236 HydrophobicContact CD1-CG1 3.81Å; L187-V236 HydrophobicContact CD1-CG2 3.99Å; V190-V236 HydrophobicContact CG2-CB 3.81Å; V190-V236 HydrophobicContact CG2-CG1 3.96Å; V190-V236 HydrophobicContact CG2-CG2 3.71Å; V192-V236 HydrophobicContact CG1-CG1 4.18Å; D231-V236 HydrophobicContact CB-CB 4.18Å; D231-V236 PolarHBondContact N-O 3.46Å; D231-V236 PolarHBondContact O-N 3.44Å; N234-V236 VanDerWaalsContact C-N 3.26Å; N234-V236 HydrophobicContact CB-CG2 4.1Å; N234-V236 PolarHBondContact O-N 3.21Å; V236-T238 HydrophobicContact CG1-CG2 3.98Å
237	V	98.9	Very high	98.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130	178.2	-171.7	0	0	0	0	108.5	I173 G174 L175 A228 H229 V230 M258 K261 V262 L265	I173-V237 PolarHBondContact O-N 3.45Å; G174-V237 CarbonylContact C-O 3.59Å; G174-V237 VanDerWaalsContact CA-O 3.3Å; G174-V237 WeakPolarHBondContact CA-O 3.36Å; L175-V237 PolarHBondContact N-O 2.97Å; A228-V237 HydrophobicContact CB-CG1 4.21Å; H229-V237 CarbonylContact O-C 3.46Å; H229-V237 VanDerWaalsContact O-CA 3.32Å; H229-V237 WeakPolarHBondContact O-CA 3.47Å; V230-V237 HydrophobicContact CG1-CG2 4.38Å; V230-V237 HydrophobicContact CG2-CG1 4.19Å; V230-V237 HydrophobicContact CG2-CG2 4.35Å; V237-M258 HydrophobicContact CB-CG 4.24Å; V237-M258 HydrophobicContact CG1-CB 4.23Å; V237-M258 HydrophobicContact CG1-CG 3.67Å; V237-K261 HydrophobicContact CG1-CB 3.82Å; V237-K261 HydrophobicContact CG2-CB 4.16Å; V237-V262 HydrophobicContact CB-CG2 3.81Å; V237-V262 HydrophobicContact CG1-CG2 4.43Å; V237-V262 HydrophobicContact CG2-CG2 3.87Å; V237-L265 HydrophobicContact CG2-CD1 3.7Å
238	T	98.9	Very high	98.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.9	-178.9	52.8	0	0	0	0	113	L175 P180 V192 T193 A228 H229 V236	L175-T238 HydrophobicContact CB-CG2 4.14Å; L175-T238 HydrophobicContact CD1-CG2 4.06Å; L175-T238 WeakPolarHBondContact O-CA 3.39Å; L175-T238 WeakPolarHBondContact O-CB 3.05Å; P180-T238 HydrophobicContact CB-CG2 4.01Å; P180-T238 HydrophobicContact CG-CG2 3.76Å; V192-T238 WeakPolarHBondContact CA-OG1 3.29Å; V192-T238 HydrophobicContact CB-CG2 4.01Å; V192-T238 HydrophobicContact CG1-CG2 3.86Å; T193-T238 WeakPolarHBondContact CG2-O 3.39Å; T193-T238 PolarHBondContact N-OG1 3.36Å; A228-T238 CarbonylContact C-O 3.5Å; A228-T238 WeakPolarHBondContact CA-O 3.27Å; H229-T238 PolarHBondContact N-O 2.95Å; H229-T238 PolarHBondContact O-N 3.45Å; V236-T238 HydrophobicContact CG1-CG2 3.98Å
239	T	98.9	Very high	98.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.4	176.6	-176.8	0	0	0	0	111.2	L175 C176 C177 E227 G254 I255 M258	L175-T239 PolarHBondContact O-N 3.19Å; C176-T239 VanDerWaalsContact CA-O 3.3Å; C176-T239 WeakPolarHBondContact CA-O 3.3Å; C176-T239 HydrophobicContact CB-CG2 3.49Å; C176-T239 VanDerWaalsContact CB-CG2 3.49Å; C177-T239 PolarHBondContact N-O 2.97Å; E227-T239 WeakPolarHBondContact O-CB 3.4Å; E227-T239 PolarHBondContact O-OG1 3.33Å; T239-G254 PolarHBondContact OG1-O 3.28Å; T239-I255 HydrophobicContact CG2-CG1 4.25Å; T239-M258 HydrophobicContact CG2-CB 3.66Å; T239-M258 HydrophobicContact CG2-CG 4.12Å; T239-M258 HydrophobicContact CG2-SD 3.9Å
240	P	98.7	Very high	98.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.			trans	-69.8	-33.5	-172.6	-20.6	34.1	0	0	0	115.1	C177 T193 G195 W204 K223 E227 F242 M243	C177-P240 VanDerWaalsContact CA-O 3.24Å; C177-P240 WeakPolarHBondContact CA-O 3.42Å; T193-P240 HydrophobicContact CG2-CG 4.31Å; G195-P240 VanDerWaalsContact CA-CG 3.5Å; W204-P240 HydrophobicContact CH2-CB 3.98Å; W204-P240 HydrophobicContact CH2-CG 4.23Å; W204-P240 HydrophobicContact CZ3-CB 3.76Å; W204-P240 HydrophobicContact CZ3-CG 4.43Å; K223-P240 HydrophobicContact CB-CG 4.12Å; E227-P240 WeakPolarHBondContact O-CD 3.22Å; P240-F242 PolarHBondContact O-N 3.35Å; P240-M243 HydrophobicContact CB-CB 4.46Å; P240-M243 VanDerWaalsContact O-CB 3.25Å; P240-M243 WeakPolarHBondContact O-CB 3.28Å; P240-M243 WeakPolarHBondContact O-CG 3.24Å; P240-M243 PolarHBondContact O-N 3.05Å
241	A	98.7	Very high	98.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	45.3	-127.2	-176.9	0	0	0	0	0	113.7	E62 C176 C177 M243 C244 I251 I255	E62-A241 HydrophobicContact CG-CB 4.16Å; C176-A241 HydrophobicContact CB-CB 4.12Å; C177-A241 HydrophobicContact CB-CB 4.04Å; A241-M243 PolarHBondContact O-N 3.08Å; A241-M243 VanDerWaalsContact O-N 3.1Å; A241-C244 PolarHBondContact O-N 2.97Å; A241-I251 HydrophobicContact CB-CG2 4.04Å; A241-I255 HydrophobicContact CB-CD1 4.01Å; A241-I255 HydrophobicContact CB-CG1 4.03Å
242	F	98.6	Very high	98.4	Very high	61 Å²	61	49.2 Å²	49.2	27%	0.268	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-73.3	7.2	-178.1	-76.5	-83.1	0	0	0	115.2	E59 H61 E62 P240 C244 L248 I251	E59-F242 HydrophobicContact CG-CD2 3.9Å; E59-F242 HydrophobicContact CG-CE2 4.22Å; E59-F242 HydrophobicContact CG-CG 4.47Å; E59-F242 VanDerWaalsContact OE2-CE2 3.24Å; E59-F242 WeakPolarHBondContact OE2-CE2 3.4Å; H61-F242 HydrophobicContact CB-CE2 3.78Å; H61-F242 HydrophobicContact CB-CZ 3.9Å; E62-F242 HydrophobicContact CG-CD2 3.69Å; E62-F242 HydrophobicContact CG-CE2 4.03Å; E62-F242 WeakPolarHBondContact OE1-CD2 3.21Å; P240-F242 PolarHBondContact O-N 3.35Å; F242-C244 PolarHBondContact O-N 3.38Å; F242-L248 HydrophobicContact CE1-CD1 4.3Å; F242-L248 HydrophobicContact CE2-CD1 4.41Å; F242-L248 HydrophobicContact CZ-CD1 3.56Å; F242-I251 HydrophobicContact CD1-CD1 3.52Å; F242-I251 HydrophobicContact CD2-CD1 4.36Å; F242-I251 HydrophobicContact CD2-CG2 3.82Å; F242-I251 HydrophobicContact CE1-CD1 3.51Å; F242-I251 HydrophobicContact CE2-CD1 4.36Å; F242-I251 HydrophobicContact CE2-CG2 3.71Å; F242-I251 HydrophobicContact CG-CD1 3.98Å; F242-I251 HydrophobicContact CG-CG2 4.4Å; F242-I251 HydrophobicContact CZ-CD1 3.97Å; F242-I251 HydrophobicContact CZ-CG2 4.22Å
243	M	98.3	Very high	98.4	Very high	7 Å²	7	46.9 Å²	46.9	3%	0.034	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-66.3	-15.6	163.9	-60.9	-66.7	-80	0	0	111.8	C177 I178 V194 Y206 T209 P240 A241	C177-M243 HydrophobicContact CB-CG 4.25Å; I178-M243 HydrophobicContact CB-SD 4.22Å; I178-M243 HydrophobicContact CD1-CE 3.98Å; I178-M243 HydrophobicContact CD1-SD 4.42Å; V194-M243 HydrophobicContact CB-CE 4.14Å; V194-M243 VanDerWaalsContact O-CB 3.28Å; V194-M243 WeakPolarHBondContact O-CB 3.25Å; Y206-M243 VanDerWaalsContact CB-CE 3.44Å; Y206-M243 HydrophobicContact CD2-SD 3.97Å; Y206-M243 HydrophobicContact CG-CE 4.27Å; Y206-M243 HydrophobicContact CG-SD 4.24Å; T209-M243 HydrophobicContact CG2-CE 4.03Å; T209-M243 WeakPolarHBondContact OG1-CE 3.45Å; P240-M243 HydrophobicContact CB-CB 4.46Å; P240-M243 VanDerWaalsContact O-CB 3.25Å; P240-M243 WeakPolarHBondContact O-CB 3.28Å; P240-M243 WeakPolarHBondContact O-CG 3.24Å; P240-M243 PolarHBondContact O-N 3.05Å; A241-M243 PolarHBondContact O-N 3.08Å; A241-M243 VanDerWaalsContact O-N 3.1Å
244	C	97.8	Very high	98.4	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.02	20%	0.196	C	C	.	.	S	Bend	trans	-107.9	138.4	175.9	-162.5	0	0	0	0	111.6	K203 W204 V225 A241 F242 A246	K203-C244 CarbonylContact O-C 3.51Å; K203-C244 WeakPolarHBondContact O-CA 3.47Å; W204-C244 HydrophobicContact CD2-CB 4.4Å; W204-C244 HydrophobicContact CE3-CB 3.81Å; W204-C244 HydrophobicContact CH2-CB 3.63Å; W204-C244 HydrophobicContact CZ2-CB 4.23Å; W204-C244 HydrophobicContact CZ3-CB 3.39Å; V225-C244 HydrophobicContact CB-CB 3.86Å; V225-C244 HydrophobicContact CG2-CB 3.81Å; A241-C244 PolarHBondContact O-N 2.97Å; F242-C244 PolarHBondContact O-N 3.38Å; C244-A246 PolarHBondContact O-N 3.46Å
245	Q	97.4	Very high	98.5	Very high	132 Å²	132	36.8 Å²	36.8	62%	0.617	19%	0.19	S	C	*	.			trans	-78.8	98.7	161.4	-66.3	-163.9	33.5	0	0	109.7	G202 K203 P205	G202-Q245 VanDerWaalsContact O-CG 3.27Å; G202-Q245 WeakPolarHBondContact O-CG 3.43Å; G202-Q245 PolarHBondContact O-NE2 2.88Å; K203-Q245 PolarHBondContact O-N 3.47Å; P205-Q245 HydrophobicContact CG-CG 4.36Å
246	A	97.1	Very high	98.5	Very high	38 Å²	38	33.9 Å²	33.9	31%	0.314	18%	0.18	S	C	.	.			trans	-139.4	165.6	179.1	0	0	0	0	0	111.3	V225 C244 L248 H250 I251	V225-A246 HydrophobicContact CB-CB 4.33Å; V225-A246 HydrophobicContact CG1-CB 3.93Å; V225-A246 HydrophobicContact CG2-CB 3.97Å; C244-A246 PolarHBondContact O-N 3.46Å; A246-L248 PolarHBondContact O-N 3.1Å; A246-H250 HydrophobicContact CB-CB 4.44Å; A246-I251 HydrophobicContact CB-CG1 4.32Å
247	A	98.1	Very high	98.5	Very high	50 Å²	50	35.3 Å²	35.3	41%	0.413	19%	0.192	S	C	.	.			trans	-60.4	139.2	169.5	0	0	0	0	0	110.5	H249 H250	A247-H249 VanDerWaalsContact CB-CE1 3.41Å; A247-H249 WeakPolarHBondContact CB-CE1 3.47Å; A247-H249 PolarHBondContact O-N 3.26Å; A247-H250 WeakPolarHBondContact O-CB 3.36Å; A247-H250 PolarHBondContact O-N 3.05Å
248	L	98.3	Very high	98.5	Very high	95 Å²	95	35.3 Å²	35.3	50%	0.497	19%	0.192	S	C	.	.	H	α-helix	trans	-52.5	-35.4	-172	-178	62.5	0	0	0	114.1	H61 F242 A246 I251 H252	H61-L248 HydrophobicContact CB-CD1 4.2Å; F242-L248 HydrophobicContact CE1-CD1 4.3Å; F242-L248 HydrophobicContact CE2-CD1 4.41Å; F242-L248 HydrophobicContact CZ-CD1 3.56Å; A246-L248 PolarHBondContact O-N 3.1Å; L248-I251 PolarHBondContact O-N 2.7Å; L248-H252 PolarHBondContact O-N 3.47Å
249	H	98.3	Very high	98.5	Very high	105 Å²	105	35.4 Å²	35.4	49%	0.486	19%	0.192	S	C	.	.	H	α-helix	trans	-66.9	-35.8	179.7	61.6	-89.6	0	0	0	112.6	A247 I251 H252 D253	A247-H249 VanDerWaalsContact CB-CE1 3.41Å; A247-H249 WeakPolarHBondContact CB-CE1 3.47Å; A247-H249 PolarHBondContact O-N 3.26Å; H249-I251 VanDerWaalsContact C-N 3.31Å; H249-I251 PolarHBondContact O-N 2.99Å; H249-H252 WeakPolarHBondContact O-CB 3.5Å; H249-H252 PolarHBondContact O-N 2.78Å; H249-D253 WeakPolarHBondContact O-CB 3.5Å; H249-D253 PolarHBondContact O-N 3.25Å
250	H	98.5	Very high	98.4	Very high	79 Å²	79	40.9 Å²	40.9	37%	0.366	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-37.9	175.6	-63.7	121.4	0	0	0	111.8	V225 A246 A247 D253 G254	V225-H250 HydrophobicContact CG1-CB 3.9Å; A246-H250 HydrophobicContact CB-CB 4.44Å; A247-H250 WeakPolarHBondContact O-CB 3.36Å; A247-H250 PolarHBondContact O-N 3.05Å; H250-D253 PolarHBondContact O-N 3.23Å; H250-G254 PolarHBondContact O-N 2.97Å
251	I	98.7	Very high	98.5	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-48	174.5	-65.5	169.8	0	0	0	110	V225 A241 F242 A246 L248 H249 D253 G254 I255	V225-I251 HydrophobicContact CG2-CB 4.46Å; V225-I251 HydrophobicContact CG2-CG1 3.63Å; A241-I251 HydrophobicContact CB-CG2 4.04Å; F242-I251 HydrophobicContact CD1-CD1 3.52Å; F242-I251 HydrophobicContact CD2-CD1 4.36Å; F242-I251 HydrophobicContact CD2-CG2 3.82Å; F242-I251 HydrophobicContact CE1-CD1 3.51Å; F242-I251 HydrophobicContact CE2-CD1 4.36Å; F242-I251 HydrophobicContact CE2-CG2 3.71Å; F242-I251 HydrophobicContact CG-CD1 3.98Å; F242-I251 HydrophobicContact CG-CG2 4.4Å; F242-I251 HydrophobicContact CZ-CD1 3.97Å; F242-I251 HydrophobicContact CZ-CG2 4.22Å; A246-I251 HydrophobicContact CB-CG1 4.32Å; L248-I251 PolarHBondContact O-N 2.7Å; H249-I251 VanDerWaalsContact C-N 3.31Å; H249-I251 PolarHBondContact O-N 2.99Å; I251-D253 VanDerWaalsContact C-N 3.28Å; I251-D253 PolarHBondContact O-N 3.02Å; I251-G254 PolarHBondContact O-N 2.95Å; I251-I255 HydrophobicContact CG2-CD1 3.95Å; I251-I255 VanDerWaalsContact O-CG1 3.27Å; I251-I255 WeakPolarHBondContact O-CG1 3.41Å; I251-I255 PolarHBondContact O-N 3.09Å
252	H	98.7	Very high	98.5	Very high	49 Å²	49	44.5 Å²	44.5	23%	0.227	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-39.7	175.7	170.4	-80.4	0	0	0	112.5	H69 L248 H249 G256	H69-H252 AromaticContact CE1-CE1 3.36Å; H69-H252 PolarHBondContact CE1-CE1 3.05Å; H69-H252 AromaticContact CE1-ND1 3.95Å; H69-H252 AromaticContact CE1-NE2 3.97Å; H69-H252 AromaticContact NE2-CD2 3.97Å; H69-H252 AromaticContact NE2-CE1 3.09Å; H69-H252 PolarHBondContact NE2-CE1 3.07Å; H69-H252 AromaticContact NE2-CG 3.98Å; H69-H252 AromaticContact NE2-ND1 3.46Å; H69-H252 PolarHBondContact NE2-ND1 3.35Å; H69-H252 AromaticContact NE2-NE2 3.44Å; H69-H252 PolarHBondContact NE2-NE2 2.99Å; H69-H252 PolarHBondContact NE2-O 2.92Å; L248-H252 PolarHBondContact O-N 3.47Å; H249-H252 WeakPolarHBondContact O-CB 3.5Å; H249-H252 PolarHBondContact O-N 2.78Å; H252-G256 PolarHBondContact O-N 3.42Å
253	D	98.6	Very high	98.5	Very high	81 Å²	81	42.9 Å²	42.9	43%	0.433	23%	0.228	S	C	.	.	H	α-helix	trans	-72.9	-40	-178.6	-66.2	-15.2	0	0	0	111.9	H249 H250 I251 I255 G256 A257	H249-D253 WeakPolarHBondContact O-CB 3.5Å; H249-D253 PolarHBondContact O-N 3.25Å; H250-D253 PolarHBondContact O-N 3.23Å; I251-D253 VanDerWaalsContact C-N 3.28Å; I251-D253 PolarHBondContact O-N 3.02Å; D253-I255 VanDerWaalsContact C-N 3.34Å; D253-I255 PolarHBondContact O-N 2.86Å; D253-G256 CarbonylContact O-C 3.38Å; D253-G256 WeakPolarHBondContact O-CA 3.39Å; D253-G256 PolarHBondContact O-N 2.78Å; D253-G256 VanDerWaalsContact O-N 3.08Å; D253-A257 PolarHBondContact O-N 3.31Å
254	G	98.8	Very high	98.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-40.3	172.5	0	0	0	0	0	112.9	T239 H250 I251 G256 A257 M258	T239-G254 PolarHBondContact OG1-O 3.28Å; H250-G254 PolarHBondContact O-N 2.97Å; I251-G254 PolarHBondContact O-N 2.95Å; G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 3.04Å; G254-A257 WeakPolarHBondContact O-CB 3.45Å; G254-A257 PolarHBondContact O-N 2.88Å; G254-M258 PolarHBondContact O-N 3.06Å
255	I	98.9	Very high	98.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.9	-38.9	171.6	-66.8	168.6	0	0	0	111.2	E62 A65 I66 T239 A241 I251 D253 M258 V259	E62-I255 HydrophobicContact CB-CD1 4Å; E62-I255 HydrophobicContact CG-CD1 3.75Å; A65-I255 HydrophobicContact CB-CB 4.2Å; A65-I255 HydrophobicContact CB-CD1 3.97Å; A65-I255 HydrophobicContact CB-CG2 3.81Å; I66-I255 HydrophobicContact CB-CG2 4.46Å; I66-I255 HydrophobicContact CD1-CG2 4.5Å; I66-I255 HydrophobicContact CG1-CG2 3.5Å; I66-I255 VanDerWaalsContact CG1-CG2 3.5Å; T239-I255 HydrophobicContact CG2-CG1 4.25Å; A241-I255 HydrophobicContact CB-CD1 4.01Å; A241-I255 HydrophobicContact CB-CG1 4.03Å; I251-I255 HydrophobicContact CG2-CD1 3.95Å; I251-I255 VanDerWaalsContact O-CG1 3.27Å; I251-I255 WeakPolarHBondContact O-CG1 3.41Å; I251-I255 PolarHBondContact O-N 3.09Å; D253-I255 VanDerWaalsContact C-N 3.34Å; D253-I255 PolarHBondContact O-N 2.86Å; I255-M258 WeakPolarHBondContact O-CB 3.47Å; I255-M258 PolarHBondContact O-N 2.96Å; I255-V259 HydrophobicContact CG2-CG2 4.47Å; I255-V259 WeakPolarHBondContact O-CG2 3.33Å; I255-V259 PolarHBondContact O-N 3.43Å
256	G	98.8	Very high	98.5	Very high	8 Å²	8	43.9 Å²	43.9	8%	0.082	24%	0.235	C	C	.	.	H	α-helix	trans	-60	-45.7	173.1	0	0	0	0	0	112.9	H69 H252 D253 G254 M258 V259 Q260	H69-G256 WeakPolarHBondContact CD2-CA 3.29Å; H69-G256 PolarHBondContact CD2-N 3.46Å; H69-G256 VanDerWaalsContact CE1-CA 3.47Å; H69-G256 WeakPolarHBondContact CE1-CA 3.2Å; H69-G256 VanDerWaalsContact CG-CA 3.49Å; H69-G256 WeakPolarHBondContact NE2-CA 3.36Å; H69-G256 PolarHBondContact NE2-N 3.35Å; H252-G256 PolarHBondContact O-N 3.42Å; D253-G256 CarbonylContact O-C 3.38Å; D253-G256 WeakPolarHBondContact O-CA 3.39Å; D253-G256 PolarHBondContact O-N 2.78Å; D253-G256 VanDerWaalsContact O-N 3.08Å; G254-G256 VanDerWaalsContact C-N 3.3Å; G254-G256 PolarHBondContact O-N 3.04Å; G256-M258 VanDerWaalsContact C-N 3.32Å; G256-M258 PolarHBondContact O-N 3.17Å; G256-V259 PolarHBondContact O-N 2.97Å; G256-Q260 WeakPolarHBondContact O-CB 3.5Å; G256-Q260 PolarHBondContact O-N 3.27Å
257	A	98.8	Very high	98.2	Very high	31 Å²	31	45.3 Å²	45.3	26%	0.256	25%	0.253	S	S	.	.	H	α-helix	trans	-59.3	-43.2	175	0	0	0	0	0	111.5	A228 D253 G254 K261	A228-A257 HydrophobicContact CB-CB 4.33Å; D253-A257 PolarHBondContact O-N 3.31Å; G254-A257 WeakPolarHBondContact O-CB 3.45Å; G254-A257 PolarHBondContact O-N 2.88Å; A257-K261 VanDerWaalsContact O-CG 3.31Å; A257-K261 WeakPolarHBondContact O-CG 3.47Å; A257-K261 PolarHBondContact O-N 3.23Å
258	M	98.9	Very high	97.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-51.4	174.6	-177.4	-154.8	68	0	0	111.6	I66 I132 C176 A228 V237 T239 G254 I255 G256 Q260 K261 V262	I66-M258 HydrophobicContact CD1-CE 4.32Å; I66-M258 HydrophobicContact CG1-CE 4.13Å; I132-M258 HydrophobicContact CG2-CE 3.81Å; C176-M258 HydrophobicContact CB-SD 3.98Å; A228-M258 HydrophobicContact CB-CB 4.19Å; V237-M258 HydrophobicContact CB-CG 4.24Å; V237-M258 HydrophobicContact CG1-CB 4.23Å; V237-M258 HydrophobicContact CG1-CG 3.67Å; T239-M258 HydrophobicContact CG2-CB 3.66Å; T239-M258 HydrophobicContact CG2-CG 4.12Å; T239-M258 HydrophobicContact CG2-SD 3.9Å; G254-M258 PolarHBondContact O-N 3.06Å; I255-M258 WeakPolarHBondContact O-CB 3.47Å; I255-M258 PolarHBondContact O-N 2.96Å; G256-M258 VanDerWaalsContact C-N 3.32Å; G256-M258 PolarHBondContact O-N 3.17Å; M258-Q260 VanDerWaalsContact C-N 3.34Å; M258-Q260 PolarHBondContact O-N 3.26Å; M258-K261 PolarHBondContact O-N 3.28Å; M258-V262 WeakPolarHBondContact O-CG2 3.4Å; M258-V262 PolarHBondContact O-N 3.33Å
259	V	98.9	Very high	97.4	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-44.4	-179.2	170.9	0	0	0	0	111.1	I66 H69 L70 I132 I255 G256 K261 V262 L263	I66-V259 HydrophobicContact CB-CG2 4.43Å; I66-V259 HydrophobicContact CG1-CG2 4.26Å; I66-V259 HydrophobicContact CG2-CG2 4.24Å; H69-V259 HydrophobicContact CB-CB 3.9Å; H69-V259 HydrophobicContact CB-CG1 3.83Å; H69-V259 HydrophobicContact CB-CG2 4.16Å; L70-V259 HydrophobicContact CD2-CG1 3.67Å; L70-V259 HydrophobicContact CG-CG1 3.86Å; I132-V259 HydrophobicContact CD1-CG2 4.19Å; I255-V259 HydrophobicContact CG2-CG2 4.47Å; I255-V259 WeakPolarHBondContact O-CG2 3.33Å; I255-V259 PolarHBondContact O-N 3.43Å; G256-V259 PolarHBondContact O-N 2.97Å; V259-K261 VanDerWaalsContact C-N 3.34Å; V259-K261 PolarHBondContact O-N 2.85Å; V259-V262 PolarHBondContact O-N 3.38Å; V259-L263 HydrophobicContact CG1-CD1 4.12Å; V259-L263 HydrophobicContact CG1-CG 4.39Å; V259-L263 WeakPolarHBondContact O-CG 3.49Å; V259-L263 PolarHBondContact O-N 3.04Å
260	Q	98.7	Very high	97.4	Very high	115 Å²	115	41.3 Å²	41.3	54%	0.537	23%	0.225	S	C	.	.	H	α-helix	trans	-58.3	-46.3	177.6	-174.9	-176.8	-12.7	0	0	111.3	G256 M258 V262 L263 E264	G256-Q260 WeakPolarHBondContact O-CB 3.5Å; G256-Q260 PolarHBondContact O-N 3.27Å; M258-Q260 VanDerWaalsContact C-N 3.34Å; M258-Q260 PolarHBondContact O-N 3.26Å; Q260-V262 PolarHBondContact O-N 3.25Å; Q260-L263 PolarHBondContact O-N 3.35Å; Q260-E264 PolarHBondContact NE2-OE1 2.74Å; Q260-E264 WeakPolarHBondContact O-CG 3.34Å; Q260-E264 PolarHBondContact O-N 2.73Å
261	K	98.8	Very high	97.3	Very high	77 Å²	77	39.2 Å²	39.2	34%	0.335	22%	0.218	S	C	.	.	H	α-helix	trans	-65.6	-36.5	177.3	-67	-59.1	172.8	-149.4	0	113.2	V230 V237 A257 M258 V259 E264 L265	V230-K261 HydrophobicContact CG2-CB 4Å; V230-K261 HydrophobicContact CG2-CD 4.3Å; V230-K261 HydrophobicContact CG2-CG 3.94Å; V237-K261 HydrophobicContact CG1-CB 3.82Å; V237-K261 HydrophobicContact CG2-CB 4.16Å; A257-K261 VanDerWaalsContact O-CG 3.31Å; A257-K261 WeakPolarHBondContact O-CG 3.47Å; A257-K261 PolarHBondContact O-N 3.23Å; M258-K261 PolarHBondContact O-N 3.28Å; V259-K261 VanDerWaalsContact C-N 3.34Å; V259-K261 PolarHBondContact O-N 2.85Å; K261-E264 VanDerWaalsContact CD-OE2 3.25Å; K261-E264 WeakPolarHBondContact CD-OE2 3.49Å; K261-E264 VanDerWaalsContact NZ-CD 3.27Å; K261-E264 IonicContact NZ-OE1 3.75Å; K261-E264 PolarHBondContact NZ-OE1 2.63Å; K261-E264 IonicContact NZ-OE2 2.87Å; K261-E264 PolarHBondContact NZ-OE2 2.92Å; K261-L265 VanDerWaalsContact O-CG 3.29Å; K261-L265 WeakPolarHBondContact O-CG 3.41Å; K261-L265 PolarHBondContact O-N 3.49Å; K261-L265 VanDerWaalsContact O-N 3.16Å
262	V	98.9	Very high	97.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-47.9	172	169.2	0	0	0	0	110.5	A130 I132 P172 V237 M258 V259 Q260 L265 T266	A130-V262 HydrophobicContact CB-CG1 3.6Å; I132-V262 HydrophobicContact CD1-CB 4.41Å; I132-V262 HydrophobicContact CD1-CG1 4.08Å; I132-V262 HydrophobicContact CD1-CG2 4.47Å; I132-V262 HydrophobicContact CG1-CG1 4.2Å; P172-V262 HydrophobicContact CB-CG1 4.25Å; P172-V262 HydrophobicContact CG-CG1 4.29Å; P172-V262 WeakPolarHBondContact CG-O 3.23Å; V237-V262 HydrophobicContact CB-CG2 3.81Å; V237-V262 HydrophobicContact CG1-CG2 4.43Å; V237-V262 HydrophobicContact CG2-CG2 3.87Å; M258-V262 WeakPolarHBondContact O-CG2 3.4Å; M258-V262 PolarHBondContact O-N 3.33Å; V259-V262 PolarHBondContact O-N 3.38Å; Q260-V262 PolarHBondContact O-N 3.25Å; V262-L265 PolarHBondContact O-N 3.13Å; V262-T266 WeakPolarHBondContact O-CG2 3.14Å; V262-T266 PolarHBondContact O-N 2.96Å
263	L	98.6	Very high	97.2	Very high	27 Å²	27	40.9 Å²	40.9	14%	0.141	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-44.4	179.8	-66.9	177.3	0	0	0	112	A43 V45 L70 A75 V259 Q260 L265 T266	A43-L263 HydrophobicContact CB-CD2 3.88Å; V45-L263 HydrophobicContact CG2-CD2 3.97Å; L70-L263 HydrophobicContact CD2-CD2 4.09Å; L70-L263 HydrophobicContact CD2-CG 4.46Å; A75-L263 HydrophobicContact CB-CD2 3.98Å; V259-L263 HydrophobicContact CG1-CD1 4.12Å; V259-L263 HydrophobicContact CG1-CG 4.39Å; V259-L263 WeakPolarHBondContact O-CG 3.49Å; V259-L263 PolarHBondContact O-N 3.04Å; Q260-L263 PolarHBondContact O-N 3.35Å; L263-L265 PolarHBondContact O-N 2.76Å; L263-T266 WeakPolarHBondContact O-CB 3.27Å; L263-T266 PolarHBondContact O-N 3.05Å; L263-T266 PolarHBondContact O-OG1 2.79Å
264	E	98	Very high	97.1	Very high	101 Å²	101	38.2 Å²	38.2	47%	0.472	22%	0.216	S	C	.	.	H	α-helix	trans	-53.6	-40.8	174.2	-73.7	171.9	-158.5	0	0	111.8	Q260 K261 T266 G267	Q260-E264 PolarHBondContact NE2-OE1 2.74Å; Q260-E264 WeakPolarHBondContact O-CG 3.34Å; Q260-E264 PolarHBondContact O-N 2.73Å; K261-E264 VanDerWaalsContact CD-OE2 3.25Å; K261-E264 WeakPolarHBondContact CD-OE2 3.49Å; K261-E264 VanDerWaalsContact NZ-CD 3.27Å; K261-E264 IonicContact NZ-OE1 3.75Å; K261-E264 PolarHBondContact NZ-OE1 2.63Å; K261-E264 IonicContact NZ-OE2 2.87Å; K261-E264 PolarHBondContact NZ-OE2 2.92Å; E264-T266 VanDerWaalsContact C-N 3.28Å; E264-T266 PolarHBondContact O-N 2.98Å; E264-G267 PolarHBondContact O-N 3.3Å
265	L	98.4	Very high	96.9	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.173	23%	0.232	C	C	.	.	H	α-helix	trans	-75.1	-11.1	-179.6	-69.4	174.9	0	0	0	114.7	P172 V230 K235 V237 K261 V262 L263 G267	P172-L265 HydrophobicContact CB-CB 3.72Å; P172-L265 HydrophobicContact CB-CD1 4.26Å; P172-L265 HydrophobicContact CG-CB 3.9Å; V230-L265 HydrophobicContact CG1-CD1 4.08Å; K235-L265 HydrophobicContact CB-CD1 4.36Å; V237-L265 HydrophobicContact CG2-CD1 3.7Å; K261-L265 VanDerWaalsContact O-CG 3.29Å; K261-L265 WeakPolarHBondContact O-CG 3.41Å; K261-L265 PolarHBondContact O-N 3.49Å; K261-L265 VanDerWaalsContact O-N 3.16Å; V262-L265 PolarHBondContact O-N 3.13Å; L263-L265 PolarHBondContact O-N 2.76Å; L265-G267 VanDerWaalsContact C-N 3.27Å
266	T	97.4	Very high	96.8	Very high	29 Å²	29	44.1 Å²	44.1	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-73.2	-23	171.7	70.2	0	0	0	0	112	A43 D129 A130 P172 V262 L263 E264 K268	A43-T266 HydrophobicContact CB-CG2 4.29Å; D129-T266 HydrophobicContact CB-CG2 4.07Å; A130-T266 HydrophobicContact CB-CG2 4.03Å; P172-T266 HydrophobicContact CG-CG2 3.75Å; V262-T266 WeakPolarHBondContact O-CG2 3.14Å; V262-T266 PolarHBondContact O-N 2.96Å; L263-T266 WeakPolarHBondContact O-CB 3.27Å; L263-T266 PolarHBondContact O-N 3.05Å; L263-T266 PolarHBondContact O-OG1 2.79Å; E264-T266 VanDerWaalsContact C-N 3.28Å; E264-T266 PolarHBondContact O-N 2.98Å; T266-K268 PolarHBondContact O-N 3.4Å; T266-K268 PolarHBondContact OG1-N 3.09Å
267	G	91.9	Very high	96.6	Very high	68 Å²	68	47.1 Å²	47.1	70%	0.701	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	17.9	-176.4	0	0	0	0	0	114.2	E264 L265	E264-G267 PolarHBondContact O-N 3.3Å; L265-G267 VanDerWaalsContact C-N 3.27Å
268	K	82.2	Confident	96.4	Very high	83 Å²	83	48.5 Å²	48.5	36%	0.361	26%	0.264	S	S	.	.			trans	-96.1	0	176.2	-69.6	-155.5	177.4	173.1	0	112.8	Q40 P41 D129 T266	Q40-K268 WeakPolarHBondContact CB-OXT 3.35Å; Q40-K268 PolarHBondContact NE2-OXT 3.05Å; Q40-K268 VanDerWaalsContact NE2-OXT 3.07Å; Q40-K268 PolarHBondContact OE1-OXT 3.29Å; P41-K268 HydrophobicContact CG-CD 4.41Å; P41-K268 WeakPolarHBondContact O-CD 3.23Å; D129-K268 VanDerWaalsContact CG-CE 3.42Å; D129-K268 WeakPolarHBondContact OD1-CE 3.29Å; D129-K268 IonicContact OD1-NZ 2.76Å; D129-K268 PolarHBondContact OD1-NZ 3.48Å; D129-K268 VanDerWaalsContact OD1-NZ 3.08Å; D129-K268 VanDerWaalsContact OD2-CE 3.29Å; D129-K268 WeakPolarHBondContact OD2-CE 3.17Å; D129-K268 IonicContact OD2-NZ 3.74Å; D129-K268 PolarHBondContact OD2-NZ 2.67Å; T266-K268 PolarHBondContact O-N 3.4Å; T266-K268 PolarHBondContact OG1-N 3.09Å

Retrieved 268 of 268 residues in 524 ms (Link to these results)

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