A0A096NXA4_PAPAN Loading...

Ganglioside induced differentiation associated protein 1 like 1

AlphaFold DB (A0A2K5ZV58), UniProt , Accession A0A096NXA4, Species PAPAN (Papio anubis, Olive baboon), Gene GDAP1L1, Length 386 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	31.5	Very low	27.2	Very low	252 Å²	252	144.4 Å²	144.4	100%	1.241	84%	0.838	S	S	*	*				0	99.3	0	-68.7	-178.3	-173.2	0	0	106.8
2	A	27	Very low	27	Very low	100 Å²	100	142 Å²	142	83%	0.826	83%	0.834	S	S	*	*			trans	-111.5	118.1	-179.8	0	0	0	0	0	107.7
3	T	25.6	Very low	26.8	Very low	132 Å²	132	137.2 Å²	137.2	81%	0.81	81%	0.813	S	S	*	*			trans	-69.2	137.5	170.7	30.2	0	0	0	0	110.3
4	P	28.4	Very low	26.5	Very low	108 Å²	108	143.7 Å²	143.7	70%	0.701	82%	0.816	S	S	*	*			trans	-81.1	130.5	175.4	31.3	-30.9	0	0	0	110.8	N6	P4-N6 PolarHBondContact O-N 3.26Å
5	N	27.6	Very low	26.2	Very low	161 Å²	161	150.5 Å²	150.5	86%	0.861	82%	0.824	S	S	*	*			trans	-74.7	99.5	168.8	-85.9	-14.2	0	0	0	109.2	L7	N5-L7 PolarHBondContact O-N 3.09Å
6	N	27	Very low	26.2	Very low	148 Å²	148	146.8 Å²	146.8	79%	0.791	81%	0.809	S	S	*	*			trans	-71	108.7	161.2	-81	-25.2	0	0	0	108.8	P4	P4-N6 PolarHBondContact O-N 3.26Å
7	L	28.5	Very low	26.1	Very low	170 Å²	170	148.6 Å²	148.6	89%	0.89	82%	0.816	S	S	*	*			trans	-90.3	104.2	161.9	-74.1	166.9	0	0	0	108	N5	N5-L7 PolarHBondContact O-N 3.09Å
8	T	26.1	Very low	26.1	Very low	116 Å²	116	146.1 Å²	146.1	71%	0.712	81%	0.81	S	S	*	*			trans	-64.6	148.5	168	41.3	0	0	0	0	110.9	T10	T8-T10 PolarHBondContact O-N 2.79Å
9	P	26.3	Very low	26.2	Very low	126 Å²	126	143.2 Å²	143.2	82%	0.818	81%	0.807	S	S	*	*			trans	-67.1	120.9	177.4	25.1	-27.5	0	0	0	109.9	N11	P9-N11 PolarHBondContact O-N 3.17Å
10	T	26.5	Very low	26.2	Very low	127 Å²	127	144.4 Å²	144.4	78%	0.779	81%	0.811	S	S	*	*			trans	-67.3	101.7	169.8	43	0	0	0	0	109.1	T8 C12	T8-T10 PolarHBondContact O-N 2.79Å; T10-C12 PolarHBondContact O-N 2.84Å; T10-C12 VanDerWaalsContact O-N 3.13Å
11	N	24.5	Very low	26.3	Very low	148 Å²	148	146.6 Å²	146.6	79%	0.791	81%	0.814	S	S	*	*			trans	-67.2	94.8	161.9	-163.9	11.9	0	0	0	107.7	P9 S13	P9-N11 PolarHBondContact O-N 3.17Å; N11-S13 PolarHBondContact O-N 3.06Å
12	C	25.5	Very low	26.1	Very low	116 Å²	116	139.8 Å²	139.8	78%	0.784	79%	0.791	S	S	*	*			trans	-91.5	91.7	175.1	-79.8	0	0	0	0	109.6	T10	T10-C12 PolarHBondContact O-N 2.84Å; T10-C12 VanDerWaalsContact O-N 3.13Å
13	S	24.4	Very low	26.2	Very low	80 Å²	80	143 Å²	143	56%	0.559	80%	0.795	S	S	*	*			trans	-100	82.2	177.1	57.5	0	0	0	0	111.4	N11	N11-S13 PolarHBondContact O-N 3.06Å
14	W	21.8	Very low	26.3	Very low	228 Å²	228	141.3 Å²	141.3	86%	0.864	79%	0.794	S	S	*	*			trans	-156.2	107.1	163.4	-66.4	93	0	0	0	106.3
15	W	22.7	Very low	26.3	Very low	246 Å²	246	141 Å²	141	93%	0.932	80%	0.801	S	S	*	*				-154	155.1	69.7	-86.7	79.5	0	0	0	113.5
16	P	25.3	Very low	26.4	Very low	91 Å²	91	142.9 Å²	142.9	59%	0.591	80%	0.801	S	S	*	*			trans	-99.2	139.2	-177.3	36.5	-27.5	0	0	0	112.6
17	I	24.9	Very low	26.8	Very low	178 Å²	178	141.7 Å²	141.7	91%	0.913	80%	0.802	S	S	*	*			trans	-100.7	91.6	157	-56.6	178.8	0	0	0	106.6
18	S	26.7	Very low	26.8	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	80%	0.8	S	S	*	*			trans	-81.6	124.6	161	-65.7	0	0	0	0	107.9	L20	S18-L20 PolarHBondContact O-N 3.39Å
19	A	27.9	Very low	27.2	Very low	91 Å²	91	142.6 Å²	142.6	75%	0.752	81%	0.811	S	S	*	*			trans	-53.7	129.9	165.3	0	0	0	0	0	109.8
20	L	25.2	Very low	27.4	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	81%	0.811	S	S	*	*			trans	-120.1	108.2	155.3	-143.3	83.5	0	0	0	106.6	S18	S18-L20 PolarHBondContact O-N 3.39Å
21	E	29.3	Very low	27.8	Very low	190 Å²	190	141 Å²	141	89%	0.888	81%	0.811	S	S	*	*			trans	-63.4	132	159.2	-71.8	169.4	148.3	0	0	108.1
22	S	27.3	Very low	28.2	Very low	109 Å²	109	142 Å²	142	76%	0.762	82%	0.816	S	S	*	*			trans	-146.7	114.8	149.8	76.2	0	0	0	0	109.6
23	D	28	Very low	28.5	Very low	167 Å²	167	140.6 Å²	140.6	89%	0.893	81%	0.813	S	S	*	*			trans	-54.1	134	164.9	-78.7	-44.7	0	0	0	111.6
24	A	28.3	Very low	29	Very low	97 Å²	97	143.1 Å²	143.1	80%	0.802	83%	0.828	S	S	*	*				154.6	140.2	115.2	0	0	0	0	0	113.5
25	A	28.6	Very low	29.4	Very low	102 Å²	102	140.3 Å²	140.3	84%	0.843	82%	0.824	S	S	*	*			trans	85.5	102.1	156.2	0	0	0	0	0	120.2
26	K	29.4	Very low	29.9	Very low	200 Å²	200	133 Å²	133	87%	0.87	82%	0.816	S	S	*	*			trans	-64.3	160.6	140.7	-80.7	-177.6	175.7	-178.6	0	109.5
27	P	36.5	Very low	30.3	Very low	123 Å²	123	133.4 Å²	133.4	80%	0.799	83%	0.827	S	S	*	*			cis	-148.9	173.1	33.4	39.9	-18.7	0	0	0	118.2
28	A	28.6	Very low	30.7	Very low	103 Å²	103	128.8 Å²	128.8	85%	0.851	81%	0.81	S	S	*	*			trans	139.3	126.2	130.4	0	0	0	0	0	113.9
29	E	34.1	Very low	31.2	Very low	203 Å²	203	130 Å²	130	95%	0.949	82%	0.816	S	S	*	*			trans	-72.6	139.7	-177.5	-70.4	167.1	134.5	0	0	114
30	A	29.9	Very low	31.6	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	81%	0.805	S	S	*	*			trans	-162.3	154.4	154.3	0	0	0	0	0	109.8
31	P	34.5	Very low	32	Very low	119 Å²	119	130 Å²	130	77%	0.773	81%	0.806	S	S	*	*			trans	-96.2	148.3	-135.9	35.7	-35.4	0	0	0	116.6
32	D	33.6	Very low	32.6	Very low	170 Å²	170	126 Å²	126	91%	0.909	78%	0.783	S	S	*	*			trans	19.7	90.4	157.8	-60.8	-23.1	0	0	0	119
33	A	32.3	Very low	33.8	Very low	86 Å²	86	125.2 Å²	125.2	71%	0.711	78%	0.775	S	S	*	*			trans	-93.7	143.8	150.7	0	0	0	0	0	109.1	E35	A33-E35 PolarHBondContact O-N 3.39Å; A33-E35 VanDerWaalsContact O-N 3.1Å
34	P	33.4	Very low	35.1	Very low	134 Å²	134	127.7 Å²	127.7	87%	0.87	77%	0.772	S	S	*	*			trans	-62.8	118.8	-176.5	25.2	-31.6	0	0	0	110.2	A36	P34-A36 PolarHBondContact O-N 3.1Å
35	E	30.7	Very low	37	Very low	169 Å²	169	128.8 Å²	128.8	79%	0.79	76%	0.761	S	S	*	*			trans	-47.2	113.8	-179.8	-153.4	172.3	-170.2	0	0	110.7	A33 A37	A33-E35 PolarHBondContact O-N 3.39Å; A33-E35 VanDerWaalsContact O-N 3.1Å; E35-A37 PolarHBondContact O-N 3.24Å
36	A	34.3	Very low	39.6	Very low	91 Å²	91	125.5 Å²	125.5	75%	0.752	73%	0.731	S	S	*	*			trans	-57.2	127.5	166	0	0	0	0	0	107.9	P34 S38	P34-A36 PolarHBondContact O-N 3.1Å; A36-S38 PolarHBondContact O-N 3.23Å
37	A	31.8	Very low	42.6	Very low	101 Å²	101	116.3 Å²	116.3	84%	0.835	69%	0.692	S	S	*	*			trans	-45.5	112.6	-174.4	0	0	0	0	0	112.2	E35	E35-A37 PolarHBondContact O-N 3.24Å
38	S	34.4	Very low	45.5	Very low	80 Å²	80	110.6 Å²	110.6	56%	0.559	66%	0.655	S	S	*	*			trans	-52.1	144.5	170.7	-57.5	0	0	0	0	110.6	A36 A40	A36-S38 PolarHBondContact O-N 3.23Å; S38-A40 PolarHBondContact O-N 2.99Å
39	P	37.3	Very low	48.7	Very low	130 Å²	130	105.7 Å²	105.7	84%	0.844	61%	0.614	S	S	*	*			trans	-64.5	104.6	178.5	26.5	-31	0	0	0	107.9	H41	P39-H41 PolarHBondContact O-N 3.3Å
40	A	37	Very low	51.7	Low	63 Å²	63	97.2 Å²	97.2	52%	0.521	57%	0.574	S	S	.	*			trans	-54.5	124.4	-178.5	0	0	0	0	0	110	S38 W42	S38-A40 PolarHBondContact O-N 2.99Å; A40-W42 VanDerWaalsContact C-N 3.28Å; A40-W42 HydrophobicContact CB-CE3 3.5Å; A40-W42 VanDerWaalsContact CB-CE3 3.5Å; A40-W42 HydrophobicContact CB-CH2 4.17Å; A40-W42 HydrophobicContact CB-CZ3 3.19Å; A40-W42 PolarHBondContact O-N 2.71Å
41	H	33.4	Very low	54.8	Low	193 Å²	193	92.6 Å²	92.6	89%	0.894	54%	0.535	S	S	*	.			trans	-70.1	85.1	179.5	-142.2	-62.7	0	0	0	108.3	P39	P39-H41 PolarHBondContact O-N 3.3Å
42	W	40.8	Very low	57.4	Low	108 Å²	108	89.4 Å²	89.4	41%	0.409	51%	0.508	S	S	.	.			trans	-66	132.2	176.8	-113.1	-105.3	0	0	0	108.9	A40 R44 E73 R75	A40-W42 VanDerWaalsContact C-N 3.28Å; A40-W42 HydrophobicContact CB-CE3 3.5Å; A40-W42 VanDerWaalsContact CB-CE3 3.5Å; A40-W42 HydrophobicContact CB-CH2 4.17Å; A40-W42 HydrophobicContact CB-CZ3 3.19Å; A40-W42 PolarHBondContact O-N 2.71Å; W42-R44 PolarHBondContact O-N 3.06Å; W42-R44 VanDerWaalsContact O-N 3.09Å; W42-E73 WeakPolarHBondContact CZ2-OE1 3.42Å; W42-E73 WeakPolarHBondContact CZ2-OE2 3.46Å; W42-E73 PolarHBondContact NE1-OE2 3.13Å; W42-R75 VanDerWaalsContact CE2-NH2 3.27Å
43	P	53.3	Low	60	Low	91 Å²	91	82.3 Å²	82.3	59%	0.591	47%	0.471	S	S	*	.			trans	-55.2	123.3	169.4	-15.9	27.4	0	0	0	106.8	E45 S46	P43-E45 PolarHBondContact O-N 3.26Å; P43-S46 PolarHBondContact O-N 3.24Å; P43-S46 PolarHBondContact O-OG 2.8Å
44	R	53.9	Low	62.5	Low	220 Å²	220	79.2 Å²	79.2	83%	0.83	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-14.6	-173.5	-77.8	-176.2	171.4	179.7	-3.8	113.8	W42 R104	W42-R44 PolarHBondContact O-N 3.06Å; W42-R44 VanDerWaalsContact O-N 3.09Å; R44-R104 WeakPolarHBondContact O-CG 3.28Å
45	E	69.9	Low	65.2	Low	119 Å²	119	73.7 Å²	73.7	56%	0.556	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-1.7	-178.9	-52.9	-156.4	140.8	0	0	115.4	P43 R104	P43-E45 PolarHBondContact O-N 3.26Å; E45-R104 IonicContact OE1-NH2 3.58Å; E45-R104 PolarHBondContact OE1-NH2 3.1Å
46	S	83.4	Confident	68.2	Low	33 Å²	33	66.7 Å²	66.7	23%	0.231	37%	0.373	C	S	.	.			trans	-75.8	133	-177.5	54.8	0	0	0	0	111.9	P43	P43-S46 PolarHBondContact O-N 3.24Å; P43-S46 PolarHBondContact O-OG 2.8Å
47	L	92.4	Very high	71.1	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.037	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116	173.8	-173.3	65.5	0	0	0	109.3	L70 C72 E73 I101 H103 F122	L47-L70 HydrophobicContact CD2-CB 4.4Å; L47-L70 HydrophobicContact CD2-CD1 4.19Å; L47-C72 HydrophobicContact CD2-CB 4.1Å; L47-C72 HydrophobicContact CG-CB 4.33Å; L47-C72 CarbonylContact O-C 3.51Å; L47-C72 WeakPolarHBondContact O-CA 3.22Å; L47-C72 PolarHBondContact O-SG 3.27Å; L47-E73 PolarHBondContact O-N 2.82Å; L47-I101 HydrophobicContact CD1-CD1 3.48Å; L47-I101 VanDerWaalsContact CD1-CD1 3.48Å; L47-I101 HydrophobicContact CD1-CG1 3.71Å; L47-I101 HydrophobicContact CD2-CD1 4.33Å; L47-I101 HydrophobicContact CG-CD1 4.03Å; L47-I101 HydrophobicContact CG-CG1 4.32Å; L47-H103 HydrophobicContact CD1-CB 3.72Å; L47-F122 HydrophobicContact CD1-CE2 4.44Å; L47-F122 HydrophobicContact CD1-CZ 4.49Å; L47-F122 HydrophobicContact CD2-CE2 4.33Å; L47-F122 HydrophobicContact CD2-CZ 4.43Å
48	V	95.6	Very high	74.1	Confident	4 Å²	4	59 Å²	59	2%	0.024	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.5	179.9	-172.4	0	0	0	0	109.5	Y50 E73 R75 I101 I102	V48-Y50 HydrophobicContact CG1-CD2 4.31Å; V48-Y50 HydrophobicContact CG1-CE2 3.94Å; V48-E73 CarbonylContact C-O 3.59Å; V48-E73 WeakPolarHBondContact CA-O 3.13Å; V48-E73 HydrophobicContact CG1-CB 4.42Å; V48-E73 HydrophobicContact CG2-CB 4.24Å; V48-R75 HydrophobicContact CG1-CG 4.16Å; V48-I101 CarbonylContact O-C 3.58Å; V48-I101 WeakPolarHBondContact O-CA 3.32Å; V48-I101 WeakPolarHBondContact O-CG1 3.25Å; V48-I102 HydrophobicContact CB-CB 4.39Å; V48-I102 PolarHBondContact N-O 3.48Å; V48-I102 PolarHBondContact O-N 3.03Å
49	L	96.8	Very high	77	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114	177.7	179.4	71.8	0	0	0	109.9	H51 V61 R62 I65 C72 E73 E74 R75 P99 I101	L49-H51 HydrophobicContact CD2-CB 4.03Å; L49-H51 HydrophobicContact CG-CB 4Å; L49-V61 HydrophobicContact CD1-CG1 3.73Å; L49-V61 HydrophobicContact CD2-CG1 4.24Å; L49-R62 HydrophobicContact CD2-CG 3.54Å; L49-I65 HydrophobicContact CD2-CD1 4Å; L49-C72 WeakPolarHBondContact CB-SG 3.38Å; L49-E73 PolarHBondContact N-O 3.26Å; L49-E74 HydrophobicContact CD2-CG 4.47Å; L49-R75 PolarHBondContact O-N 3.04Å; L49-P99 HydrophobicContact CD1-CB 3.7Å; L49-I101 HydrophobicContact CD1-CB 4.45Å; L49-I101 HydrophobicContact CD1-CG1 4.37Å
50	Y	96.5	Very high	79.9	Confident	25 Å²	25	49.4 Å²	49.4	10%	0.098	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.9	164.6	-67.3	-98.7	0	0	0	109	V48 R75 V77 W88 L92 P99 V100 I102	V48-Y50 HydrophobicContact CG1-CD2 4.31Å; V48-Y50 HydrophobicContact CG1-CE2 3.94Å; Y50-R75 CarbonylContact C-O 3.58Å; Y50-R75 VanDerWaalsContact CA-O 3.32Å; Y50-R75 WeakPolarHBondContact CA-O 3.25Å; Y50-R75 HydrophobicContact CD1-CB 3.85Å; Y50-R75 HydrophobicContact CE1-CB 4.14Å; Y50-R75 HydrophobicContact CE1-CG 4.48Å; Y50-R75 HydrophobicContact CG-CB 4.29Å; Y50-R75 PolarHBondContact OH-NH1 3.24Å; Y50-V77 HydrophobicContact CD1-CG2 3.92Å; Y50-V77 HydrophobicContact CG-CG2 4.44Å; Y50-W88 HydrophobicContact CD1-CH2 4.29Å; Y50-W88 AromaticContact CD1-CZ3 3.96Å; Y50-W88 HydrophobicContact CD1-CZ3 3.96Å; Y50-W88 HydrophobicContact CE1-CH2 4.24Å; Y50-W88 AromaticContact CE1-CZ3 3.63Å; Y50-W88 HydrophobicContact CE1-CZ3 3.63Å; Y50-L92 HydrophobicContact CD1-CD1 4.35Å; Y50-L92 HydrophobicContact CD2-CD1 4.26Å; Y50-L92 HydrophobicContact CE1-CD1 4Å; Y50-L92 HydrophobicContact CE2-CD1 3.95Å; Y50-L92 HydrophobicContact CG-CD1 4.43Å; Y50-P99 CarbonylContact O-C 3.53Å; Y50-P99 WeakPolarHBondContact O-CA 3.43Å; Y50-P99 WeakPolarHBondContact O-CB 3.45Å; Y50-V100 PolarHBondContact N-O 3.38Å; Y50-V100 PolarHBondContact O-N 3.22Å; Y50-I102 HydrophobicContact CD2-CD1 4.32Å; Y50-I102 HydrophobicContact CD2-CG1 4.44Å; Y50-I102 HydrophobicContact CE2-CD1 3.63Å; Y50-I102 HydrophobicContact CE2-CG1 4.15Å
51	H	94.4	Very high	82.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	172.9	-174.4	71.1	78.7	0	0	0	112.6	L49 R62 E74 R75 D76 V77 P99	L49-H51 HydrophobicContact CD2-CB 4.03Å; L49-H51 HydrophobicContact CG-CB 4Å; H51-R62 PolarHBondContact CE1-NE 2.88Å; H51-E74 IonicContact CD2-OE2 3.77Å; H51-E74 IonicContact CE1-OE2 3.38Å; H51-E74 VanDerWaalsContact NE2-CB 3.33Å; H51-E74 WeakPolarHBondContact NE2-CB 3.46Å; H51-E74 WeakPolarHBondContact NE2-CG 3.47Å; H51-E74 IonicContact NE2-OE2 3.98Å; H51-E74 PolarHBondContact NE2-OE2 3.28Å; H51-R75 PolarHBondContact N-O 2.95Å; H51-D76 IonicContact CE1-OD1 3.17Å; H51-D76 PolarHBondContact CE1-OD1 3.26Å; H51-D76 IonicContact ND1-OD1 2.57Å; H51-D76 CarbonylContact O-C 3.52Å; H51-D76 WeakPolarHBondContact O-CA 3.48Å; H51-V77 PolarHBondContact O-N 3.44Å; H51-P99 HydrophobicContact CB-CB 4.33Å
52	W	90.4	Very high	85.8	Confident	52 Å²	52	38.6 Å²	38.6	20%	0.197	18%	0.181	C	C	.	.			trans	-126.4	127.8	163.1	-176.7	54.1	0	0	0	109.4	Q54 S55 S58 V77 L79 P80 V98	W52-Q54 HydrophobicContact CD2-CB 3.8Å; W52-Q54 VanDerWaalsContact CE3-C 3.48Å; W52-Q54 HydrophobicContact CE3-CB 3.65Å; W52-Q54 HydrophobicContact CH2-CB 3.35Å; W52-Q54 HydrophobicContact CH2-CG 4.08Å; W52-Q54 HydrophobicContact CZ2-CB 3.46Å; W52-Q54 VanDerWaalsContact CZ2-CB 3.46Å; W52-Q54 HydrophobicContact CZ2-CG 3.74Å; W52-Q54 HydrophobicContact CZ3-CB 3.44Å; W52-Q54 VanDerWaalsContact CZ3-CB 3.44Å; W52-Q54 PolarHBondContact O-N 3.36Å; W52-S55 WeakPolarHBondContact O-CB 3.35Å; W52-S55 PolarHBondContact O-N 2.99Å; W52-S58 PolarHBondContact N-OG 3.36Å; W52-S58 WeakPolarHBondContact O-CB 3.43Å; W52-S58 PolarHBondContact O-OG 3.17Å; W52-V77 WeakPolarHBondContact CB-O 3.29Å; W52-L79 HydrophobicContact CB-CD1 3.85Å; W52-L79 HydrophobicContact CD2-CB 3.98Å; W52-L79 HydrophobicContact CD2-CD1 4.36Å; W52-L79 HydrophobicContact CD2-CD2 4.36Å; W52-L79 HydrophobicContact CD2-CG 4.46Å; W52-L79 HydrophobicContact CE3-CB 3.98Å; W52-L79 HydrophobicContact CE3-CD1 4.43Å; W52-L79 HydrophobicContact CE3-CD2 3.67Å; W52-L79 HydrophobicContact CE3-CG 4.24Å; W52-L79 HydrophobicContact CG-CB 4.44Å; W52-L79 HydrophobicContact CG-CD1 4.14Å; W52-L79 HydrophobicContact CZ3-CB 4.25Å; W52-L79 HydrophobicContact CZ3-CD2 4.03Å; W52-P80 HydrophobicContact CZ2-CG 3.78Å; W52-V98 HydrophobicContact CB-CG2 3.95Å
53	T	88.1	Confident	88.5	Confident	21 Å²	21	33.7 Å²	33.7	13%	0.129	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.2	-173.5	54.5	0	0	0	0	114.2	Q59	T53-Q59 WeakPolarHBondContact O-CG 3.2Å; T53-Q59 PolarHBondContact O-NE2 3.46Å
54	Q	84.5	Confident	90.6	Very high	22 Å²	22	29.4 Å²	29.4	10%	0.103	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.2	179.9	-55	-62.5	-38.4	0	0	113.7	W52 R298 T340	W52-Q54 HydrophobicContact CD2-CB 3.8Å; W52-Q54 VanDerWaalsContact CE3-C 3.48Å; W52-Q54 HydrophobicContact CE3-CB 3.65Å; W52-Q54 HydrophobicContact CH2-CB 3.35Å; W52-Q54 HydrophobicContact CH2-CG 4.08Å; W52-Q54 HydrophobicContact CZ2-CB 3.46Å; W52-Q54 VanDerWaalsContact CZ2-CB 3.46Å; W52-Q54 HydrophobicContact CZ2-CG 3.74Å; W52-Q54 HydrophobicContact CZ3-CB 3.44Å; W52-Q54 VanDerWaalsContact CZ3-CB 3.44Å; W52-Q54 PolarHBondContact O-N 3.36Å; Q54-R298 PolarHBondContact O-NH2 3.08Å; Q54-T340 PolarHBondContact NE2-OG1 2.91Å; Q54-T340 VanDerWaalsContact NE2-OG1 3.14Å; Q54-T340 PolarHBondContact OE1-OG1 3.26Å
55	S	90.5	Very high	92.5	Very high	17 Å²	17	19.2 Å²	19.2	12%	0.119	10%	0.096	C	C	.	.			trans	-73.2	131.1	173.7	161.9	0	0	0	0	109.5	W52 S57 S58 Q59 V98	W52-S55 WeakPolarHBondContact O-CB 3.35Å; W52-S55 PolarHBondContact O-N 2.99Å; S55-S57 PolarHBondContact O-N 3.17Å; S55-S58 WeakPolarHBondContact CB-OG 3.05Å; S55-S58 WeakPolarHBondContact O-CB 3.43Å; S55-S58 PolarHBondContact O-N 3.46Å; S55-S58 PolarHBondContact OG-N 2.91Å; S55-S58 PolarHBondContact OG-OG 3.46Å; S55-Q59 VanDerWaalsContact O-CG 3.24Å; S55-Q59 WeakPolarHBondContact O-CG 3.32Å; S55-Q59 PolarHBondContact O-N 3.09Å; S55-V98 PolarHBondContact OG-O 2.85Å
56	F	93.2	Very high	93.7	Very high	23 Å²	23	14.2 Å²	14.2	10%	0.101	8%	0.076	C	C	.	.	H	α-helix	trans	-62.3	-44.5	-178.8	-179.7	-120.2	0	0	0	112.1	S58 Q59 K60 M173 A294 R298	F56-S58 VanDerWaalsContact C-N 3.32Å; F56-S58 PolarHBondContact O-N 2.71Å; F56-Q59 WeakPolarHBondContact O-CB 3.46Å; F56-Q59 PolarHBondContact O-N 2.93Å; F56-Q59 VanDerWaalsContact O-N 3.17Å; F56-K60 HydrophobicContact CE1-CD 4.37Å; F56-K60 VanDerWaalsContact CZ-CE 3.48Å; F56-K60 PolarHBondContact O-N 3.43Å; F56-K60 VanDerWaalsContact O-N 3.1Å; F56-M173 HydrophobicContact CD1-CB 3.96Å; F56-M173 HydrophobicContact CD1-CG 4.08Å; F56-M173 HydrophobicContact CE1-CB 3.93Å; F56-M173 HydrophobicContact CE1-CG 3.52Å; F56-M173 HydrophobicContact CE2-CE 4.39Å; F56-M173 HydrophobicContact CZ-CE 4.24Å; F56-M173 HydrophobicContact CZ-CG 3.99Å; F56-A294 HydrophobicContact CE2-CB 4.17Å; F56-R298 HydrophobicContact CD2-CB 3.85Å; F56-R298 HydrophobicContact CD2-CG 4.06Å; F56-R298 HydrophobicContact CE2-CB 3.83Å; F56-R298 HydrophobicContact CE2-CG 4.36Å
57	S	94.9	Very high	94.2	Very high	29 Å²	29	13.8 Å²	13.8	20%	0.203	7%	0.07	C	C	.	.	H	α-helix	trans	-64.9	-37	176.4	-52	0	0	0	0	112	S55 Q59 K60 V61	S55-S57 PolarHBondContact O-N 3.17Å; S57-Q59 VanDerWaalsContact C-N 3.35Å; S57-K60 PolarHBondContact O-N 3.02Å; S57-V61 PolarHBondContact O-N 3.21Å
58	S	95.6	Very high	94.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.5	-40.3	173	-69.7	0	0	0	0	112	W52 S55 F56 V61 R62	W52-S58 PolarHBondContact N-OG 3.36Å; W52-S58 WeakPolarHBondContact O-CB 3.43Å; W52-S58 PolarHBondContact O-OG 3.17Å; S55-S58 WeakPolarHBondContact CB-OG 3.05Å; S55-S58 WeakPolarHBondContact O-CB 3.43Å; S55-S58 PolarHBondContact O-N 3.46Å; S55-S58 PolarHBondContact OG-N 2.91Å; S55-S58 PolarHBondContact OG-OG 3.46Å; F56-S58 VanDerWaalsContact C-N 3.32Å; F56-S58 PolarHBondContact O-N 2.71Å; S58-V61 PolarHBondContact O-N 2.7Å; S58-R62 WeakPolarHBondContact O-CB 3.49Å; S58-R62 WeakPolarHBondContact O-CG 3.15Å; S58-R62 PolarHBondContact O-N 3.4Å
59	Q	95.6	Very high	93.9	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.028	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-44.4	176.7	-71.2	170	-13.8	0	0	111.5	T53 S55 F56 S57 R62 L63 L334	T53-Q59 WeakPolarHBondContact O-CG 3.2Å; T53-Q59 PolarHBondContact O-NE2 3.46Å; S55-Q59 VanDerWaalsContact O-CG 3.24Å; S55-Q59 WeakPolarHBondContact O-CG 3.32Å; S55-Q59 PolarHBondContact O-N 3.09Å; F56-Q59 WeakPolarHBondContact O-CB 3.46Å; F56-Q59 PolarHBondContact O-N 2.93Å; F56-Q59 VanDerWaalsContact O-N 3.17Å; S57-Q59 VanDerWaalsContact C-N 3.35Å; Q59-R62 PolarHBondContact O-N 3.04Å; Q59-L63 WeakPolarHBondContact O-CB 3.34Å; Q59-L63 VanDerWaalsContact O-CG 3.25Å; Q59-L63 WeakPolarHBondContact O-CG 3.13Å; Q59-L63 PolarHBondContact O-N 2.73Å; Q59-L334 HydrophobicContact CB-CD2 3.95Å; Q59-L334 HydrophobicContact CG-CD2 3.56Å
60	K	96.9	Very high	93.6	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.017	10%	0.103	C	C	.	.	H	α-helix	trans	-55.7	-53.4	174.9	-69	-179.4	174.1	-176.2	0	111.5	F56 S57 L63 V64 Y111 I115 D169 L291 A294	F56-K60 HydrophobicContact CE1-CD 4.37Å; F56-K60 VanDerWaalsContact CZ-CE 3.48Å; F56-K60 PolarHBondContact O-N 3.43Å; F56-K60 VanDerWaalsContact O-N 3.1Å; S57-K60 PolarHBondContact O-N 3.02Å; K60-L63 PolarHBondContact O-N 2.91Å; K60-V64 WeakPolarHBondContact O-CG2 3.5Å; K60-V64 PolarHBondContact O-N 3.4Å; K60-Y111 HydrophobicContact CD-CD2 4.13Å; K60-Y111 HydrophobicContact CD-CE2 3.93Å; K60-I115 HydrophobicContact CB-CD1 4.33Å; K60-D169 IonicContact NZ-OD1 3.06Å; K60-D169 PolarHBondContact NZ-OD1 3.25Å; K60-L291 HydrophobicContact CB-CD2 4.23Å; K60-L291 HydrophobicContact CD-CD2 3.67Å; K60-L291 HydrophobicContact CG-CD2 3.89Å; K60-A294 HydrophobicContact CG-CB 4.14Å
61	V	97.8	Very high	93.3	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-43.9	-177.9	171.5	0	0	0	0	112	L49 S57 S58 L63 V64 I65 P99 I114 I115	L49-V61 HydrophobicContact CD1-CG1 3.73Å; L49-V61 HydrophobicContact CD2-CG1 4.24Å; S57-V61 PolarHBondContact O-N 3.21Å; S58-V61 PolarHBondContact O-N 2.7Å; V61-L63 VanDerWaalsContact C-N 3.31Å; V61-L63 PolarHBondContact O-N 2.86Å; V61-V64 PolarHBondContact O-N 3.05Å; V61-I65 HydrophobicContact CG1-CD1 3.78Å; V61-I65 HydrophobicContact CG1-CG1 4.42Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 2.88Å; V61-P99 HydrophobicContact CB-CG 4.05Å; V61-P99 HydrophobicContact CG2-CG 3.66Å; V61-I114 HydrophobicContact CB-CG2 4.46Å; V61-I114 HydrophobicContact CG1-CG2 3.62Å; V61-I114 HydrophobicContact CG2-CB 4.26Å; V61-I114 HydrophobicContact CG2-CG2 3.93Å; V61-I115 HydrophobicContact CG2-CG1 4.15Å
62	R	97.1	Very high	93.2	Very high	27 Å²	27	23.9 Å²	23.9	10%	0.102	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-39.4	177.7	-71.1	173.8	81.7	-143.4	3.2	111.9	L49 H51 S58 Q59 A66 E74 V333	L49-R62 HydrophobicContact CD2-CG 3.54Å; H51-R62 PolarHBondContact CE1-NE 2.88Å; S58-R62 WeakPolarHBondContact O-CB 3.49Å; S58-R62 WeakPolarHBondContact O-CG 3.15Å; S58-R62 PolarHBondContact O-N 3.4Å; Q59-R62 PolarHBondContact O-N 3.04Å; R62-A66 VanDerWaalsContact O-CB 3.23Å; R62-A66 WeakPolarHBondContact O-CB 3.23Å; R62-A66 PolarHBondContact O-N 2.91Å; R62-E74 IonicContact CZ-OE2 3.92Å; R62-E74 IonicContact NE-OE2 2.65Å; R62-E74 PolarHBondContact NE-OE2 3.32Å; R62-E74 IonicContact NH2-OE2 3.45Å; R62-E74 PolarHBondContact NH2-OE2 3.18Å; R62-V333 HydrophobicContact CB-CG1 3.56Å; R62-V333 HydrophobicContact CB-CG2 4.12Å
63	L	97.1	Very high	93.3	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-44.9	174.2	-73.5	168.6	0	0	0	111.7	Q59 K60 V61 A66 E67 V290 A294 F330 V333 L334	Q59-L63 WeakPolarHBondContact O-CB 3.34Å; Q59-L63 VanDerWaalsContact O-CG 3.25Å; Q59-L63 WeakPolarHBondContact O-CG 3.13Å; Q59-L63 PolarHBondContact O-N 2.73Å; K60-L63 PolarHBondContact O-N 2.91Å; V61-L63 VanDerWaalsContact C-N 3.31Å; V61-L63 PolarHBondContact O-N 2.86Å; L63-A66 PolarHBondContact O-N 3.47Å; L63-E67 WeakPolarHBondContact O-CB 3.21Å; L63-E67 WeakPolarHBondContact O-CG 3.45Å; L63-E67 PolarHBondContact O-N 3.04Å; L63-V290 HydrophobicContact CB-CG1 3.59Å; L63-V290 HydrophobicContact CD1-CG1 4.2Å; L63-A294 HydrophobicContact CD1-CB 3.81Å; L63-F330 HydrophobicContact CD2-CB 4.34Å; L63-F330 HydrophobicContact CD2-CD2 4.21Å; L63-V333 HydrophobicContact CD2-CB 3.89Å; L63-V333 HydrophobicContact CD2-CG1 4.21Å; L63-V333 HydrophobicContact CD2-CG2 4.27Å; L63-V333 HydrophobicContact CG-CB 4.34Å; L63-V333 HydrophobicContact CG-CG1 4.13Å; L63-L334 HydrophobicContact CD1-CD1 3.86Å; L63-L334 HydrophobicContact CD2-CD1 4.21Å; L63-L334 HydrophobicContact CD2-CG 4.36Å; L63-L334 HydrophobicContact CG-CD1 4.36Å
64	V	97	Very high	93.5	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-49.2	177	169	0	0	0	0	111.1	K60 V61 A66 E67 K68 I115 V118 L149 L287 V290	K60-V64 WeakPolarHBondContact O-CG2 3.5Å; K60-V64 PolarHBondContact O-N 3.4Å; V61-V64 PolarHBondContact O-N 3.05Å; V64-A66 VanDerWaalsContact C-N 3.3Å; V64-A66 PolarHBondContact O-N 3.4Å; V64-E67 PolarHBondContact O-N 3.29Å; V64-K68 HydrophobicContact CG1-CD 4.07Å; V64-K68 WeakPolarHBondContact O-CB 3.49Å; V64-K68 VanDerWaalsContact O-CG 3.27Å; V64-K68 WeakPolarHBondContact O-CG 3.08Å; V64-K68 PolarHBondContact O-N 2.82Å; V64-I115 HydrophobicContact CG2-CD1 4.24Å; V64-I115 HydrophobicContact CG2-CG1 4.11Å; V64-I115 HydrophobicContact CG2-CG2 4.35Å; V64-V118 HydrophobicContact CG1-CG1 3.96Å; V64-L149 HydrophobicContact CB-CD1 4.45Å; V64-L149 HydrophobicContact CG1-CD1 4.11Å; V64-L149 HydrophobicContact CG2-CD1 4.37Å; V64-L287 HydrophobicContact CG2-CD1 3.71Å; V64-V290 HydrophobicContact CG2-CG1 4.02Å
65	I	95.3	Very high	93.9	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-58.3	-43.9	177.2	-71.3	170.7	0	0	0	110.9	L49 V61 G69 L70 C72 I101	L49-I65 HydrophobicContact CD2-CD1 4Å; V61-I65 HydrophobicContact CG1-CD1 3.78Å; V61-I65 HydrophobicContact CG1-CG1 4.42Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 2.88Å; I65-G69 PolarHBondContact O-N 3.03Å; I65-L70 HydrophobicContact CG2-CB 4.07Å; I65-L70 PolarHBondContact O-N 2.68Å; I65-C72 HydrophobicContact CD1-CB 4.48Å; I65-C72 HydrophobicContact CG2-CB 3.62Å; I65-I101 HydrophobicContact CD1-CD1 4.21Å
66	A	94.7	Very high	93.8	Very high	15 Å²	15	33.5 Å²	33.5	12%	0.124	19%	0.19	C	C	.	.	H	α-helix	trans	-70.8	-40.7	-178.7	0	0	0	0	0	113.4	R62 L63 V64 K68 G69 A329 V333	R62-A66 VanDerWaalsContact O-CB 3.23Å; R62-A66 WeakPolarHBondContact O-CB 3.23Å; R62-A66 PolarHBondContact O-N 2.91Å; L63-A66 PolarHBondContact O-N 3.47Å; V64-A66 VanDerWaalsContact C-N 3.3Å; V64-A66 PolarHBondContact O-N 3.4Å; A66-K68 VanDerWaalsContact C-N 3.31Å; A66-K68 PolarHBondContact O-N 2.04Å; A66-G69 PolarHBondContact O-N 3.13Å; A66-G69 VanDerWaalsContact O-N 3.13Å; A66-A329 HydrophobicContact CB-CB 3.66Å; A66-V333 HydrophobicContact CB-CG2 3.83Å
67	E	94.3	Very high	93.5	Very high	23 Å²	23	32.4 Å²	32.4	11%	0.107	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-33.7	176.5	-74.7	-70.5	176.4	0	0	111.9	L63 V64 G69 L149 F285 V290 R327 A329	L63-E67 WeakPolarHBondContact O-CB 3.21Å; L63-E67 WeakPolarHBondContact O-CG 3.45Å; L63-E67 PolarHBondContact O-N 3.04Å; V64-E67 PolarHBondContact O-N 3.29Å; E67-G69 PolarHBondContact O-N 3.24Å; E67-L149 HydrophobicContact CB-CD1 4.19Å; E67-L149 HydrophobicContact CB-CD2 4.22Å; E67-F285 HydrophobicContact CG-CE1 4.02Å; E67-F285 WeakPolarHBondContact OE1-CE1 3.09Å; E67-V290 HydrophobicContact CG-CG2 4.04Å; E67-R327 IonicContact OE1-CZ 3.99Å; E67-R327 IonicContact OE1-NE 3.93Å; E67-R327 PolarHBondContact OE1-NE 3.1Å; E67-R327 IonicContact OE1-NH2 3.43Å; E67-R327 IonicContact OE2-CZ 2.59Å; E67-R327 IonicContact OE2-NE 3.87Å; E67-R327 PolarHBondContact OE2-NE 3.25Å; E67-R327 IonicContact OE2-NH2 3.76Å; E67-R327 PolarHBondContact OE2-NH2 2.96Å; E67-A329 HydrophobicContact CB-CB 4.33Å; E67-A329 VanDerWaalsContact CD-CB 3.44Å; E67-A329 HydrophobicContact CG-CB 3.57Å; E67-A329 WeakPolarHBondContact OE1-CB 3.48Å
68	K	91.4	Very high	92.9	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.017	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.4	173.6	-66.6	-178.7	80.5	65.8	0	113.8	V64 A66 L70 V118 E119 F122 V146 V147 L149	V64-K68 HydrophobicContact CG1-CD 4.07Å; V64-K68 WeakPolarHBondContact O-CB 3.49Å; V64-K68 VanDerWaalsContact O-CG 3.27Å; V64-K68 WeakPolarHBondContact O-CG 3.08Å; V64-K68 PolarHBondContact O-N 2.82Å; A66-K68 VanDerWaalsContact C-N 3.31Å; A66-K68 PolarHBondContact O-N 2.04Å; K68-L70 VanDerWaalsContact C-N 3.28Å; K68-L70 HydrophobicContact CB-CD1 4.16Å; K68-L70 HydrophobicContact CB-CD2 4.41Å; K68-L70 HydrophobicContact CB-CG 3.79Å; K68-L70 HydrophobicContact CD-CD1 4.2Å; K68-L70 PolarHBondContact O-N 3.3Å; K68-V118 HydrophobicContact CD-CG1 3.45Å; K68-V118 VanDerWaalsContact CD-CG1 3.45Å; K68-E119 WeakPolarHBondContact CD-OE1 3.44Å; K68-E119 WeakPolarHBondContact CE-OE1 3.37Å; K68-E119 IonicContact NZ-OE1 3.97Å; K68-E119 PolarHBondContact NZ-OE1 3.02Å; K68-E119 IonicContact NZ-OE2 3.17Å; K68-F122 WeakPolarHBondContact CE-O 3.46Å; K68-F122 PolarHBondContact NZ-O 2.85Å; K68-V146 HydrophobicContact CB-CG1 4.2Å; K68-V147 PolarHBondContact NZ-O 3.06Å; K68-L149 HydrophobicContact CG-CD1 3.98Å; K68-L149 HydrophobicContact CG-CG 4.3Å
69	G	90.2	Very high	92.2	Very high	61 Å²	61	33.8 Å²	33.8	63%	0.629	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	24.8	-178.2	0	0	0	0	0	114	I65 A66 E67	I65-G69 PolarHBondContact O-N 3.03Å; A66-G69 PolarHBondContact O-N 3.13Å; A66-G69 VanDerWaalsContact O-N 3.13Å; E67-G69 PolarHBondContact O-N 3.24Å
70	L	90.6	Very high	91.2	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.11	21%	0.211	C	C	.	.			trans	-74.8	139	-177.1	-59.1	178.5	0	0	0	111.1	L47 I65 K68 C72 V118 F122 V146	L47-L70 HydrophobicContact CD2-CB 4.4Å; L47-L70 HydrophobicContact CD2-CD1 4.19Å; I65-L70 HydrophobicContact CG2-CB 4.07Å; I65-L70 PolarHBondContact O-N 2.68Å; K68-L70 VanDerWaalsContact C-N 3.28Å; K68-L70 HydrophobicContact CB-CD1 4.16Å; K68-L70 HydrophobicContact CB-CD2 4.41Å; K68-L70 HydrophobicContact CB-CG 3.79Å; K68-L70 HydrophobicContact CD-CD1 4.2Å; K68-L70 PolarHBondContact O-N 3.3Å; L70-C72 PolarHBondContact O-N 2.85Å; L70-V118 HydrophobicContact CD1-CG1 3.65Å; L70-F122 HydrophobicContact CD1-CB 4.22Å; L70-F122 HydrophobicContact CD1-CD2 3.74Å; L70-F122 HydrophobicContact CD1-CE2 4.23Å; L70-F122 HydrophobicContact CD1-CG 3.95Å; L70-F122 HydrophobicContact CD2-CB 3.88Å; L70-F122 HydrophobicContact CD2-CD1 3.94Å; L70-F122 HydrophobicContact CD2-CD2 4.47Å; L70-F122 HydrophobicContact CD2-CG 3.86Å; L70-V146 HydrophobicContact CD2-CG1 4.36Å; L70-V146 HydrophobicContact CD2-CG2 4.15Å
71	V	89.7	Confident	90	Very high	139 Å²	139	38 Å²	38	84%	0.842	22%	0.217	S	C	*	.			trans	-79	112.6	169	179.7	0	0	0	0	107.7
72	C	91.9	Very high	89.1	Confident	24 Å²	24	40.1 Å²	40.1	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.5	-179.2	-174.5	0	0	0	0	110	L47 L49 I65 L70 E74	L47-C72 HydrophobicContact CD2-CB 4.1Å; L47-C72 HydrophobicContact CG-CB 4.33Å; L47-C72 CarbonylContact O-C 3.51Å; L47-C72 WeakPolarHBondContact O-CA 3.22Å; L47-C72 PolarHBondContact O-SG 3.27Å; L49-C72 WeakPolarHBondContact CB-SG 3.38Å; I65-C72 HydrophobicContact CD1-CB 4.48Å; I65-C72 HydrophobicContact CG2-CB 3.62Å; L70-C72 PolarHBondContact O-N 2.85Å; C72-E74 PolarHBondContact O-N 3.19Å
73	E	93.9	Very high	88.3	Confident	72 Å²	72	40.5 Å²	40.5	34%	0.336	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	111.8	169.2	-173.8	-167.8	146.1	0	0	108.8	W42 L47 V48 L49 R75	W42-E73 WeakPolarHBondContact CZ2-OE1 3.42Å; W42-E73 WeakPolarHBondContact CZ2-OE2 3.46Å; W42-E73 PolarHBondContact NE1-OE2 3.13Å; L47-E73 PolarHBondContact O-N 2.82Å; V48-E73 CarbonylContact C-O 3.59Å; V48-E73 WeakPolarHBondContact CA-O 3.13Å; V48-E73 HydrophobicContact CG1-CB 4.42Å; V48-E73 HydrophobicContact CG2-CB 4.24Å; L49-E73 PolarHBondContact N-O 3.26Å; E73-R75 IonicContact OE1-CZ 3.33Å; E73-R75 VanDerWaalsContact OE1-CZ 3.28Å; E73-R75 IonicContact OE1-NE 3.51Å; E73-R75 PolarHBondContact OE1-NE 2.8Å; E73-R75 IonicContact OE1-NH2 3.7Å; E73-R75 PolarHBondContact OE1-NH2 3.38Å; E73-R75 IonicContact OE2-NH2 2.74Å
74	E	91.4	Very high	87.6	Confident	75 Å²	75	41.5 Å²	41.5	35%	0.35	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.4	179.2	-80.6	-178.2	-135.4	0	0	110.7	L49 H51 R62 C72	L49-E74 HydrophobicContact CD2-CG 4.47Å; H51-E74 IonicContact CD2-OE2 3.77Å; H51-E74 IonicContact CE1-OE2 3.38Å; H51-E74 VanDerWaalsContact NE2-CB 3.33Å; H51-E74 WeakPolarHBondContact NE2-CB 3.46Å; H51-E74 WeakPolarHBondContact NE2-CG 3.47Å; H51-E74 IonicContact NE2-OE2 3.98Å; H51-E74 PolarHBondContact NE2-OE2 3.28Å; R62-E74 IonicContact CZ-OE2 3.92Å; R62-E74 IonicContact NE-OE2 2.65Å; R62-E74 PolarHBondContact NE-OE2 3.32Å; R62-E74 IonicContact NH2-OE2 3.45Å; R62-E74 PolarHBondContact NH2-OE2 3.18Å; C72-E74 PolarHBondContact O-N 3.19Å
75	R	91.9	Very high	87	Confident	65 Å²	65	43.6 Å²	43.6	25%	0.245	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.3	174.6	-65.9	-171.3	-176.5	175.4	7	110.3	W42 V48 L49 Y50 H51 E73	W42-R75 VanDerWaalsContact CE2-NH2 3.27Å; V48-R75 HydrophobicContact CG1-CG 4.16Å; L49-R75 PolarHBondContact O-N 3.04Å; Y50-R75 CarbonylContact C-O 3.58Å; Y50-R75 VanDerWaalsContact CA-O 3.32Å; Y50-R75 WeakPolarHBondContact CA-O 3.25Å; Y50-R75 HydrophobicContact CD1-CB 3.85Å; Y50-R75 HydrophobicContact CE1-CB 4.14Å; Y50-R75 HydrophobicContact CE1-CG 4.48Å; Y50-R75 HydrophobicContact CG-CB 4.29Å; Y50-R75 PolarHBondContact OH-NH1 3.24Å; H51-R75 PolarHBondContact N-O 2.95Å; E73-R75 IonicContact OE1-CZ 3.33Å; E73-R75 VanDerWaalsContact OE1-CZ 3.28Å; E73-R75 IonicContact OE1-NE 3.51Å; E73-R75 PolarHBondContact OE1-NE 2.8Å; E73-R75 IonicContact OE1-NH2 3.7Å; E73-R75 PolarHBondContact OE1-NH2 3.38Å; E73-R75 IonicContact OE2-NH2 2.74Å
76	D	89.5	Confident	86.4	Confident	102 Å²	102	46.4 Å²	46.4	55%	0.545	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.4	176.1	-82.3	-57.5	0	0	0	111.5	H51	H51-D76 IonicContact CE1-OD1 3.17Å; H51-D76 PolarHBondContact CE1-OD1 3.26Å; H51-D76 IonicContact ND1-OD1 2.57Å; H51-D76 CarbonylContact O-C 3.52Å; H51-D76 WeakPolarHBondContact O-CA 3.48Å
77	V	87.5	Confident	85.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.			trans	-118.6	105.4	170.9	-176.9	0	0	0	0	107.5	Y50 H51 W52 L79 E83 H84 W88 F89 V98	Y50-V77 HydrophobicContact CD1-CG2 3.92Å; Y50-V77 HydrophobicContact CG-CG2 4.44Å; H51-V77 PolarHBondContact O-N 3.44Å; W52-V77 WeakPolarHBondContact CB-O 3.29Å; V77-L79 WeakPolarHBondContact O-CD1 3.34Å; V77-L79 PolarHBondContact O-N 3.02Å; V77-L79 VanDerWaalsContact O-N 3.13Å; V77-E83 WeakPolarHBondContact CA-OE2 3.45Å; V77-E83 HydrophobicContact CG1-CB 3.91Å; V77-H84 HydrophobicContact CG1-CB 4.03Å; V77-W88 HydrophobicContact CG2-CH2 4.11Å; V77-F89 HydrophobicContact CB-CE2 4.38Å; V77-F89 HydrophobicContact CG1-CD2 3.95Å; V77-F89 HydrophobicContact CG1-CE2 4.05Å; V77-F89 HydrophobicContact CG1-CG 4.29Å; V77-F89 HydrophobicContact CG1-CZ 4.44Å; V77-F89 HydrophobicContact CG2-CD2 3.87Å; V77-F89 HydrophobicContact CG2-CE2 3.71Å; V77-V98 HydrophobicContact CB-CG1 3.9Å; V77-V98 HydrophobicContact CG1-CG1 4.09Å; V77-V98 HydrophobicContact CG2-CG1 4.35Å
78	S	82.1	Confident	85.6	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.063	28%	0.28	C	S	.	.			trans	-73	105.2	-173.9	-170.1	0	0	0	0	111.8	Q81 S82 E83	S78-Q81 PolarHBondContact O-N 2.93Å; S78-Q81 PolarHBondContact OG-NE2 3.33Å; S78-S82 PolarHBondContact O-N 3.47Å; S78-E83 PolarHBondContact N-OE2 3.34Å; S78-E83 PolarHBondContact O-N 2.98Å
79	L	80.3	Confident	85.5	Confident	50 Å²	50	50.7 Å²	50.7	26%	0.262	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-46	172.5	-93.3	63.6	0	0	0	113.4	W52 V77 Q81 S82 H84 V98	W52-L79 HydrophobicContact CB-CD1 3.85Å; W52-L79 HydrophobicContact CD2-CB 3.98Å; W52-L79 HydrophobicContact CD2-CD1 4.36Å; W52-L79 HydrophobicContact CD2-CD2 4.36Å; W52-L79 HydrophobicContact CD2-CG 4.46Å; W52-L79 HydrophobicContact CE3-CB 3.98Å; W52-L79 HydrophobicContact CE3-CD1 4.43Å; W52-L79 HydrophobicContact CE3-CD2 3.67Å; W52-L79 HydrophobicContact CE3-CG 4.24Å; W52-L79 HydrophobicContact CG-CB 4.44Å; W52-L79 HydrophobicContact CG-CD1 4.14Å; W52-L79 HydrophobicContact CZ3-CB 4.25Å; W52-L79 HydrophobicContact CZ3-CD2 4.03Å; V77-L79 WeakPolarHBondContact O-CD1 3.34Å; V77-L79 PolarHBondContact O-N 3.02Å; V77-L79 VanDerWaalsContact O-N 3.13Å; L79-Q81 PolarHBondContact O-N 3.31Å; L79-Q81 VanDerWaalsContact O-N 3.15Å; L79-S82 PolarHBondContact O-N 2.59Å; L79-H84 HydrophobicContact CD1-CB 4.37Å; L79-H84 PolarHBondContact O-CE1 2.89Å; L79-V98 HydrophobicContact CD1-CG1 4.25Å; L79-V98 HydrophobicContact CD1-CG2 3.73Å; L79-V98 HydrophobicContact CD2-CG2 4.47Å
80	P	74.6	Confident	85.3	Confident	70 Å²	70	47.8 Å²	47.8	46%	0.455	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.9	177.4	-26.7	35.6	0	0	0	113.8	W52	W52-P80 HydrophobicContact CZ2-CG 3.78Å
81	Q	72.4	Confident	85.2	Confident	27 Å²	27	54.4 Å²	54.4	13%	0.126	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	11.1	178	-65.5	-178.5	72.4	0	0	113.5	S78 L79 E83 N348 R351	S78-Q81 PolarHBondContact O-N 2.93Å; S78-Q81 PolarHBondContact OG-NE2 3.33Å; L79-Q81 PolarHBondContact O-N 3.31Å; L79-Q81 VanDerWaalsContact O-N 3.15Å; Q81-E83 PolarHBondContact O-N 3.12Å; Q81-N348 WeakPolarHBondContact CG-OD1 3.48Å; Q81-N348 PolarHBondContact NE2-OD1 3.11Å; Q81-N348 PolarHBondContact OE1-OD1 3.27Å; Q81-R351 VanDerWaalsContact CB-NH2 3.31Å; Q81-R351 VanDerWaalsContact CD-CZ 3.44Å
82	S	78.6	Confident	85.2	Confident	47 Å²	47	49.6 Å²	49.6	33%	0.329	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	28.1	179.3	-57.2	0	0	0	0	114.7	S78 L79 H84 K85	S78-S82 PolarHBondContact O-N 3.47Å; L79-S82 PolarHBondContact O-N 2.59Å; S82-H84 PolarHBondContact O-N 3.48Å; S82-K85 WeakPolarHBondContact O-CA 3.49Å; S82-K85 WeakPolarHBondContact O-CB 3.41Å; S82-K85 PolarHBondContact O-N 3.36Å
83	E	80.6	Confident	85.1	Confident	36 Å²	36	49.1 Å²	49.1	17%	0.168	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-62.2	-31.5	178.1	-74.2	-174.3	169.9	0	0	112.4	V77 S78 Q81 K85 E86 W88 R351	V77-E83 WeakPolarHBondContact CA-OE2 3.45Å; V77-E83 HydrophobicContact CG1-CB 3.91Å; S78-E83 PolarHBondContact N-OE2 3.34Å; S78-E83 PolarHBondContact O-N 2.98Å; Q81-E83 PolarHBondContact O-N 3.12Å; E83-K85 PolarHBondContact O-N 2.91Å; E83-K85 VanDerWaalsContact O-N 3.09Å; E83-E86 WeakPolarHBondContact O-CB 3.31Å; E83-E86 PolarHBondContact O-N 3.44Å; E83-W88 HydrophobicContact CB-CZ2 4.45Å; E83-R351 IonicContact OE1-CZ 3.16Å; E83-R351 IonicContact OE1-NH2 3.67Å; E83-R351 PolarHBondContact OE1-NH2 3.03Å
84	H	82.3	Confident	84.7	Confident	24 Å²	24	50.6 Å²	50.6	11%	0.111	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-61.9	-13.4	172.9	61.7	-73.9	0	0	0	113.8	V77 L79 S82 F89 E96	V77-H84 HydrophobicContact CG1-CB 4.03Å; L79-H84 HydrophobicContact CD1-CB 4.37Å; L79-H84 PolarHBondContact O-CE1 2.89Å; S82-H84 PolarHBondContact O-N 3.48Å; H84-F89 HydrophobicContact CB-CD1 4.03Å; H84-F89 HydrophobicContact CB-CE1 4.05Å; H84-F89 VanDerWaalsContact O-CD1 3.3Å; H84-F89 WeakPolarHBondContact O-CD1 3.36Å; H84-E96 PolarHBondContact CD2-O 3.06Å; H84-E96 VanDerWaalsContact CD2-O 3.23Å
85	K	83.1	Confident	84.4	Confident	46 Å²	46	48.1 Å²	48.1	20%	0.2	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-100.2	-5.4	174.5	-58	-169.3	173.9	-175.7	0	112.5	S82 E83 Y226	S82-K85 WeakPolarHBondContact O-CA 3.49Å; S82-K85 WeakPolarHBondContact O-CB 3.41Å; S82-K85 PolarHBondContact O-N 3.36Å; E83-K85 PolarHBondContact O-N 2.91Å; E83-K85 VanDerWaalsContact O-N 3.09Å; K85-Y226 HydrophobicContact CB-CE1 3.93Å; K85-Y226 WeakPolarHBondContact O-CE1 3.45Å; K85-Y226 PolarHBondContact O-OH 3.34Å
86	E	83.6	Confident	84.1	Confident	65 Å²	65	45.7 Å²	45.7	30%	0.304	23%	0.233	S	C	.	.	S	Bend	trans	-71.9	144.3	178.6	-68.7	-177.5	167.7	0	0	109.9	E83 W88 F89 M90	E83-E86 WeakPolarHBondContact O-CB 3.31Å; E83-E86 PolarHBondContact O-N 3.44Å; E86-W88 PolarHBondContact O-N 2.77Å; E86-W88 PolarHBondContact OE2-NE1 2.91Å; E86-F89 PolarHBondContact O-N 2.96Å; E86-M90 PolarHBondContact O-N 3.4Å; E86-M90 VanDerWaalsContact O-N 3.11Å
87	P	84.5	Confident	84.1	Confident	44 Å²	44	46 Å²	46	29%	0.286	23%	0.231	S	C	.	.	H	α-helix	trans	-54.4	-33.1	-174.5	-29.8	35.3	0	0	0	114.1	F89 M90 R91 L222	P87-F89 VanDerWaalsContact C-N 3.34Å; P87-F89 PolarHBondContact O-N 2.99Å; P87-M90 PolarHBondContact O-N 3.09Å; P87-R91 WeakPolarHBondContact O-CG 3.44Å; P87-R91 PolarHBondContact O-N 3.45Å; P87-L222 HydrophobicContact CB-CD1 4.29Å
88	W	87.9	Confident	84.3	Confident	87 Å²	87	46.5 Å²	46.5	33%	0.33	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-35.9	178.7	71.4	-97.2	0	0	0	113	Y50 V77 E83 E86 L92	Y50-W88 HydrophobicContact CD1-CH2 4.29Å; Y50-W88 AromaticContact CD1-CZ3 3.96Å; Y50-W88 HydrophobicContact CD1-CZ3 3.96Å; Y50-W88 HydrophobicContact CE1-CH2 4.24Å; Y50-W88 AromaticContact CE1-CZ3 3.63Å; Y50-W88 HydrophobicContact CE1-CZ3 3.63Å; V77-W88 HydrophobicContact CG2-CH2 4.11Å; E83-W88 HydrophobicContact CB-CZ2 4.45Å; E86-W88 PolarHBondContact O-N 2.77Å; E86-W88 PolarHBondContact OE2-NE1 2.91Å; W88-L92 HydrophobicContact CE3-CD1 4.38Å; W88-L92 HydrophobicContact CZ3-CD1 4.23Å
89	F	88.9	Confident	85	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-80.2	-37.4	178.4	-174.5	-93.8	0	0	0	110.6	V77 H84 E86 P87 R91 L92 N93 E97 V98 V100	V77-F89 HydrophobicContact CB-CE2 4.38Å; V77-F89 HydrophobicContact CG1-CD2 3.95Å; V77-F89 HydrophobicContact CG1-CE2 4.05Å; V77-F89 HydrophobicContact CG1-CG 4.29Å; V77-F89 HydrophobicContact CG1-CZ 4.44Å; V77-F89 HydrophobicContact CG2-CD2 3.87Å; V77-F89 HydrophobicContact CG2-CE2 3.71Å; H84-F89 HydrophobicContact CB-CD1 4.03Å; H84-F89 HydrophobicContact CB-CE1 4.05Å; H84-F89 VanDerWaalsContact O-CD1 3.3Å; H84-F89 WeakPolarHBondContact O-CD1 3.36Å; E86-F89 PolarHBondContact O-N 2.96Å; P87-F89 VanDerWaalsContact C-N 3.34Å; P87-F89 PolarHBondContact O-N 2.99Å; F89-R91 VanDerWaalsContact C-N 3.25Å; F89-R91 PolarHBondContact O-N 3.1Å; F89-L92 HydrophobicContact CD2-CD1 4.4Å; F89-L92 CarbonylContact O-C 3.59Å; F89-L92 WeakPolarHBondContact O-CA 3.29Å; F89-L92 VanDerWaalsContact O-CB 3.25Å; F89-L92 WeakPolarHBondContact O-CB 3.42Å; F89-L92 PolarHBondContact O-N 3.04Å; F89-N93 HydrophobicContact CE1-CB 4.27Å; F89-N93 PolarHBondContact O-N 3.42Å; F89-E97 WeakPolarHBondContact CE1-O 3.42Å; F89-E97 WeakPolarHBondContact CZ-O 3.4Å; F89-V98 HydrophobicContact CE1-CG1 4.35Å; F89-V98 HydrophobicContact CE2-CG1 4.14Å; F89-V98 HydrophobicContact CZ-CG1 3.59Å; F89-V100 HydrophobicContact CE2-CG2 4.14Å; F89-V100 HydrophobicContact CZ-CG2 3.73Å
90	M	86.8	Confident	85.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-30.1	176.9	-73.2	-161.4	69.6	0	0	113.8	E86 P87 L92 N93 L94 E96 L222 P225 Y226	E86-M90 PolarHBondContact O-N 3.4Å; E86-M90 VanDerWaalsContact O-N 3.11Å; P87-M90 PolarHBondContact O-N 3.09Å; M90-L92 PolarHBondContact O-N 2.77Å; M90-N93 CarbonylContact O-C 3.27Å; M90-N93 VanDerWaalsContact O-C 3.27Å; M90-N93 PolarHBondContact O-N 3.04Å; M90-L94 HydrophobicContact CE-CD2 4.32Å; M90-L94 WeakPolarHBondContact O-CD2 2.93Å; M90-L94 PolarHBondContact O-N 3.08Å; M90-E96 HydrophobicContact CE-CG 3.87Å; M90-E96 HydrophobicContact CG-CG 4.24Å; M90-E96 HydrophobicContact SD-CG 4Å; M90-L222 HydrophobicContact CB-CD1 4.39Å; M90-L222 HydrophobicContact CB-CD2 4.43Å; M90-L222 HydrophobicContact CE-CD2 4.25Å; M90-P225 HydrophobicContact CE-CB 4.09Å; M90-Y226 HydrophobicContact CE-CD1 4.24Å; M90-Y226 HydrophobicContact CE-CE1 4.07Å; M90-Y226 HydrophobicContact CE-CE2 4.4Å; M90-Y226 HydrophobicContact CG-CE1 4.45Å; M90-Y226 HydrophobicContact SD-CD1 3.73Å; M90-Y226 HydrophobicContact SD-CD2 4.4Å; M90-Y226 HydrophobicContact SD-CE1 3Å; M90-Y226 WeakPolarHBondContact SD-CE1 3.41Å; M90-Y226 HydrophobicContact SD-CE2 3.74Å; M90-Y226 HydrophobicContact SD-CG 4.38Å; M90-Y226 PolarHBondContact SD-OH 3.48Å
91	R	87.1	Confident	86.9	Confident	160 Å²	160	40.5 Å²	40.5	60%	0.604	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.6	168.4	-75.9	-174	-66.9	-99.5	7.2	113.2	P87 F89	P87-R91 WeakPolarHBondContact O-CG 3.44Å; P87-R91 PolarHBondContact O-N 3.45Å; F89-R91 VanDerWaalsContact C-N 3.25Å; F89-R91 PolarHBondContact O-N 3.1Å
92	L	89.3	Confident	87.9	Confident	38 Å²	38	40.9 Å²	40.9	20%	0.199	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-41.1	172.7	-56.2	174.6	0	0	0	111.7	Y50 W88 F89 M90 V100 I102 I107	Y50-L92 HydrophobicContact CD1-CD1 4.35Å; Y50-L92 HydrophobicContact CD2-CD1 4.26Å; Y50-L92 HydrophobicContact CE1-CD1 4Å; Y50-L92 HydrophobicContact CE2-CD1 3.95Å; Y50-L92 HydrophobicContact CG-CD1 4.43Å; W88-L92 HydrophobicContact CE3-CD1 4.38Å; W88-L92 HydrophobicContact CZ3-CD1 4.23Å; F89-L92 HydrophobicContact CD2-CD1 4.4Å; F89-L92 CarbonylContact O-C 3.59Å; F89-L92 WeakPolarHBondContact O-CA 3.29Å; F89-L92 VanDerWaalsContact O-CB 3.25Å; F89-L92 WeakPolarHBondContact O-CB 3.42Å; F89-L92 PolarHBondContact O-N 3.04Å; M90-L92 PolarHBondContact O-N 2.77Å; L92-V100 HydrophobicContact CB-CG1 4.46Å; L92-I102 HydrophobicContact CD2-CD1 3.97Å; L92-I107 HydrophobicContact CD2-CD1 4.33Å
93	N	90.6	Very high	88.6	Confident	14 Å²	14	38.9 Å²	38.9	8%	0.075	19%	0.186	C	C	.	.			trans	-146.6	104.3	-179.6	-177.3	23.6	0	0	0	112.3	F89 M90 G95 E96 E97 V100 S109	F89-N93 HydrophobicContact CE1-CB 4.27Å; F89-N93 PolarHBondContact O-N 3.42Å; M90-N93 CarbonylContact O-C 3.27Å; M90-N93 VanDerWaalsContact O-C 3.27Å; M90-N93 PolarHBondContact O-N 3.04Å; N93-G95 PolarHBondContact O-N 3.43Å; N93-G95 VanDerWaalsContact O-N 3.1Å; N93-G95 WeakPolarHBondContact OD1-CA 3.27Å; N93-G95 PolarHBondContact OD1-N 3.24Å; N93-E96 PolarHBondContact O-N 3.13Å; N93-E96 VanDerWaalsContact O-N 3.12Å; N93-E97 PolarHBondContact ND2-N 3.24Å; N93-E97 PolarHBondContact ND2-O 2.74Å; N93-V100 HydrophobicContact CB-CG2 3.62Å; N93-S109 WeakPolarHBondContact OD1-CB 3.23Å; N93-S109 PolarHBondContact OD1-OG 2.78Å
94	L	86.5	Confident	88.9	Confident	103 Å²	103	41 Å²	41	54%	0.539	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.1	172.6	-64.7	176.5	0	0	0	113.2	M90 E96 L222	M90-L94 HydrophobicContact CE-CD2 4.32Å; M90-L94 WeakPolarHBondContact O-CD2 2.93Å; M90-L94 PolarHBondContact O-N 3.08Å; L94-E96 PolarHBondContact O-N 3.42Å; L94-L222 HydrophobicContact CD2-CD2 3.64Å
95	G	84.2	Confident	89.2	Confident	23 Å²	23	47.7 Å²	47.7	24%	0.237	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.5	174	0	0	0	0	0	114.5	N93 E97 K229	N93-G95 PolarHBondContact O-N 3.43Å; N93-G95 VanDerWaalsContact O-N 3.1Å; N93-G95 WeakPolarHBondContact OD1-CA 3.27Å; N93-G95 PolarHBondContact OD1-N 3.24Å; G95-E97 WeakPolarHBondContact O-CG 3.48Å; G95-E97 PolarHBondContact O-N 2.89Å; G95-K229 WeakPolarHBondContact O-CE 3.17Å; G95-K229 PolarHBondContact O-NZ 3.37Å
96	E	86.1	Confident	89.6	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.065	24%	0.238	C	C	.	.			trans	56.1	27.3	-176.1	-63.4	174.2	-133.4	0	0	113	H84 M90 N93 L94 Y226 K229	H84-E96 PolarHBondContact CD2-O 3.06Å; H84-E96 VanDerWaalsContact CD2-O 3.23Å; M90-E96 HydrophobicContact CE-CG 3.87Å; M90-E96 HydrophobicContact CG-CG 4.24Å; M90-E96 HydrophobicContact SD-CG 4Å; N93-E96 PolarHBondContact O-N 3.13Å; N93-E96 VanDerWaalsContact O-N 3.12Å; L94-E96 PolarHBondContact O-N 3.42Å; E96-Y226 WeakPolarHBondContact OE1-CA 3.16Å; E96-Y226 WeakPolarHBondContact OE1-CD1 3.36Å; E96-K229 HydrophobicContact CB-CG 4.49Å
97	E	88.4	Confident	90.1	Very high	109 Å²	109	50.1 Å²	50.1	51%	0.509	25%	0.246	S	C	.	.			trans	-121.1	150.4	-171.9	-80.3	170.6	178.2	0	0	111.9	F89 N93 G95 K229	F89-E97 WeakPolarHBondContact CE1-O 3.42Å; F89-E97 WeakPolarHBondContact CZ-O 3.4Å; N93-E97 PolarHBondContact ND2-N 3.24Å; N93-E97 PolarHBondContact ND2-O 2.74Å; G95-E97 WeakPolarHBondContact O-CG 3.48Å; G95-E97 PolarHBondContact O-N 2.89Å; E97-K229 IonicContact OE1-NZ 2.88Å; E97-K229 PolarHBondContact OE1-NZ 3.33Å; E97-K229 IonicContact OE2-NZ 2.55Å
98	V	92.9	Very high	90.6	Very high	11 Å²	11	49.2 Å²	49.2	7%	0.067	24%	0.238	C	C	.	.	S	Bend	trans	-113.4	147.2	171.3	-66.8	0	0	0	0	108.8	W52 S55 V77 L79 F89	W52-V98 HydrophobicContact CB-CG2 3.95Å; S55-V98 PolarHBondContact OG-O 2.85Å; V77-V98 HydrophobicContact CB-CG1 3.9Å; V77-V98 HydrophobicContact CG1-CG1 4.09Å; V77-V98 HydrophobicContact CG2-CG1 4.35Å; L79-V98 HydrophobicContact CD1-CG1 4.25Å; L79-V98 HydrophobicContact CD1-CG2 3.73Å; L79-V98 HydrophobicContact CD2-CG2 4.47Å; F89-V98 HydrophobicContact CE1-CG1 4.35Å; F89-V98 HydrophobicContact CE2-CG1 4.14Å; F89-V98 HydrophobicContact CZ-CG1 3.59Å
99	P	97.1	Very high	90.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.013	24%	0.237	C	C	.	.			cis	-88.5	163.2	8.7	32.8	-31.3	0	0	0	114.8	L49 Y50 H51 V61 S109 I114	L49-P99 HydrophobicContact CD1-CB 3.7Å; Y50-P99 CarbonylContact O-C 3.53Å; Y50-P99 WeakPolarHBondContact O-CA 3.43Å; Y50-P99 WeakPolarHBondContact O-CB 3.45Å; H51-P99 HydrophobicContact CB-CB 4.33Å; V61-P99 HydrophobicContact CB-CG 4.05Å; V61-P99 HydrophobicContact CG2-CG 3.66Å; P99-S109 VanDerWaalsContact O-O 3.11Å; P99-I114 HydrophobicContact CB-CD1 4.35Å; P99-I114 HydrophobicContact CG-CD1 3.97Å
100	V	97.2	Very high	91	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.3	165.5	-178.9	0	0	0	0	108.2	Y50 F89 L92 N93 I107 I108	Y50-V100 PolarHBondContact N-O 3.38Å; Y50-V100 PolarHBondContact O-N 3.22Å; F89-V100 HydrophobicContact CE2-CG2 4.14Å; F89-V100 HydrophobicContact CZ-CG2 3.73Å; L92-V100 HydrophobicContact CB-CG1 4.46Å; N93-V100 HydrophobicContact CB-CG2 3.62Å; V100-I107 HydrophobicContact CG1-CG2 3.73Å; V100-I108 CarbonylContact C-O 3.55Å; V100-I108 WeakPolarHBondContact CA-O 3.37Å
101	I	96.2	Very high	91.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.5	174.7	-147.9	167	0	0	0	110.1	L47 V48 L49 I65 I107 I108 I114 V118	L47-I101 HydrophobicContact CD1-CD1 3.48Å; L47-I101 VanDerWaalsContact CD1-CD1 3.48Å; L47-I101 HydrophobicContact CD1-CG1 3.71Å; L47-I101 HydrophobicContact CD2-CD1 4.33Å; L47-I101 HydrophobicContact CG-CD1 4.03Å; L47-I101 HydrophobicContact CG-CG1 4.32Å; V48-I101 CarbonylContact O-C 3.58Å; V48-I101 WeakPolarHBondContact O-CA 3.32Å; V48-I101 WeakPolarHBondContact O-CG1 3.25Å; L49-I101 HydrophobicContact CD1-CB 4.45Å; L49-I101 HydrophobicContact CD1-CG1 4.37Å; I65-I101 HydrophobicContact CD1-CD1 4.21Å; I101-I107 WeakPolarHBondContact O-CA 3.11Å; I101-I108 HydrophobicContact CG2-CB 3.93Å; I101-I108 HydrophobicContact CG2-CD1 4.23Å; I101-I108 HydrophobicContact CG2-CG1 4.24Å; I101-I108 PolarHBondContact N-O 3.46Å; I101-I108 PolarHBondContact O-N 3.29Å; I101-I114 HydrophobicContact CB-CD1 4.23Å; I101-I114 HydrophobicContact CB-CG1 4.1Å; I101-I114 HydrophobicContact CB-CG2 4.05Å; I101-I114 HydrophobicContact CD1-CG2 3.8Å; I101-I114 HydrophobicContact CG2-CB 4.42Å; I101-I114 HydrophobicContact CG2-CD1 4.4Å; I101-I114 HydrophobicContact CG2-CG1 3.77Å; I101-I114 HydrophobicContact CG2-CG2 4.04Å; I101-V118 HydrophobicContact CD1-CG2 3.94Å
102	I	94.8	Very high	91.7	Very high	35 Å²	35	46.7 Å²	46.7	18%	0.179	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125	170.9	-52.9	-172.7	0	0	0	107.9	V48 Y50 L92 N106 I107	V48-I102 HydrophobicContact CB-CB 4.39Å; V48-I102 PolarHBondContact N-O 3.48Å; V48-I102 PolarHBondContact O-N 3.03Å; Y50-I102 HydrophobicContact CD2-CD1 4.32Å; Y50-I102 HydrophobicContact CD2-CG1 4.44Å; Y50-I102 HydrophobicContact CE2-CD1 3.63Å; Y50-I102 HydrophobicContact CE2-CG1 4.15Å; L92-I102 HydrophobicContact CD2-CD1 3.97Å; I102-N106 WeakPolarHBondContact CA-O 3.28Å; I102-I107 HydrophobicContact CD1-CG1 4.45Å; I102-I107 HydrophobicContact CG1-CG1 4.27Å; I102-I107 HydrophobicContact CG1-CG2 4.5Å; I102-I107 HydrophobicContact CG2-CG1 4.49Å
103	H	92.6	Very high	92	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.019	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	115	172.4	-179.2	-137.9	0	0	0	109.3	L47 D105 N106 Y117 F122	L47-H103 HydrophobicContact CD1-CB 3.72Å; H103-D105 PolarHBondContact O-N 3.25Å; H103-N106 PolarHBondContact N-O 3.5Å; H103-N106 WeakPolarHBondContact O-CB 3.35Å; H103-N106 PolarHBondContact O-N 2.95Å; H103-N106 VanDerWaalsContact O-N 3.08Å; H103-N106 PolarHBondContact O-ND2 3.03Å; H103-N106 VanDerWaalsContact O-ND2 3.1Å; H103-Y117 HydrophobicContact CB-CE1 4.02Å; H103-Y117 AromaticContact ND1-CE1 3.69Å; H103-Y117 AromaticContact ND1-CZ 3.62Å; H103-Y117 PolarHBondContact ND1-OH 3.27Å; H103-F122 AromaticContact CE1-CZ 3.72Å; H103-F122 AromaticContact ND1-CZ 3.99Å
104	R	88.1	Confident	92.3	Very high	82 Å²	82	49.6 Å²	49.6	31%	0.309	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-126.8	-169.6	-59.2	157.8	-176.7	-132.6	-5.2	109.7	R44 E45 N106 L139	R44-R104 WeakPolarHBondContact O-CG 3.28Å; E45-R104 IonicContact OE1-NH2 3.58Å; E45-R104 PolarHBondContact OE1-NH2 3.1Å; R104-N106 VanDerWaalsContact C-N 3.31Å; R104-L139 VanDerWaalsContact CZ-CD2 3.47Å
105	D	88.3	Confident	92.7	Very high	163 Å²	163	44.7 Å²	44.7	87%	0.872	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	3.3	178.8	-50.3	-52	0	0	0	112.8	H103	H103-D105 PolarHBondContact O-N 3.25Å
106	N	90.7	Very high	93.2	Very high	72 Å²	72	46.3 Å²	46.3	39%	0.385	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.1	-179.5	-52.5	-74.2	0	0	0	110.5	I102 H103 R104 I108 Y117	I102-N106 WeakPolarHBondContact CA-O 3.28Å; H103-N106 PolarHBondContact N-O 3.5Å; H103-N106 WeakPolarHBondContact O-CB 3.35Å; H103-N106 PolarHBondContact O-N 2.95Å; H103-N106 VanDerWaalsContact O-N 3.08Å; H103-N106 PolarHBondContact O-ND2 3.03Å; H103-N106 VanDerWaalsContact O-ND2 3.1Å; R104-N106 VanDerWaalsContact C-N 3.31Å; N106-I108 HydrophobicContact CB-CG1 4.49Å; N106-Y117 PolarHBondContact ND2-OH 3.07Å
107	I	94.3	Very high	93.6	Very high	91 Å²	91	47 Å²	47	47%	0.467	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.1	167.8	-55.7	177	0	0	0	106.8	L92 V100 I101 I102	L92-I107 HydrophobicContact CD2-CD1 4.33Å; V100-I107 HydrophobicContact CG1-CG2 3.73Å; I101-I107 WeakPolarHBondContact O-CA 3.11Å; I102-I107 HydrophobicContact CD1-CG1 4.45Å; I102-I107 HydrophobicContact CG1-CG1 4.27Å; I102-I107 HydrophobicContact CG1-CG2 4.5Å; I102-I107 HydrophobicContact CG2-CG1 4.49Å
108	I	95.9	Very high	93.8	Very high	24 Å²	24	41.8 Å²	41.8	12%	0.123	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125	-177.9	-44.2	172.4	0	0	0	107.8	V100 I101 N106 Q113 I114 Y117	V100-I108 CarbonylContact C-O 3.55Å; V100-I108 WeakPolarHBondContact CA-O 3.37Å; I101-I108 HydrophobicContact CG2-CB 3.93Å; I101-I108 HydrophobicContact CG2-CD1 4.23Å; I101-I108 HydrophobicContact CG2-CG1 4.24Å; I101-I108 PolarHBondContact N-O 3.46Å; I101-I108 PolarHBondContact O-N 3.29Å; N106-I108 HydrophobicContact CB-CG1 4.49Å; I108-Q113 HydrophobicContact CG2-CB 3.69Å; I108-I114 HydrophobicContact CB-CG1 3.95Å; I108-I114 HydrophobicContact CG2-CG1 3.81Å; I108-I114 WeakPolarHBondContact O-CD1 3.39Å; I108-Y117 HydrophobicContact CD1-CD1 3.82Å; I108-Y117 HydrophobicContact CD1-CD2 3.52Å; I108-Y117 HydrophobicContact CD1-CE1 4.4Å; I108-Y117 HydrophobicContact CD1-CE2 4.12Å; I108-Y117 HydrophobicContact CD1-CG 3.33Å
109	S	92.9	Very high	93.7	Very high	45 Å²	45	42 Å²	42	32%	0.315	21%	0.211	S	C	.	.			trans	-112.9	-12.4	-174.6	54.7	0	0	0	0	114.7	N93 P99	N93-S109 WeakPolarHBondContact OD1-CB 3.23Å; N93-S109 PolarHBondContact OD1-OG 2.78Å; P99-S109 VanDerWaalsContact O-O 3.11Å
110	D	92.3	Very high	93.4	Very high	67 Å²	67	50.5 Å²	50.5	36%	0.358	24%	0.243	S	C	.	.			trans	-86.8	123.7	174.5	179.7	-74.6	0	0	0	109.7	D112 Q113 I114	D110-D112 VanDerWaalsContact C-N 3.29Å; D110-D112 PolarHBondContact O-N 2.94Å; D110-D112 WeakPolarHBondContact OD1-CA 3.45Å; D110-D112 WeakPolarHBondContact OD1-CB 3.33Å; D110-D112 PolarHBondContact OD1-N 2.88Å; D110-Q113 HydrophobicContact CB-CB 4.03Å; D110-Q113 HydrophobicContact CB-CG 3.97Å; D110-Q113 PolarHBondContact O-N 2.96Å; D110-Q113 PolarHBondContact OD1-N 3.28Å; D110-I114 VanDerWaalsContact O-CG1 3.23Å; D110-I114 WeakPolarHBondContact O-CG1 3.13Å; D110-I114 PolarHBondContact O-N 2.95Å
111	Y	93.5	Very high	93	Very high	48 Å²	48	52.8 Å²	52.8	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-33.4	-172.9	78.7	-94.8	0	0	0	113	K60 I114 I115 D169	K60-Y111 HydrophobicContact CD-CD2 4.13Å; K60-Y111 HydrophobicContact CD-CE2 3.93Å; Y111-I114 PolarHBondContact O-N 2.73Å; Y111-I115 HydrophobicContact CD2-CD1 4.31Å; Y111-I115 WeakPolarHBondContact O-CG1 3.32Å; Y111-I115 PolarHBondContact O-N 2.78Å; Y111-D169 PolarHBondContact OH-OD1 3.31Å
112	D	93.6	Very high	92.5	Very high	34 Å²	34	53.7 Å²	53.7	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-70.6	-42.1	178.6	-88.6	-45.5	0	0	0	110.4	D110 I114 I115 D116 R165	D110-D112 VanDerWaalsContact C-N 3.29Å; D110-D112 PolarHBondContact O-N 2.94Å; D110-D112 WeakPolarHBondContact OD1-CA 3.45Å; D110-D112 WeakPolarHBondContact OD1-CB 3.33Å; D110-D112 PolarHBondContact OD1-N 2.88Å; D112-I114 VanDerWaalsContact C-N 3.31Å; D112-I114 PolarHBondContact O-N 2.79Å; D112-I115 PolarHBondContact O-N 3.49Å; D112-D116 PolarHBondContact O-N 2.88Å; D112-R165 PolarHBondContact O-NH2 2.75Å; D112-R165 IonicContact OD1-CZ 3.3Å; D112-R165 IonicContact OD1-NE 2.82Å; D112-R165 IonicContact OD1-NH2 3.31Å; D112-R165 PolarHBondContact OD1-NH2 3.46Å
113	Q	96.1	Very high	91.7	Very high	113 Å²	113	56 Å²	56	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-34.3	173.1	-64.8	-177.9	50.6	0	0	112.4	I108 D110 D116 Y117	I108-Q113 HydrophobicContact CG2-CB 3.69Å; D110-Q113 HydrophobicContact CB-CB 4.03Å; D110-Q113 HydrophobicContact CB-CG 3.97Å; D110-Q113 PolarHBondContact O-N 2.96Å; D110-Q113 PolarHBondContact OD1-N 3.28Å; Q113-D116 PolarHBondContact O-N 2.91Å; Q113-Y117 WeakPolarHBondContact O-CB 3.06Å; Q113-Y117 PolarHBondContact O-N 3Å
114	I	96.6	Very high	90	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-47.6	173.5	-69.6	165.5	0	0	0	110	V61 P99 I101 I108 D110 Y111 D112 D116 Y117 V118	V61-I114 HydrophobicContact CB-CG2 4.46Å; V61-I114 HydrophobicContact CG1-CG2 3.62Å; V61-I114 HydrophobicContact CG2-CB 4.26Å; V61-I114 HydrophobicContact CG2-CG2 3.93Å; P99-I114 HydrophobicContact CB-CD1 4.35Å; P99-I114 HydrophobicContact CG-CD1 3.97Å; I101-I114 HydrophobicContact CB-CD1 4.23Å; I101-I114 HydrophobicContact CB-CG1 4.1Å; I101-I114 HydrophobicContact CB-CG2 4.05Å; I101-I114 HydrophobicContact CD1-CG2 3.8Å; I101-I114 HydrophobicContact CG2-CB 4.42Å; I101-I114 HydrophobicContact CG2-CD1 4.4Å; I101-I114 HydrophobicContact CG2-CG1 3.77Å; I101-I114 HydrophobicContact CG2-CG2 4.04Å; I108-I114 HydrophobicContact CB-CG1 3.95Å; I108-I114 HydrophobicContact CG2-CG1 3.81Å; I108-I114 WeakPolarHBondContact O-CD1 3.39Å; D110-I114 VanDerWaalsContact O-CG1 3.23Å; D110-I114 WeakPolarHBondContact O-CG1 3.13Å; D110-I114 PolarHBondContact O-N 2.95Å; Y111-I114 PolarHBondContact O-N 2.73Å; D112-I114 VanDerWaalsContact C-N 3.31Å; D112-I114 PolarHBondContact O-N 2.79Å; I114-D116 PolarHBondContact O-N 3.16Å; I114-Y117 PolarHBondContact O-N 3.26Å; I114-V118 HydrophobicContact CG2-CG2 4.37Å; I114-V118 WeakPolarHBondContact O-CB 3.37Å; I114-V118 VanDerWaalsContact O-CG2 3.29Å; I114-V118 WeakPolarHBondContact O-CG2 3.48Å; I114-V118 PolarHBondContact O-N 3.3Å
115	I	95.8	Very high	87.8	Confident	1 Å²	1	57 Å²	57	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-46.8	178	-69.1	171.8	0	0	0	110.3	K60 V61 V64 Y111 D112 Y117 V118 E119 L287 L291	K60-I115 HydrophobicContact CB-CD1 4.33Å; V61-I115 HydrophobicContact CG2-CG1 4.15Å; V64-I115 HydrophobicContact CG2-CD1 4.24Å; V64-I115 HydrophobicContact CG2-CG1 4.11Å; V64-I115 HydrophobicContact CG2-CG2 4.35Å; Y111-I115 HydrophobicContact CD2-CD1 4.31Å; Y111-I115 WeakPolarHBondContact O-CG1 3.32Å; Y111-I115 PolarHBondContact O-N 2.78Å; D112-I115 PolarHBondContact O-N 3.49Å; I115-Y117 VanDerWaalsContact C-N 3.31Å; I115-Y117 PolarHBondContact O-N 2.92Å; I115-V118 PolarHBondContact O-N 2.97Å; I115-E119 PolarHBondContact O-N 2.99Å; I115-L287 HydrophobicContact CG2-CD1 3.76Å; I115-L287 HydrophobicContact CG2-CD2 3.72Å; I115-L287 HydrophobicContact CG2-CG 4.42Å; I115-L291 HydrophobicContact CD1-CD2 4.33Å
116	D	94.4	Very high	85.3	Confident	57 Å²	57	52.7 Å²	52.7	31%	0.305	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-37.1	178.2	-72.5	-18.2	0	0	0	112.7	D112 Q113 I114 R120 R165	D112-D116 PolarHBondContact O-N 2.88Å; Q113-D116 PolarHBondContact O-N 2.91Å; I114-D116 PolarHBondContact O-N 3.16Å; D116-R120 VanDerWaalsContact O-CB 3.32Å; D116-R120 WeakPolarHBondContact O-CB 3.4Å; D116-R120 VanDerWaalsContact O-CG 3.25Å; D116-R120 WeakPolarHBondContact O-CG 3.05Å; D116-R120 PolarHBondContact O-N 3.13Å; D116-R120 PolarHBondContact O-NE 3.21Å; D116-R165 IonicContact OD1-CZ 2.72Å; D116-R165 IonicContact OD1-NH1 2.71Å; D116-R165 PolarHBondContact OD1-NH1 2.78Å; D116-R165 IonicContact OD1-NH2 3.67Å; D116-R165 PolarHBondContact OD1-NH2 3.36Å; D116-R165 IonicContact OD2-NH1 2.91Å; D116-R165 IonicContact OD2-NH2 3.19Å
117	Y	94.7	Very high	82.7	Confident	27 Å²	27	60.8 Å²	60.8	11%	0.106	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-46.7	175	176.5	-98.1	0	0	0	111	H103 N106 I108 Q113 I114 I115 R120 T121	H103-Y117 HydrophobicContact CB-CE1 4.02Å; H103-Y117 AromaticContact ND1-CE1 3.69Å; H103-Y117 AromaticContact ND1-CZ 3.62Å; H103-Y117 PolarHBondContact ND1-OH 3.27Å; N106-Y117 PolarHBondContact ND2-OH 3.07Å; I108-Y117 HydrophobicContact CD1-CD1 3.82Å; I108-Y117 HydrophobicContact CD1-CD2 3.52Å; I108-Y117 HydrophobicContact CD1-CE1 4.4Å; I108-Y117 HydrophobicContact CD1-CE2 4.12Å; I108-Y117 HydrophobicContact CD1-CG 3.33Å; Q113-Y117 WeakPolarHBondContact O-CB 3.06Å; Q113-Y117 PolarHBondContact O-N 3Å; I114-Y117 PolarHBondContact O-N 3.26Å; I115-Y117 VanDerWaalsContact C-N 3.31Å; I115-Y117 PolarHBondContact O-N 2.92Å; Y117-R120 PolarHBondContact O-N 3.39Å; Y117-T121 WeakPolarHBondContact CE2-OG1 3.35Å; Y117-T121 WeakPolarHBondContact O-CB 3.38Å; Y117-T121 PolarHBondContact O-N 2.94Å; Y117-T121 PolarHBondContact O-OG1 3.46Å
118	V	92.6	Very high	79.8	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-42.9	179.6	166.9	0	0	0	0	111.1	V64 K68 L70 I101 I114 I115 F122	V64-V118 HydrophobicContact CG1-CG1 3.96Å; K68-V118 HydrophobicContact CD-CG1 3.45Å; K68-V118 VanDerWaalsContact CD-CG1 3.45Å; L70-V118 HydrophobicContact CD1-CG1 3.65Å; I101-V118 HydrophobicContact CD1-CG2 3.94Å; I114-V118 HydrophobicContact CG2-CG2 4.37Å; I114-V118 WeakPolarHBondContact O-CB 3.37Å; I114-V118 VanDerWaalsContact O-CG2 3.29Å; I114-V118 WeakPolarHBondContact O-CG2 3.48Å; I114-V118 PolarHBondContact O-N 3.3Å; I115-V118 PolarHBondContact O-N 2.97Å; V118-F122 HydrophobicContact CG1-CD2 4.31Å; V118-F122 WeakPolarHBondContact O-CD2 3.39Å; V118-F122 PolarHBondContact O-N 2.95Å; V118-F122 VanDerWaalsContact O-N 3.09Å
119	E	90.3	Very high	76.8	Confident	15 Å²	15	69.4 Å²	69.4	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-64.6	-42.8	176.7	-78.3	-63.4	106.4	0	0	112.3	K68 I115 T123 L149 M150	K68-E119 WeakPolarHBondContact CD-OE1 3.44Å; K68-E119 WeakPolarHBondContact CE-OE1 3.37Å; K68-E119 IonicContact NZ-OE1 3.97Å; K68-E119 PolarHBondContact NZ-OE1 3.02Å; K68-E119 IonicContact NZ-OE2 3.17Å; I115-E119 PolarHBondContact O-N 2.99Å; E119-T123 VanDerWaalsContact O-CG2 3.25Å; E119-T123 WeakPolarHBondContact O-CG2 3.34Å; E119-L149 PolarHBondContact OE2-N 3.41Å; E119-M150 HydrophobicContact CB-CG 4.33Å; E119-M150 HydrophobicContact CG-CG 3.86Å; E119-M150 WeakPolarHBondContact OE2-CB 3.23Å; E119-M150 WeakPolarHBondContact OE2-CG 3.34Å; E119-M150 PolarHBondContact OE2-N 3.42Å
120	R	90	Very high	73.9	Confident	180 Å²	180	71.6 Å²	71.6	68%	0.679	39%	0.394	S	S	*	.	H	α-helix	trans	-73.6	-34.7	179.7	-73	-178.9	-66.5	153.4	-4.1	113.7	D116 Y117	D116-R120 VanDerWaalsContact O-CB 3.32Å; D116-R120 WeakPolarHBondContact O-CB 3.4Å; D116-R120 VanDerWaalsContact O-CG 3.25Å; D116-R120 WeakPolarHBondContact O-CG 3.05Å; D116-R120 PolarHBondContact O-N 3.13Å; D116-R120 PolarHBondContact O-NE 3.21Å; Y117-R120 PolarHBondContact O-N 3.39Å
121	T	89.2	Confident	71	Confident	49 Å²	49	73.9 Å²	73.9	30%	0.301	41%	0.411	S	S	.	.	H	α-helix	trans	-83	-33.8	-173.7	-54.7	0	0	0	0	111.8	Y117	Y117-T121 WeakPolarHBondContact CE2-OG1 3.35Å; Y117-T121 WeakPolarHBondContact O-CB 3.38Å; Y117-T121 PolarHBondContact O-N 2.94Å; Y117-T121 PolarHBondContact O-OG1 3.46Å
122	F	86.4	Confident	68.5	Low	19 Å²	19	77.2 Å²	77.2	8%	0.083	44%	0.441	C	S	.	.			trans	-118.7	77.5	-174.1	-54.3	-82	0	0	0	111.2	L47 K68 L70 H103 V118 V146	L47-F122 HydrophobicContact CD1-CE2 4.44Å; L47-F122 HydrophobicContact CD1-CZ 4.49Å; L47-F122 HydrophobicContact CD2-CE2 4.33Å; L47-F122 HydrophobicContact CD2-CZ 4.43Å; K68-F122 WeakPolarHBondContact CE-O 3.46Å; K68-F122 PolarHBondContact NZ-O 2.85Å; L70-F122 HydrophobicContact CD1-CB 4.22Å; L70-F122 HydrophobicContact CD1-CD2 3.74Å; L70-F122 HydrophobicContact CD1-CE2 4.23Å; L70-F122 HydrophobicContact CD1-CG 3.95Å; L70-F122 HydrophobicContact CD2-CB 3.88Å; L70-F122 HydrophobicContact CD2-CD1 3.94Å; L70-F122 HydrophobicContact CD2-CD2 4.47Å; L70-F122 HydrophobicContact CD2-CG 3.86Å; H103-F122 AromaticContact CE1-CZ 3.72Å; H103-F122 AromaticContact ND1-CZ 3.99Å; V118-F122 HydrophobicContact CG1-CD2 4.31Å; V118-F122 WeakPolarHBondContact O-CD2 3.39Å; V118-F122 PolarHBondContact O-N 2.95Å; V118-F122 VanDerWaalsContact O-N 3.09Å; F122-V146 HydrophobicContact CB-CG1 4.2Å; F122-V146 WeakPolarHBondContact O-CG1 3.48Å
123	T	76.8	Confident	65.8	Low	85 Å²	85	79.4 Å²	79.4	52%	0.521	47%	0.472	S	S	.	.			trans	-102.2	126	174.6	57.4	0	0	0	0	111.1	E119 G125	E119-T123 VanDerWaalsContact O-CG2 3.25Å; E119-T123 WeakPolarHBondContact O-CG2 3.34Å; T123-G125 PolarHBondContact O-N 2.94Å
124	G	56.9	Low	62.7	Low	34 Å²	34	79.2 Å²	79.2	35%	0.351	48%	0.482	S	S	.	.			trans	-77.6	105.3	174.5	0	0	0	0	0	111.9	V146	G124-V146 WeakPolarHBondContact CA-O 3.33Å; G124-V146 PolarHBondContact N-O 3.2Å; G124-V146 VanDerWaalsContact N-O 3.1Å
125	G	41.6	Very low	59.6	Low	71 Å²	71	85.7 Å²	85.7	73%	0.732	52%	0.524	S	S	*	.	S	Bend	trans	110.7	100.9	163.9	0	0	0	0	0	116.1	T123	T123-G125 PolarHBondContact O-N 2.94Å
126	G	37.3	Very low	56.8	Low	73 Å²	73	88.4 Å²	88.4	75%	0.753	55%	0.547	S	S	*	.			trans	105.3	104.8	136.4	0	0	0	0	0	119
127	R	34.6	Very low	54.1	Low	243 Å²	243	93.9 Å²	93.9	92%	0.917	57%	0.57	S	S	*	*			trans	58.8	109.4	151.6	-59.4	-176.6	-168.3	-161.7	2.7	116.4	R129	R127-R129 PolarHBondContact O-N 3.38Å
128	G	35.5	Very low	51.5	Low	72 Å²	72	98 Å²	98	74%	0.742	60%	0.6	S	S	*	*			trans	-50.6	103.2	155.3	0	0	0	0	0	110.2	C130	G128-C130 VanDerWaalsContact C-N 3.28Å; G128-C130 PolarHBondContact O-N 2.89Å
129	R	32.1	Very low	49.3	Very low	224 Å²	224	102.9 Å²	102.9	85%	0.845	63%	0.626	S	S	*	*			trans	-83.5	84.4	164.9	-168.9	-179.6	-65.6	-131.1	3.1	106.6	R127 T131	R127-R129 PolarHBondContact O-N 3.38Å; R129-T131 HydrophobicContact CG-CG2 4.34Å; R129-T131 PolarHBondContact O-N 3.3Å; R129-T131 VanDerWaalsContact O-N 3.09Å
130	C	32.1	Very low	47	Very low	90 Å²	90	106.3 Å²	106.3	61%	0.608	66%	0.657	S	S	*	*			trans	-67.7	98.6	162.1	-70.1	0	0	0	0	107.8	G128 S132	G128-C130 VanDerWaalsContact C-N 3.28Å; G128-C130 PolarHBondContact O-N 2.89Å; C130-S132 PolarHBondContact O-N 2.82Å
131	T	31.3	Very low	45	Very low	115 Å²	115	100 Å²	100	71%	0.706	64%	0.639	S	S	*	*			trans	-77.9	96.9	156.4	49.3	0	0	0	0	107.2	R129	R129-T131 HydrophobicContact CG-CG2 4.34Å; R129-T131 PolarHBondContact O-N 3.3Å; R129-T131 VanDerWaalsContact O-N 3.09Å
132	S	41	Very low	42.6	Very low	118 Å²	118	103.6 Å²	103.6	83%	0.825	66%	0.663	S	S	*	*	S	Bend	trans	32.3	106.7	158.6	58.8	0	0	0	0	117.8	C130	C130-S132 PolarHBondContact O-N 2.82Å
133	G	36.5	Very low	40.8	Very low	81 Å²	81	105 Å²	105	84%	0.835	67%	0.673	S	S	*	*	S	Bend	trans	132.7	-8.4	146.2	0	0	0	0	0	118.9
134	C	30.5	Very low	39.4	Very low	108 Å²	108	109.4 Å²	109.4	73%	0.73	69%	0.688	S	S	*	*	S	Bend	trans	-115.7	145.9	178.1	-64.7	0	0	0	0	111.1	A136	C134-A136 PolarHBondContact O-N 3.5Å
135	P	32.5	Very low	39.4	Very low	136 Å²	136	115.9 Å²	115.9	88%	0.883	71%	0.708	S	S	*	*			trans	-73	74.5	170.1	32.1	-31.5	0	0	0	108.7	Q137	P135-Q137 PolarHBondContact O-N 2.98Å
136	A	36.2	Very low	40.7	Very low	59 Å²	59	113.1 Å²	113.1	49%	0.488	68%	0.677	S	S	.	*			trans	-81.7	105.8	172.1	0	0	0	0	0	108.1	C134 P138	C134-A136 PolarHBondContact O-N 3.5Å; A136-P138 WeakPolarHBondContact O-CD 3.5Å
137	Q	37.1	Very low	42.8	Very low	171 Å²	171	113.2 Å²	113.2	80%	0.799	66%	0.663	S	S	*	*			trans	-63	123.6	163.5	-71	178.3	11.2	0	0	107.9	P135 L139	P135-Q137 PolarHBondContact O-N 2.98Å; Q137-L139 PolarHBondContact O-N 3.28Å; Q137-L139 VanDerWaalsContact O-N 3.13Å
138	P	40.4	Very low	45.3	Very low	113 Å²	113	104.4 Å²	104.4	73%	0.734	64%	0.642	S	S	*	*			trans	-70.7	109.4	175.9	-6.9	22	0	0	0	108.7	A136 A140	A136-P138 WeakPolarHBondContact O-CD 3.5Å; P138-A140 VanDerWaalsContact C-N 3.32Å; P138-A140 PolarHBondContact O-N 2.86Å
139	L	46.2	Very low	48	Very low	104 Å²	104	101 Å²	101	55%	0.545	61%	0.607	S	S	.	*			trans	-76	87.7	165.9	-95.2	81.8	0	0	0	108.4	R104 Q137	R104-L139 VanDerWaalsContact CZ-CD2 3.47Å; Q137-L139 PolarHBondContact O-N 3.28Å; Q137-L139 VanDerWaalsContact O-N 3.13Å
140	A	43.1	Very low	51	Low	88 Å²	88	92.1 Å²	92.1	73%	0.727	58%	0.576	S	S	*	*			trans	-101.2	90.1	164.7	0	0	0	0	0	108	P138	P138-A140 VanDerWaalsContact C-N 3.32Å; P138-A140 PolarHBondContact O-N 2.86Å
141	V	46.8	Very low	53.8	Low	48 Å²	48	89.3 Å²	89.3	29%	0.291	56%	0.557	S	S	.	*			trans	-64.9	135.3	152.7	-177.3	0	0	0	0	105.6	T143	V141-T143 HydrophobicContact CB-CG2 4.47Å; V141-T143 HydrophobicContact CG1-CG2 4Å; V141-T143 PolarHBondContact O-N 2.96Å; V141-T143 PolarHBondContact O-OG1 2.95Å
142	P	40.1	Very low	56.6	Low	124 Å²	124	91.6 Å²	91.6	81%	0.805	56%	0.559	S	S	*	*			trans	-71.2	81.8	175	28.5	-32	0	0	0	109
143	T	48.4	Very low	58.9	Low	48 Å²	48	91.9 Å²	91.9	29%	0.294	56%	0.555	S	S	.	*			trans	-105.8	76.7	177.2	31.7	0	0	0	0	109.5	V141 H145 V146	V141-T143 HydrophobicContact CB-CG2 4.47Å; V141-T143 HydrophobicContact CG1-CG2 4Å; V141-T143 PolarHBondContact O-N 2.96Å; V141-T143 PolarHBondContact O-OG1 2.95Å; T143-H145 PolarHBondContact O-N 3.2Å; T143-V146 HydrophobicContact CG2-CG2 3.46Å; T143-V146 VanDerWaalsContact CG2-CG2 3.46Å
144	E	46.1	Very low	61.5	Low	178 Å²	178	91.5 Å²	91.5	83%	0.832	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	112.2	160.1	-80.1	-173.2	157.7	0	0	108
145	H	57.3	Low	64.5	Low	169 Å²	169	87.6 Å²	87.6	78%	0.782	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	44.5	170.2	-47.5	90.6	0	0	0	118.4	T143 V147	T143-H145 PolarHBondContact O-N 3.2Å; H145-V147 PolarHBondContact O-N 2.83Å
146	V	69.9	Low	67.3	Low	14 Å²	14	85.6 Å²	85.6	9%	0.085	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-75.6	122.4	163.6	172.8	0	0	0	0	110.8	K68 L70 F122 G124 T143 A148	K68-V146 HydrophobicContact CB-CG1 4.2Å; L70-V146 HydrophobicContact CD2-CG1 4.36Å; L70-V146 HydrophobicContact CD2-CG2 4.15Å; F122-V146 HydrophobicContact CB-CG1 4.2Å; F122-V146 WeakPolarHBondContact O-CG1 3.48Å; G124-V146 WeakPolarHBondContact CA-O 3.33Å; G124-V146 PolarHBondContact N-O 3.2Å; G124-V146 VanDerWaalsContact N-O 3.1Å; T143-V146 HydrophobicContact CG2-CG2 3.46Å; T143-V146 VanDerWaalsContact CG2-CG2 3.46Å; V146-A148 PolarHBondContact O-N 3.06Å
147	V	81.5	Confident	69.9	Low	74 Å²	74	87.1 Å²	87.1	45%	0.448	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-63.7	130.8	177.7	-179.2	0	0	0	0	110.1	K68 H145 L149	K68-V147 PolarHBondContact NZ-O 3.06Å; H145-V147 PolarHBondContact O-N 2.83Å; V147-L149 HydrophobicContact CG1-CD2 4.24Å
148	A	87	Confident	72.7	Confident	59 Å²	59	80.4 Å²	80.4	49%	0.488	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-87.8	121.8	167	0	0	0	0	0	108.8	V146	V146-A148 PolarHBondContact O-N 3.06Å
149	L	93	Very high	75.3	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	47%	0.467	C	S	.	.	S	Bend	trans	-91.7	-22.1	177.6	-65	172.8	0	0	0	111.2	V64 E67 K68 E119 V147 F285 T286 L287 V290	V64-L149 HydrophobicContact CB-CD1 4.45Å; V64-L149 HydrophobicContact CG1-CD1 4.11Å; V64-L149 HydrophobicContact CG2-CD1 4.37Å; E67-L149 HydrophobicContact CB-CD1 4.19Å; E67-L149 HydrophobicContact CB-CD2 4.22Å; K68-L149 HydrophobicContact CG-CD1 3.98Å; K68-L149 HydrophobicContact CG-CG 4.3Å; E119-L149 PolarHBondContact OE2-N 3.41Å; V147-L149 HydrophobicContact CG1-CD2 4.24Å; L149-F285 HydrophobicContact CD2-CD1 4.25Å; L149-T286 CarbonylContact O-C 3.52Å; L149-T286 VanDerWaalsContact O-CA 3.23Å; L149-T286 WeakPolarHBondContact O-CA 3.42Å; L149-T286 WeakPolarHBondContact O-CB 3.38Å; L149-L287 HydrophobicContact CB-CB 4.16Å; L149-L287 PolarHBondContact O-N 3.42Å; L149-V290 HydrophobicContact CD1-CG2 4.35Å; L149-V290 HydrophobicContact CD2-CG2 4.46Å
150	M	93.6	Very high	77.6	Confident	36 Å²	36	75.2 Å²	75.2	18%	0.177	45%	0.449	C	S	.	.	S	Bend	trans	-91.5	122.7	169.7	-67.2	-61.2	-68.5	0	0	110.7	E119 V161 L162 L287	E119-M150 HydrophobicContact CB-CG 4.33Å; E119-M150 HydrophobicContact CG-CG 3.86Å; E119-M150 WeakPolarHBondContact OE2-CB 3.23Å; E119-M150 WeakPolarHBondContact OE2-CG 3.34Å; E119-M150 PolarHBondContact OE2-N 3.42Å; M150-V161 HydrophobicContact CE-CG1 4.08Å; M150-V161 HydrophobicContact SD-CG1 3.57Å; M150-V161 VanDerWaalsContact SD-CG1 3.57Å; M150-L162 HydrophobicContact CE-CD2 3.75Å; M150-L162 HydrophobicContact CE-CG 4.34Å; M150-L287 HydrophobicContact CG-CD2 4.42Å; M150-L287 HydrophobicContact SD-CB 3.83Å; M150-L287 HydrophobicContact SD-CD2 3.6Å; M150-L287 HydrophobicContact SD-CG 4.37Å
151	P	92.2	Very high	80.2	Confident	32 Å²	32	71 Å²	71	21%	0.208	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-64.8	167.8	172.4	-19.4	31.9	0	0	0	112.4	V153 Q157 H158 V161 T286	P151-V153 PolarHBondContact O-N 3.32Å; P151-Q157 HydrophobicContact CB-CB 4.03Å; P151-Q157 HydrophobicContact CG-CB 3.98Å; P151-H158 HydrophobicContact CB-CB 4.12Å; P151-H158 PolarHBondContact O-CD2 2.84Å; P151-H158 VanDerWaalsContact O-CD2 3.27Å; P151-V161 HydrophobicContact CG-CG2 3.87Å; P151-T286 HydrophobicContact CG-CG2 4.07Å
152	E	89.4	Confident	82.6	Confident	163 Å²	163	71.5 Å²	71.5	76%	0.762	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-57.7	132.4	179.2	-172.6	177	-174.3	0	0	111.8	G154 S155 H158	E152-G154 PolarHBondContact O-N 3.24Å; E152-S155 VanDerWaalsContact O-CB 3.28Å; E152-S155 WeakPolarHBondContact O-CB 3.43Å; E152-S155 PolarHBondContact O-N 3.4Å; E152-S155 PolarHBondContact O-OG 3.34Å; E152-H158 WeakPolarHBondContact O-CB 3.4Å
153	V	90.2	Very high	85.3	Confident	123 Å²	123	70.1 Å²	70.1	75%	0.745	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	127.7	179.9	-179.5	0	0	0	0	109.7	P151	P151-V153 PolarHBondContact O-N 3.32Å
154	G	90	Very high	87.7	Confident	73 Å²	73	68 Å²	68	75%	0.753	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-10.2	-177.2	0	0	0	0	0	114.5	E152	E152-G154 PolarHBondContact O-N 3.24Å
155	S	92.7	Very high	90.1	Very high	27 Å²	27	60.7 Å²	60.7	19%	0.189	35%	0.35	C	S	.	.	S	Bend	trans	-70.2	149.9	170.6	67.2	0	0	0	0	111.8	E152 Q157 H158 A159	E152-S155 VanDerWaalsContact O-CB 3.28Å; E152-S155 WeakPolarHBondContact O-CB 3.43Å; E152-S155 PolarHBondContact O-N 3.4Å; E152-S155 PolarHBondContact O-OG 3.34Å; S155-Q157 PolarHBondContact O-N 3.2Å; S155-H158 WeakPolarHBondContact O-CB 3.49Å; S155-H158 PolarHBondContact O-N 3.16Å; S155-H158 VanDerWaalsContact O-N 3.1Å; S155-H158 VanDerWaalsContact OG-CB 3.29Å; S155-H158 WeakPolarHBondContact OG-CB 3.49Å; S155-H158 PolarHBondContact OG-N 2.86Å; S155-H158 VanDerWaalsContact OG-N 3.08Å; S155-A159 PolarHBondContact O-N 3.33Å
156	P	91.4	Very high	92	Very high	94 Å²	94	59.3 Å²	59.3	61%	0.61	34%	0.344	S	S	*	.	H	α-helix	trans	-56.1	-33.9	172.5	-25.9	34.6	0	0	0	113.1	R160	P156-R160 PolarHBondContact O-N 3.39Å
157	Q	92.1	Very high	93.3	Very high	91 Å²	91	60.3 Å²	60.3	43%	0.425	35%	0.349	S	S	.	.	H	α-helix	trans	-66.8	-41.9	177.2	-67.6	79.6	-7.1	0	0	111.1	P151 S155 R160 V161	P151-Q157 HydrophobicContact CB-CB 4.03Å; P151-Q157 HydrophobicContact CG-CB 3.98Å; S155-Q157 PolarHBondContact O-N 3.2Å; Q157-R160 PolarHBondContact O-N 3.45Å; Q157-V161 WeakPolarHBondContact O-CG2 3.33Å; Q157-V161 PolarHBondContact O-N 3.38Å
158	H	94.8	Very high	94.1	Very high	29 Å²	29	56.9 Å²	56.9	13%	0.134	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-46.2	176.5	176.1	-100	0	0	0	111.9	P151 E152 S155 R160 V161 L162	P151-H158 HydrophobicContact CB-CB 4.12Å; P151-H158 PolarHBondContact O-CD2 2.84Å; P151-H158 VanDerWaalsContact O-CD2 3.27Å; E152-H158 WeakPolarHBondContact O-CB 3.4Å; S155-H158 WeakPolarHBondContact O-CB 3.49Å; S155-H158 PolarHBondContact O-N 3.16Å; S155-H158 VanDerWaalsContact O-N 3.1Å; S155-H158 VanDerWaalsContact OG-CB 3.29Å; S155-H158 WeakPolarHBondContact OG-CB 3.49Å; S155-H158 PolarHBondContact OG-N 2.86Å; S155-H158 VanDerWaalsContact OG-N 3.08Å; H158-R160 VanDerWaalsContact C-N 3.28Å; H158-R160 PolarHBondContact O-N 2.93Å; H158-V161 PolarHBondContact O-N 3.27Å; H158-L162 VanDerWaalsContact CE1-CD1 3.45Å; H158-L162 WeakPolarHBondContact CE1-CD1 3.4Å; H158-L162 PolarHBondContact O-N 3.09Å
159	A	95.9	Very high	94.4	Very high	60 Å²	60	56 Å²	56	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-40.5	176.5	0	0	0	0	0	112.2	S155 L162 Q163	S155-A159 PolarHBondContact O-N 3.33Å; A159-L162 PolarHBondContact O-N 2.94Å; A159-Q163 PolarHBondContact O-N 3.41Å
160	R	95.3	Very high	94.6	Very high	48 Å²	48	59.7 Å²	59.7	18%	0.181	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-42.3	176.5	-170.6	-174.7	-68.5	147.1	-0.4	112.4	P156 Q157 H158 L162 Q163 Y164 E263 C281	P156-R160 PolarHBondContact O-N 3.39Å; Q157-R160 PolarHBondContact O-N 3.45Å; H158-R160 VanDerWaalsContact C-N 3.28Å; H158-R160 PolarHBondContact O-N 2.93Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 3.24Å; R160-Q163 WeakPolarHBondContact O-CB 3.4Å; R160-Q163 PolarHBondContact O-N 3.38Å; R160-Y164 HydrophobicContact CG-CD2 3.81Å; R160-Y164 HydrophobicContact CG-CE2 3.81Å; R160-Y164 WeakPolarHBondContact O-CD2 3.38Å; R160-Y164 PolarHBondContact O-N 3.35Å; R160-E263 WeakPolarHBondContact CD-OE1 3.38Å; R160-E263 IonicContact NE-OE1 3.66Å; R160-E263 PolarHBondContact NE-OE1 3.1Å; R160-C281 HydrophobicContact CG-CB 4.42Å; R160-C281 PolarHBondContact NH1-O 3.4Å
161	V	97.1	Very high	94.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.3	-43.4	176.7	170.2	0	0	0	0	110.9	M150 P151 Q157 H158 Y164 R165 C281 T286 L287 A288	M150-V161 HydrophobicContact CE-CG1 4.08Å; M150-V161 HydrophobicContact SD-CG1 3.57Å; M150-V161 VanDerWaalsContact SD-CG1 3.57Å; P151-V161 HydrophobicContact CG-CG2 3.87Å; Q157-V161 WeakPolarHBondContact O-CG2 3.33Å; Q157-V161 PolarHBondContact O-N 3.38Å; H158-V161 PolarHBondContact O-N 3.27Å; V161-Y164 PolarHBondContact O-N 2.81Å; V161-R165 WeakPolarHBondContact O-CB 3.23Å; V161-R165 PolarHBondContact O-N 2.92Å; V161-C281 HydrophobicContact CG2-CB 3.88Å; V161-C281 VanDerWaalsContact CG2-SG 3.58Å; V161-T286 HydrophobicContact CG2-CG2 3.85Å; V161-L287 HydrophobicContact CG1-CB 4.15Å; V161-A288 HydrophobicContact CG1-CB 4.24Å; V161-A288 HydrophobicContact CG2-CB 4.4Å
162	L	96.8	Very high	94.9	Very high	59 Å²	59	58.8 Å²	58.8	31%	0.309	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-45.6	175.4	-70.2	-179.4	0	0	0	112.1	M150 H158 A159 R160 Y164 R165 E166	M150-L162 HydrophobicContact CE-CD2 3.75Å; M150-L162 HydrophobicContact CE-CG 4.34Å; H158-L162 VanDerWaalsContact CE1-CD1 3.45Å; H158-L162 WeakPolarHBondContact CE1-CD1 3.4Å; H158-L162 PolarHBondContact O-N 3.09Å; A159-L162 PolarHBondContact O-N 2.94Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 3.24Å; L162-Y164 VanDerWaalsContact C-N 3.34Å; L162-Y164 PolarHBondContact O-N 3.45Å; L162-R165 WeakPolarHBondContact O-CB 3.46Å; L162-R165 PolarHBondContact O-N 2.68Å; L162-E166 WeakPolarHBondContact O-CG 3.45Å; L162-E166 PolarHBondContact O-N 3.44Å
163	Q	97.3	Very high	95.1	Very high	94 Å²	94	51.7 Å²	51.7	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-55.9	-48	177.6	-179.4	-174.2	6.2	0	0	112	A159 R160 E166 L167	A159-Q163 PolarHBondContact O-N 3.41Å; R160-Q163 WeakPolarHBondContact O-CB 3.4Å; R160-Q163 PolarHBondContact O-N 3.38Å; Q163-E166 PolarHBondContact O-N 2.99Å; Q163-L167 WeakPolarHBondContact O-CB 3.28Å; Q163-L167 PolarHBondContact O-N 3.35Å
164	Y	97.6	Very high	95	Very high	5 Å²	5	48.4 Å²	48.4	2%	0.02	29%	0.287	C	S	.	.	H	α-helix	trans	-75.5	-28.4	-179.1	-79.4	-72.7	0	0	0	113.2	R160 V161 L162 L167 L168 I260 E263 L280	R160-Y164 HydrophobicContact CG-CD2 3.81Å; R160-Y164 HydrophobicContact CG-CE2 3.81Å; R160-Y164 WeakPolarHBondContact O-CD2 3.38Å; R160-Y164 PolarHBondContact O-N 3.35Å; V161-Y164 PolarHBondContact O-N 2.81Å; L162-Y164 VanDerWaalsContact C-N 3.34Å; L162-Y164 PolarHBondContact O-N 3.45Å; Y164-L167 HydrophobicContact CD1-CD2 3.82Å; Y164-L167 HydrophobicContact CE1-CD2 3.85Å; Y164-L168 WeakPolarHBondContact O-CB 3.45Å; Y164-L168 WeakPolarHBondContact O-CD1 3.44Å; Y164-L168 WeakPolarHBondContact O-CG 3.49Å; Y164-L168 PolarHBondContact O-N 2.75Å; Y164-I260 HydrophobicContact CD1-CG1 4.27Å; Y164-I260 HydrophobicContact CE1-CG1 3.97Å; Y164-E263 HydrophobicContact CE2-CG 3.8Å; Y164-E263 WeakPolarHBondContact OH-CB 3.36Å; Y164-E263 VanDerWaalsContact OH-CD 3.31Å; Y164-E263 WeakPolarHBondContact OH-CG 3.5Å; Y164-L280 HydrophobicContact CD1-CD1 4.41Å; Y164-L280 HydrophobicContact CD1-CD2 3.78Å; Y164-L280 HydrophobicContact CD1-CG 4.37Å; Y164-L280 HydrophobicContact CD2-CD2 4.09Å; Y164-L280 HydrophobicContact CD2-CG 4.12Å; Y164-L280 HydrophobicContact CE1-CD1 4.27Å; Y164-L280 HydrophobicContact CE1-CD2 4.45Å; Y164-L280 HydrophobicContact CE2-CD1 4.47Å; Y164-L280 HydrophobicContact CE2-CG 4.41Å; Y164-L280 HydrophobicContact CG-CD2 3.6Å; Y164-L280 HydrophobicContact CG-CG 4.12Å
165	R	97.1	Very high	95.1	Very high	23 Å²	23	45 Å²	45	9%	0.087	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-54.1	168.3	175.9	175.2	-176.2	-177.8	0.1	110.6	D112 D116 V161 L162 L167 L168 D169 L291	D112-R165 PolarHBondContact O-NH2 2.75Å; D112-R165 IonicContact OD1-CZ 3.3Å; D112-R165 IonicContact OD1-NE 2.82Å; D112-R165 IonicContact OD1-NH2 3.31Å; D112-R165 PolarHBondContact OD1-NH2 3.46Å; D116-R165 IonicContact OD1-CZ 2.72Å; D116-R165 IonicContact OD1-NH1 2.71Å; D116-R165 PolarHBondContact OD1-NH1 2.78Å; D116-R165 IonicContact OD1-NH2 3.67Å; D116-R165 PolarHBondContact OD1-NH2 3.36Å; D116-R165 IonicContact OD2-NH1 2.91Å; D116-R165 IonicContact OD2-NH2 3.19Å; V161-R165 WeakPolarHBondContact O-CB 3.23Å; V161-R165 PolarHBondContact O-N 2.92Å; L162-R165 WeakPolarHBondContact O-CB 3.46Å; L162-R165 PolarHBondContact O-N 2.68Å; R165-L167 VanDerWaalsContact C-N 3.32Å; R165-L167 PolarHBondContact O-N 3.41Å; R165-L168 PolarHBondContact O-N 3.32Å; R165-L168 VanDerWaalsContact O-N 3.16Å; R165-D169 VanDerWaalsContact CG-OD2 3.23Å; R165-D169 WeakPolarHBondContact CG-OD2 3.35Å; R165-D169 IonicContact NE-OD2 3.73Å; R165-D169 WeakPolarHBondContact O-CB 3.44Å; R165-D169 PolarHBondContact O-N 3.5Å; R165-L291 HydrophobicContact CB-CD1 4.03Å; R165-L291 HydrophobicContact CG-CD1 3.7Å
166	E	97.1	Very high	95.1	Very high	141 Å²	141	43.8 Å²	43.8	66%	0.659	24%	0.243	S	C	*	.	H	α-helix	trans	-57.8	-44.4	178.4	-71.4	175.8	-171.9	0	0	112	L162 Q163 L168 D169 A170	L162-E166 WeakPolarHBondContact O-CG 3.45Å; L162-E166 PolarHBondContact O-N 3.44Å; Q163-E166 PolarHBondContact O-N 2.99Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; E166-D169 PolarHBondContact O-N 3.46Å; E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 3.33Å
167	L	97.9	Very high	95	Very high	35 Å²	35	40.4 Å²	40.4	18%	0.183	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-42.2	177.9	-175.4	66.4	0	0	0	112.4	Q163 Y164 R165 V256 I260	Q163-L167 WeakPolarHBondContact O-CB 3.28Å; Q163-L167 PolarHBondContact O-N 3.35Å; Y164-L167 HydrophobicContact CD1-CD2 3.82Å; Y164-L167 HydrophobicContact CE1-CD2 3.85Å; R165-L167 VanDerWaalsContact C-N 3.32Å; R165-L167 PolarHBondContact O-N 3.41Å; L167-V256 HydrophobicContact CD1-CG1 4.21Å; L167-V256 HydrophobicContact CD1-CG2 4.2Å; L167-V256 HydrophobicContact CD2-CG1 4.02Å; L167-V256 HydrophobicContact CG-CG1 3.9Å; L167-I260 HydrophobicContact CD2-CG1 4.48Å
168	L	97.3	Very high	94.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-77.6	-33.6	-178.3	-69	167.5	0	0	0	112.6	Y164 R165 E166 A170 L171 I260 L291 L292 T295	Y164-L168 WeakPolarHBondContact O-CB 3.45Å; Y164-L168 WeakPolarHBondContact O-CD1 3.44Å; Y164-L168 WeakPolarHBondContact O-CG 3.49Å; Y164-L168 PolarHBondContact O-N 2.75Å; R165-L168 PolarHBondContact O-N 3.32Å; R165-L168 VanDerWaalsContact O-N 3.16Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; L168-A170 VanDerWaalsContact C-N 3.32Å; L168-L171 HydrophobicContact CD2-CD1 4.17Å; L168-L171 WeakPolarHBondContact O-CB 3.42Å; L168-L171 PolarHBondContact O-N 3.05Å; L168-I260 HydrophobicContact CD2-CD1 4.13Å; L168-L291 HydrophobicContact CD1-CB 3.87Å; L168-L292 HydrophobicContact CD1-CB 3.9Å; L168-L292 HydrophobicContact CD2-CD1 3.93Å; L168-T295 HydrophobicContact CD2-CG2 4.45Å
169	D	94.2	Very high	94.6	Very high	41 Å²	41	36.5 Å²	36.5	22%	0.219	20%	0.202	C	C	.	.	H	α-helix	trans	-74.6	-23.9	177.1	-69.3	-31.5	0	0	0	112.2	K60 Y111 R165 E166 L171	K60-D169 IonicContact NZ-OD1 3.06Å; K60-D169 PolarHBondContact NZ-OD1 3.25Å; Y111-D169 PolarHBondContact OH-OD1 3.31Å; R165-D169 VanDerWaalsContact CG-OD2 3.23Å; R165-D169 WeakPolarHBondContact CG-OD2 3.35Å; R165-D169 IonicContact NE-OD2 3.73Å; R165-D169 WeakPolarHBondContact O-CB 3.44Å; R165-D169 PolarHBondContact O-N 3.5Å; E166-D169 PolarHBondContact O-N 3.46Å; D169-L171 PolarHBondContact O-N 2.87Å
170	A	96.5	Very high	94.3	Very high	79 Å²	79	33.7 Å²	33.7	65%	0.653	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.7	172.4	0	0	0	0	0	113.9	E166 L168	E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 3.33Å; L168-A170 VanDerWaalsContact C-N 3.32Å
171	L	96.5	Very high	93.8	Very high	15 Å²	15	32.4 Å²	32.4	8%	0.079	18%	0.175	C	C	.	.	S	Bend	trans	-69.4	126.7	178.7	-68.1	175.1	0	0	0	110.8	L168 D169 M173 Y176 L253 V256 T295	L168-L171 HydrophobicContact CD2-CD1 4.17Å; L168-L171 WeakPolarHBondContact O-CB 3.42Å; L168-L171 PolarHBondContact O-N 3.05Å; D169-L171 PolarHBondContact O-N 2.87Å; L171-M173 HydrophobicContact CB-CG 4.23Å; L171-M173 HydrophobicContact CB-SD 4.13Å; L171-M173 PolarHBondContact O-N 2.97Å; L171-Y176 HydrophobicContact CB-CE2 4.25Å; L171-Y176 HydrophobicContact CD2-CE2 4.47Å; L171-L253 HydrophobicContact CD1-CD1 4.25Å; L171-L253 HydrophobicContact CD2-CD1 4.02Å; L171-V256 HydrophobicContact CD2-CB 4.33Å; L171-V256 HydrophobicContact CD2-CG1 4.23Å; L171-V256 HydrophobicContact CD2-CG2 4.11Å; L171-T295 HydrophobicContact CD1-CG2 3.84Å
172	P	95.4	Very high	93.3	Very high	34 Å²	34	32.8 Å²	32.8	22%	0.221	18%	0.177	C	C	.	.			trans	-77.3	70.7	180	33.9	-38	0	0	0	111.1	D174 A175 Y176 I249	P172-D174 PolarHBondContact O-N 3.48Å; P172-A175 HydrophobicContact CB-CB 3.9Å; P172-A175 HydrophobicContact CG-CB 4.4Å; P172-A175 WeakPolarHBondContact O-CA 3.45Å; P172-A175 WeakPolarHBondContact O-CB 3.27Å; P172-A175 PolarHBondContact O-N 3.5Å; P172-Y176 WeakPolarHBondContact CD-OH 3.38Å; P172-Y176 HydrophobicContact CG-CE1 4.02Å; P172-Y176 HydrophobicContact CG-CE2 4.29Å; P172-Y176 PolarHBondContact O-N 3.07Å; P172-I249 HydrophobicContact CG-CB 4.42Å; P172-I249 HydrophobicContact CG-CD1 4.27Å
173	M	93.3	Very high	93	Very high	14 Å²	14	30.8 Å²	30.8	7%	0.069	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-26	-174.6	-66.7	-59.2	-56.8	0	0	112.9	F56 L171 Y176 T177 T295 R298 L299	F56-M173 HydrophobicContact CD1-CB 3.96Å; F56-M173 HydrophobicContact CD1-CG 4.08Å; F56-M173 HydrophobicContact CE1-CB 3.93Å; F56-M173 HydrophobicContact CE1-CG 3.52Å; F56-M173 HydrophobicContact CE2-CE 4.39Å; F56-M173 HydrophobicContact CZ-CE 4.24Å; F56-M173 HydrophobicContact CZ-CG 3.99Å; L171-M173 HydrophobicContact CB-CG 4.23Å; L171-M173 HydrophobicContact CB-SD 4.13Å; L171-M173 PolarHBondContact O-N 2.97Å; M173-Y176 HydrophobicContact CE-CD2 4.38Å; M173-Y176 HydrophobicContact SD-CD2 3.61Å; M173-Y176 HydrophobicContact SD-CE2 3.98Å; M173-T177 VanDerWaalsContact O-CB 3.26Å; M173-T177 WeakPolarHBondContact O-CB 3.4Å; M173-T177 PolarHBondContact O-N 3.26Å; M173-T177 PolarHBondContact O-OG1 2.83Å; M173-T295 HydrophobicContact SD-CG2 4.23Å; M173-R298 HydrophobicContact CE-CB 3.69Å; M173-R298 HydrophobicContact CE-CG 3.22Å; M173-L299 HydrophobicContact CE-CD2 4.23Å
174	D	89.4	Confident	92.7	Very high	54 Å²	54	29.5 Å²	29.5	29%	0.289	17%	0.166	S	C	.	.	H	α-helix	trans	-69.2	-40.4	171.5	60.7	-18.7	0	0	0	111.8	P172 T177 H178 K236 H240	P172-D174 PolarHBondContact O-N 3.48Å; D174-T177 PolarHBondContact O-N 3.4Å; D174-H178 VanDerWaalsContact O-CG 3.3Å; D174-H178 PolarHBondContact O-N 3.01Å; D174-H178 PolarHBondContact O-ND1 3.3Å; D174-K236 IonicContact OD2-NZ 3.53Å; D174-K236 PolarHBondContact OD2-NZ 3.07Å; D174-H240 PolarHBondContact O-ND1 2.88Å; D174-H240 IonicContact OD2-CE1 3.06Å
175	A	91.9	Very high	92.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-45.7	173.4	0	0	0	0	0	112.3	P172 T177 G179 H240 Y245 I249	P172-A175 HydrophobicContact CB-CB 3.9Å; P172-A175 HydrophobicContact CG-CB 4.4Å; P172-A175 WeakPolarHBondContact O-CA 3.45Å; P172-A175 WeakPolarHBondContact O-CB 3.27Å; P172-A175 PolarHBondContact O-N 3.5Å; A175-T177 VanDerWaalsContact C-N 3.34Å; A175-T177 PolarHBondContact O-N 3.25Å; A175-G179 WeakPolarHBondContact O-CA 3.5Å; A175-G179 PolarHBondContact O-N 2.8Å; A175-H240 WeakPolarHBondContact CA-CE1 3.3Å; A175-H240 WeakPolarHBondContact CA-ND1 3.33Å; A175-H240 PolarHBondContact N-CE1 2.9Å; A175-Y245 HydrophobicContact CB-CE1 4.4Å; A175-I249 HydrophobicContact CB-CD1 3.47Å; A175-I249 VanDerWaalsContact CB-CD1 3.47Å
176	Y	93.2	Very high	92.1	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-43.5	173.8	-54.6	-33.7	0	0	0	111.5	L171 P172 M173 C180 I249 L250 L253 L299	L171-Y176 HydrophobicContact CB-CE2 4.25Å; L171-Y176 HydrophobicContact CD2-CE2 4.47Å; P172-Y176 WeakPolarHBondContact CD-OH 3.38Å; P172-Y176 HydrophobicContact CG-CE1 4.02Å; P172-Y176 HydrophobicContact CG-CE2 4.29Å; P172-Y176 PolarHBondContact O-N 3.07Å; M173-Y176 HydrophobicContact CE-CD2 4.38Å; M173-Y176 HydrophobicContact SD-CD2 3.61Å; M173-Y176 HydrophobicContact SD-CE2 3.98Å; Y176-C180 WeakPolarHBondContact O-CB 3.34Å; Y176-C180 PolarHBondContact O-N 3.06Å; Y176-C180 PolarHBondContact O-SG 2.86Å; Y176-I249 HydrophobicContact CD1-CD1 3.82Å; Y176-I249 HydrophobicContact CD1-CG1 4.16Å; Y176-I249 HydrophobicContact CE1-CB 3.96Å; Y176-I249 HydrophobicContact CE1-CD1 3.69Å; Y176-I249 HydrophobicContact CE1-CG1 3.68Å; Y176-I249 PolarHBondContact OH-O 2.75Å; Y176-I249 VanDerWaalsContact OH-O 3.05Å; Y176-L250 HydrophobicContact CD1-CD2 3.97Å; Y176-L250 HydrophobicContact CE1-CD2 4.2Å; Y176-L253 HydrophobicContact CE2-CD1 4.35Å; Y176-L253 HydrophobicContact CE2-CD2 4.35Å; Y176-L299 HydrophobicContact CD2-CD2 4.33Å
177	T	88.9	Confident	91.8	Very high	23 Å²	23	30.5 Å²	30.5	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-53.3	-177.3	-60.4	0	0	0	0	111.4	M173 D174 A175 I181 L302	M173-T177 VanDerWaalsContact O-CB 3.26Å; M173-T177 WeakPolarHBondContact O-CB 3.4Å; M173-T177 PolarHBondContact O-N 3.26Å; M173-T177 PolarHBondContact O-OG1 2.83Å; D174-T177 PolarHBondContact O-N 3.4Å; A175-T177 VanDerWaalsContact C-N 3.34Å; A175-T177 PolarHBondContact O-N 3.25Å; T177-I181 HydrophobicContact CG2-CD1 4.1Å; T177-I181 VanDerWaalsContact O-CD1 3.31Å; T177-I181 WeakPolarHBondContact O-CD1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.33Å; T177-I181 PolarHBondContact O-N 2.87Å; T177-L302 HydrophobicContact CG2-CD2 4.36Å
178	H	87.9	Confident	91.5	Very high	37 Å²	37	32.3 Å²	32.3	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-67.6	-43.8	179.6	-57.6	151.4	0	0	0	111.4	D174 C180 I181 L182 H240	D174-H178 VanDerWaalsContact O-CG 3.3Å; D174-H178 PolarHBondContact O-N 3.01Å; D174-H178 PolarHBondContact O-ND1 3.3Å; H178-C180 PolarHBondContact O-N 2.72Å; H178-I181 PolarHBondContact O-N 3.42Å; H178-I181 VanDerWaalsContact O-N 3.13Å; H178-L182 WeakPolarHBondContact O-CG 3.34Å; H178-L182 PolarHBondContact O-N 2.85Å; H178-H240 HydrophobicContact CB-CB 3.89Å; H178-H240 WeakPolarHBondContact CB-ND1 3.2Å; H178-H240 AromaticContact CG-ND1 3.59Å; H178-H240 AromaticContact ND1-CE1 3.56Å; H178-H240 AromaticContact ND1-ND1 3.02Å; H178-H240 PolarHBondContact ND1-ND1 2.78Å
179	G	89.8	Confident	91	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-46.9	-179.2	0	0	0	0	0	112.7	A175 I181 L182 H183	A175-G179 WeakPolarHBondContact O-CA 3.5Å; A175-G179 PolarHBondContact O-N 2.8Å; G179-I181 VanDerWaalsContact C-N 3.3Å; G179-I181 PolarHBondContact O-N 3.44Å; G179-L182 PolarHBondContact O-N 3.27Å; G179-H183 WeakPolarHBondContact O-CB 3.43Å; G179-H183 PolarHBondContact O-CD2 2.83Å; G179-H183 PolarHBondContact O-N 2.79Å
180	C	89.1	Confident	90.7	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-26.7	177.1	-72.4	0	0	0	0	113.7	Y176 H178 T187 I192 L302	Y176-C180 WeakPolarHBondContact O-CB 3.34Å; Y176-C180 PolarHBondContact O-N 3.06Å; Y176-C180 PolarHBondContact O-SG 2.86Å; H178-C180 PolarHBondContact O-N 2.72Å; C180-T187 HydrophobicContact CB-CG2 3.67Å; C180-I192 HydrophobicContact CB-CD1 4.35Å; C180-L302 HydrophobicContact CB-CB 4.37Å; C180-L302 HydrophobicContact CB-CD2 4.28Å
181	I	86.3	Confident	90.1	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.108	20%	0.201	C	C	.	.	H	α-helix	trans	-74	-38	173.3	-63.4	164.2	0	0	0	110.6	T177 H178 G179 I192 A196 T197 I200	T177-I181 HydrophobicContact CG2-CD1 4.1Å; T177-I181 VanDerWaalsContact O-CD1 3.31Å; T177-I181 WeakPolarHBondContact O-CD1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.33Å; T177-I181 PolarHBondContact O-N 2.87Å; H178-I181 PolarHBondContact O-N 3.42Å; H178-I181 VanDerWaalsContact O-N 3.13Å; G179-I181 VanDerWaalsContact C-N 3.3Å; G179-I181 PolarHBondContact O-N 3.44Å; I181-I192 HydrophobicContact CG1-CD1 3.62Å; I181-I192 HydrophobicContact CG1-CG1 4.28Å; I181-I192 HydrophobicContact CG1-CG2 3.96Å; I181-A196 HydrophobicContact CG2-CB 4Å; I181-T197 WeakPolarHBondContact O-CB 3.46Å; I181-T197 WeakPolarHBondContact O-CG2 3.48Å; I181-T197 PolarHBondContact O-OG1 3.34Å; I181-I200 HydrophobicContact CB-CD1 3.92Å; I181-I200 HydrophobicContact CD1-CD1 3.7Å; I181-I200 HydrophobicContact CG1-CD1 4.4Å; I181-I200 HydrophobicContact CG2-CD1 3.48Å; I181-I200 VanDerWaalsContact CG2-CD1 3.48Å; I181-I200 HydrophobicContact CG2-CG1 4.29Å
182	L	86.8	Confident	89.2	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-77.7	-32.7	-178.4	-68.4	171.4	0	0	0	112.9	H178 G179 P184 I200 R201 I237 D241	H178-L182 WeakPolarHBondContact O-CG 3.34Å; H178-L182 PolarHBondContact O-N 2.85Å; G179-L182 PolarHBondContact O-N 3.27Å; L182-P184 VanDerWaalsContact C-CD 3.44Å; L182-P184 WeakPolarHBondContact O-CD 3.32Å; L182-I200 HydrophobicContact CD2-CG2 3.94Å; L182-R201 HydrophobicContact CD2-CG 4.35Å; L182-I237 HydrophobicContact CD1-CG2 4.26Å; L182-D241 HydrophobicContact CD1-CB 3.99Å
183	H	90.6	Very high	88.2	Confident	17 Å²	17	37.1 Å²	37.1	8%	0.079	20%	0.203	C	C	.	.			trans	-123.1	66.6	-175.4	-57.8	-61.1	0	0	0	111.5	G179 E185 L186 D241 V243 L246	G179-H183 WeakPolarHBondContact O-CB 3.43Å; G179-H183 PolarHBondContact O-CD2 2.83Å; G179-H183 PolarHBondContact O-N 2.79Å; H183-E185 VanDerWaalsContact CA-OE2 3.31Å; H183-E185 WeakPolarHBondContact CA-OE2 3.25Å; H183-E185 WeakPolarHBondContact CB-OE1 3.2Å; H183-E185 IonicContact CG-OE1 2.67Å; H183-E185 IonicContact ND1-OE1 3.71Å; H183-E185 PolarHBondContact O-N 3.43Å; H183-E185 VanDerWaalsContact O-N 3.13Å; H183-L186 HydrophobicContact CB-CD1 3.82Å; H183-L186 HydrophobicContact CB-CG 4.13Å; H183-L186 WeakPolarHBondContact O-CB 3.35Å; H183-L186 PolarHBondContact O-N 3.28Å; H183-L186 VanDerWaalsContact O-N 3.1Å; H183-D241 PolarHBondContact CE1-O 2.86Å; H183-D241 VanDerWaalsContact CE1-O 3.3Å; H183-D241 IonicContact CE1-OD1 3.9Å; H183-D241 PolarHBondContact CE1-OD1 3.46Å; H183-D241 VanDerWaalsContact NE2-C 3.33Å; H183-D241 WeakPolarHBondContact NE2-CA 3.39Å; H183-D241 PolarHBondContact NE2-O 2.82Å; H183-D241 IonicContact NE2-OD1 3.91Å; H183-D241 PolarHBondContact NE2-OD1 3.33Å; H183-V243 WeakPolarHBondContact CE1-CG2 3.18Å; H183-V243 WeakPolarHBondContact ND1-CG2 3.46Å; H183-L246 HydrophobicContact CB-CD2 4.3Å
184	P	89.3	Confident	87.3	Confident	68 Å²	68	46.4 Å²	46.4	44%	0.442	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-61.3	-21.8	-175.4	25.7	-35.2	0	0	0	113.6	L182 L186 T187	L182-P184 VanDerWaalsContact C-CD 3.44Å; L182-P184 WeakPolarHBondContact O-CD 3.32Å; P184-L186 PolarHBondContact O-N 2.88Å; P184-T187 PolarHBondContact O-N 2.99Å; P184-T187 PolarHBondContact O-OG1 3.31Å
185	E	90.6	Very high	86.5	Confident	129 Å²	129	49.8 Å²	49.8	60%	0.603	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-63.6	-15.8	175.3	72.4	-76.7	179.9	0	0	114.1	H183 T187	H183-E185 VanDerWaalsContact CA-OE2 3.31Å; H183-E185 WeakPolarHBondContact CA-OE2 3.25Å; H183-E185 WeakPolarHBondContact CB-OE1 3.2Å; H183-E185 IonicContact CG-OE1 2.67Å; H183-E185 IonicContact ND1-OE1 3.71Å; H183-E185 PolarHBondContact O-N 3.43Å; H183-E185 VanDerWaalsContact O-N 3.13Å; E185-T187 VanDerWaalsContact C-N 3.29Å
186	L	91.4	Very high	85.6	Confident	39 Å²	39	50.5 Å²	50.5	20%	0.204	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-84.3	-5.1	173.8	-59.5	178.2	0	0	0	113	H183 P184 L246 L250	H183-L186 HydrophobicContact CB-CD1 3.82Å; H183-L186 HydrophobicContact CB-CG 4.13Å; H183-L186 WeakPolarHBondContact O-CB 3.35Å; H183-L186 PolarHBondContact O-N 3.28Å; H183-L186 VanDerWaalsContact O-N 3.1Å; P184-L186 PolarHBondContact O-N 2.88Å; L186-L246 HydrophobicContact CD1-CD2 3.41Å; L186-L246 VanDerWaalsContact CD1-CD2 3.41Å; L186-L246 HydrophobicContact CD1-CG 3.92Å; L186-L250 HydrophobicContact CD1-CD1 4.43Å
187	T	91.3	Very high	84.7	Confident	22 Å²	22	51.9 Å²	51.9	14%	0.135	27%	0.267	C	S	.	.			trans	-116.9	159.4	-173	73.9	0	0	0	0	111.8	C180 P184 E185 L302 L304	C180-T187 HydrophobicContact CB-CG2 3.67Å; P184-T187 PolarHBondContact O-N 2.99Å; P184-T187 PolarHBondContact O-OG1 3.31Å; E185-T187 VanDerWaalsContact C-N 3.29Å; T187-L302 WeakPolarHBondContact CB-O 3.4Å; T187-L302 WeakPolarHBondContact CG2-O 3.13Å; T187-L304 HydrophobicContact CG2-CD2 4.49Å
188	T	91.9	Very high	84	Confident	72 Å²	72	53.9 Å²	53.9	44%	0.442	29%	0.286	S	S	.	.	S	Bend	trans	-137.5	131.2	173.4	-54.5	0	0	0	0	109.2	S190 G303 K306	T188-S190 PolarHBondContact O-N 3.48Å; T188-G303 PolarHBondContact N-O 3.3Å; T188-G303 CarbonylContact O-C 3.35Å; T188-G303 WeakPolarHBondContact O-CA 3.1Å; T188-K306 HydrophobicContact CG2-CD 3.7Å
189	D	87.1	Confident	83.3	Confident	111 Å²	111	55.9 Å²	55.9	59%	0.594	30%	0.295	S	S	*	.	S	Bend	trans	53.5	37.6	-176.6	-56.9	-26.6	0	0	0	114.3	K306	D189-K306 WeakPolarHBondContact OD2-CD 3.45Å; D189-K306 WeakPolarHBondContact OD2-CE 3.09Å; D189-K306 IonicContact OD2-NZ 3.52Å; D189-K306 PolarHBondContact OD2-NZ 2.91Å
190	S	86.8	Confident	82.4	Confident	38 Å²	38	57.2 Å²	57.2	27%	0.266	30%	0.302	S	S	.	.			trans	-60.2	139.5	175.2	-175.8	0	0	0	0	111.7	T188 I192 F301 L302	T188-S190 PolarHBondContact O-N 3.48Å; S190-I192 VanDerWaalsContact C-N 3.26Å; S190-I192 WeakPolarHBondContact OG-CB 3.31Å; S190-I192 WeakPolarHBondContact OG-CD1 3.45Å; S190-I192 VanDerWaalsContact OG-CG1 3.26Å; S190-I192 WeakPolarHBondContact OG-CG1 3.35Å; S190-I192 PolarHBondContact OG-N 3.34Å; S190-F301 PolarHBondContact OG-O 3.18Å; S190-L302 PolarHBondContact OG-O 3.34Å
191	M	83.9	Confident	81.7	Confident	65 Å²	65	63 Å²	63	32%	0.32	32%	0.324	S	S	.	.			trans	-88.1	2.8	174.5	-58.4	-179.9	-165	0	0	112.1	K300 F301 I337	M191-K300 HydrophobicContact CE-CG 4.14Å; M191-F301 HydrophobicContact CB-CD2 3.59Å; M191-F301 HydrophobicContact CB-CE2 3.85Å; M191-F301 HydrophobicContact CB-CG 4.36Å; M191-F301 HydrophobicContact CG-CD2 4.49Å; M191-F301 PolarHBondContact N-O 2.91Å; M191-F301 HydrophobicContact SD-CD2 4.33Å; M191-I337 HydrophobicContact CE-CD1 4.18Å; M191-I337 HydrophobicContact SD-CD1 4.06Å; M191-I337 HydrophobicContact SD-CG1 4.47Å; M191-I337 HydrophobicContact SD-CG2 3.77Å
192	I	78.1	Confident	81.2	Confident	26 Å²	26	66.6 Å²	66.6	13%	0.133	34%	0.336	C	S	.	.	S	Bend	trans	-64.5	128.6	176.4	-65.9	165.8	0	0	0	109.5	C180 I181 S190 K194 A196 F301 L302	C180-I192 HydrophobicContact CB-CD1 4.35Å; I181-I192 HydrophobicContact CG1-CD1 3.62Å; I181-I192 HydrophobicContact CG1-CG1 4.28Å; I181-I192 HydrophobicContact CG1-CG2 3.96Å; S190-I192 VanDerWaalsContact C-N 3.26Å; S190-I192 WeakPolarHBondContact OG-CB 3.31Å; S190-I192 WeakPolarHBondContact OG-CD1 3.45Å; S190-I192 VanDerWaalsContact OG-CG1 3.26Å; S190-I192 WeakPolarHBondContact OG-CG1 3.35Å; S190-I192 PolarHBondContact OG-N 3.34Å; I192-K194 PolarHBondContact O-N 2.96Å; I192-A196 HydrophobicContact CG2-CB 3.75Å; I192-F301 HydrophobicContact CG1-CD1 4.45Å; I192-F301 HydrophobicContact CG1-CE1 3.81Å; I192-F301 HydrophobicContact CG1-CZ 4.18Å; I192-L302 HydrophobicContact CD1-CD2 3.78Å; I192-L302 HydrophobicContact CG1-CD2 4.41Å
193	P	75.2	Confident	80.4	Confident	31 Å²	31	69.6 Å²	69.6	20%	0.201	35%	0.35	C	S	.	.			trans	-60.7	136	174.3	-22.6	32.8	0	0	0	112.2	Y195 A196	P193-Y195 HydrophobicContact CB-CD1 3.81Å; P193-Y195 HydrophobicContact CB-CE1 3.36Å; P193-Y195 HydrophobicContact CB-CE2 4.2Å; P193-Y195 HydrophobicContact CB-CG 4.4Å; P193-Y195 HydrophobicContact CG-CE1 4.28Å; P193-Y195 PolarHBondContact O-N 3.47Å; P193-A196 WeakPolarHBondContact O-CB 3.45Å; P193-A196 PolarHBondContact O-N 2.81Å
194	K	73.9	Confident	79.4	Confident	209 Å²	209	71.2 Å²	71.2	91%	0.909	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.5	-177	-66.1	-176.2	178.3	-178.7	0	114.8	I192 A196	I192-K194 PolarHBondContact O-N 2.96Å; K194-A196 VanDerWaalsContact C-N 3.34Å
195	Y	71.9	Confident	78.5	Confident	126 Å²	126	71.6 Å²	71.6	49%	0.494	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.9	178.5	62.9	-100.4	0	0	0	113.5	P193 T197 A198 E199	P193-Y195 HydrophobicContact CB-CD1 3.81Å; P193-Y195 HydrophobicContact CB-CE1 3.36Å; P193-Y195 HydrophobicContact CB-CE2 4.2Å; P193-Y195 HydrophobicContact CB-CG 4.4Å; P193-Y195 HydrophobicContact CG-CE1 4.28Å; P193-Y195 PolarHBondContact O-N 3.47Å; Y195-T197 VanDerWaalsContact C-N 3.3Å; Y195-T197 PolarHBondContact O-N 3.33Å; Y195-A198 PolarHBondContact O-N 3.01Å; Y195-A198 VanDerWaalsContact O-N 3.17Å; Y195-E199 PolarHBondContact O-N 3.5Å
196	A	73.8	Confident	77.5	Confident	16 Å²	16	68.3 Å²	68.3	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-39.8	-174.8	0	0	0	0	0	112.1	I181 I192 P193 K194 A198 E199 I200	I181-A196 HydrophobicContact CG2-CB 4Å; I192-A196 HydrophobicContact CG2-CB 3.75Å; P193-A196 WeakPolarHBondContact O-CB 3.45Å; P193-A196 PolarHBondContact O-N 2.81Å; K194-A196 VanDerWaalsContact C-N 3.34Å; A196-A198 PolarHBondContact O-N 3.45Å; A196-E199 PolarHBondContact O-N 3.15Å; A196-I200 WeakPolarHBondContact O-CG1 3.44Å; A196-I200 PolarHBondContact O-N 3.28Å
197	T	74.3	Confident	76.2	Confident	31 Å²	31	66.9 Å²	66.9	19%	0.19	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-45.8	176.5	-47.4	0	0	0	0	111.8	I181 Y195 E199 I200 R201	I181-T197 WeakPolarHBondContact O-CB 3.46Å; I181-T197 WeakPolarHBondContact O-CG2 3.48Å; I181-T197 PolarHBondContact O-OG1 3.34Å; Y195-T197 VanDerWaalsContact C-N 3.3Å; Y195-T197 PolarHBondContact O-N 3.33Å; T197-E199 VanDerWaalsContact C-N 3.28Å; T197-E199 PolarHBondContact O-N 3.33Å; T197-I200 PolarHBondContact O-N 2.77Å; T197-R201 WeakPolarHBondContact O-CB 3.33Å; T197-R201 WeakPolarHBondContact O-CG 3.41Å; T197-R201 PolarHBondContact O-N 2.91Å
198	A	74.1	Confident	74.6	Confident	65 Å²	65	70.2 Å²	70.2	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-38.4	178.3	0	0	0	0	0	111.1	Y195 A196 R201 R202	Y195-A198 PolarHBondContact O-N 3.01Å; Y195-A198 VanDerWaalsContact O-N 3.17Å; A196-A198 PolarHBondContact O-N 3.45Å; A198-R201 PolarHBondContact O-N 3.03Å; A198-R202 VanDerWaalsContact O-CB 3.26Å; A198-R202 WeakPolarHBondContact O-CB 3.17Å; A198-R202 PolarHBondContact O-N 3.09Å
199	E	72.7	Confident	73.3	Confident	78 Å²	78	70.3 Å²	70.3	36%	0.364	37%	0.369	S	S	.	.	H	α-helix	trans	-68.7	-44.1	179.3	-171.4	61	-173.8	0	0	112.5	Y195 A196 T197 R201 R202 H203	Y195-E199 PolarHBondContact O-N 3.5Å; A196-E199 PolarHBondContact O-N 3.15Å; T197-E199 VanDerWaalsContact C-N 3.28Å; T197-E199 PolarHBondContact O-N 3.33Å; E199-R201 PolarHBondContact O-N 3.12Å; E199-R202 WeakPolarHBondContact O-CB 3.4Å; E199-R202 PolarHBondContact O-N 3.1Å; E199-R202 IonicContact OE1-CZ 3.44Å; E199-R202 IonicContact OE1-NE 3.4Å; E199-R202 PolarHBondContact OE1-NE 3.28Å; E199-R202 IonicContact OE1-NH2 2.75Å; E199-R202 PolarHBondContact OE1-NH2 3.25Å; E199-R202 IonicContact OE2-CZ 3.73Å; E199-R202 IonicContact OE2-NE 2.9Å; E199-R202 PolarHBondContact OE2-NE 2.92Å; E199-R202 IonicContact OE2-NH2 3.89Å; E199-H203 PolarHBondContact O-CD2 3.35Å; E199-H203 PolarHBondContact O-N 3.35Å; E199-H203 IonicContact OE1-CD2 3.67Å; E199-H203 IonicContact OE1-NE2 2.68Å; E199-H203 PolarHBondContact OE1-NE2 2.91Å; E199-H203 VanDerWaalsContact OE1-NE2 3.17Å
200	I	72.4	Confident	72.3	Confident	29 Å²	29	67 Å²	67	15%	0.149	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-46.3	173.7	-66.2	-174.4	0	0	0	110.5	I181 L182 A196 T197 R202 H203 L204 I237	I181-I200 HydrophobicContact CB-CD1 3.92Å; I181-I200 HydrophobicContact CD1-CD1 3.7Å; I181-I200 HydrophobicContact CG1-CD1 4.4Å; I181-I200 HydrophobicContact CG2-CD1 3.48Å; I181-I200 VanDerWaalsContact CG2-CD1 3.48Å; I181-I200 HydrophobicContact CG2-CG1 4.29Å; L182-I200 HydrophobicContact CD2-CG2 3.94Å; A196-I200 WeakPolarHBondContact O-CG1 3.44Å; A196-I200 PolarHBondContact O-N 3.28Å; T197-I200 PolarHBondContact O-N 2.77Å; I200-R202 VanDerWaalsContact C-N 3.31Å; I200-R202 PolarHBondContact O-N 3.17Å; I200-H203 PolarHBondContact O-N 3.44Å; I200-L204 PolarHBondContact O-N 3.16Å; I200-I237 HydrophobicContact CG2-CG2 4.02Å
201	R	73.6	Confident	71	Confident	122 Å²	122	66.7 Å²	66.7	46%	0.46	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-38.4	177.6	-72	-178.1	-174.9	-85.4	-4.2	111.8	L182 T197 A198 E199 L204 A205	L182-R201 HydrophobicContact CD2-CG 4.35Å; T197-R201 WeakPolarHBondContact O-CB 3.33Å; T197-R201 WeakPolarHBondContact O-CG 3.41Å; T197-R201 PolarHBondContact O-N 2.91Å; A198-R201 PolarHBondContact O-N 3.03Å; E199-R201 PolarHBondContact O-N 3.12Å; R201-L204 PolarHBondContact O-N 2.98Å; R201-A205 WeakPolarHBondContact O-CB 3.48Å; R201-A205 PolarHBondContact O-N 3.33Å
202	R	74.9	Confident	69.9	Low	97 Å²	97	70.5 Å²	70.5	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-45.5	174.5	-172	-167	69.4	69.7	-3.5	111.5	A198 E199 I200 L204 A205 N206	A198-R202 VanDerWaalsContact O-CB 3.26Å; A198-R202 WeakPolarHBondContact O-CB 3.17Å; A198-R202 PolarHBondContact O-N 3.09Å; E199-R202 WeakPolarHBondContact O-CB 3.4Å; E199-R202 PolarHBondContact O-N 3.1Å; E199-R202 IonicContact OE1-CZ 3.44Å; E199-R202 IonicContact OE1-NE 3.4Å; E199-R202 PolarHBondContact OE1-NE 3.28Å; E199-R202 IonicContact OE1-NH2 2.75Å; E199-R202 PolarHBondContact OE1-NH2 3.25Å; E199-R202 IonicContact OE2-CZ 3.73Å; E199-R202 IonicContact OE2-NE 2.9Å; E199-R202 PolarHBondContact OE2-NE 2.92Å; E199-R202 IonicContact OE2-NH2 3.89Å; I200-R202 VanDerWaalsContact C-N 3.31Å; I200-R202 PolarHBondContact O-N 3.17Å; R202-L204 VanDerWaalsContact C-N 3.33Å; R202-A205 PolarHBondContact O-N 3.47Å; R202-N206 PolarHBondContact NH1-ND2 3.24Å; R202-N206 WeakPolarHBondContact O-CB 3.34Å; R202-N206 PolarHBondContact O-N 3.46Å
203	H	70	Confident	69.1	Low	70 Å²	70	76.3 Å²	76.3	32%	0.324	39%	0.39	S	S	.	.	H	α-helix	trans	-62.6	-40.1	176.1	-83.4	-67.1	0	0	0	112.5	E199 I200 N206 A207	E199-H203 PolarHBondContact O-CD2 3.35Å; E199-H203 PolarHBondContact O-N 3.35Å; E199-H203 IonicContact OE1-CD2 3.67Å; E199-H203 IonicContact OE1-NE2 2.68Å; E199-H203 PolarHBondContact OE1-NE2 2.91Å; E199-H203 VanDerWaalsContact OE1-NE2 3.17Å; I200-H203 PolarHBondContact O-N 3.44Å; H203-N206 PolarHBondContact O-N 3.39Å; H203-A207 WeakPolarHBondContact O-CA 3.49Å; H203-A207 PolarHBondContact O-N 3.1Å
204	L	69.6	Low	68.2	Low	51 Å²	51	76.8 Å²	76.8	27%	0.267	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-44.4	175.9	-173.5	62.3	0	0	0	111.4	I200 R201 R202 N206 A207 M234 L238	I200-L204 PolarHBondContact O-N 3.16Å; R201-L204 PolarHBondContact O-N 2.98Å; R202-L204 VanDerWaalsContact C-N 3.33Å; L204-N206 PolarHBondContact O-N 3.1Å; L204-A207 WeakPolarHBondContact O-CB 3.46Å; L204-A207 PolarHBondContact O-N 3.35Å; L204-M234 HydrophobicContact CD1-SD 3.6Å; L204-L238 HydrophobicContact CD1-CD2 4.05Å; L204-L238 HydrophobicContact CD1-CG 4.07Å; L204-L238 HydrophobicContact CD2-CD2 3.88Å; L204-L238 HydrophobicContact CG-CD2 4.48Å
205	A	71.3	Confident	67.4	Low	77 Å²	77	72.9 Å²	72.9	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-65.8	-35.7	178.3	0	0	0	0	0	113.1	R201 R202	R201-A205 WeakPolarHBondContact O-CB 3.48Å; R201-A205 PolarHBondContact O-N 3.33Å; R202-A205 PolarHBondContact O-N 3.47Å
206	N	68.5	Low	66.7	Low	60 Å²	60	69.9 Å²	69.9	32%	0.321	37%	0.37	S	S	.	.	H	α-helix	trans	-92.4	0.1	-177.6	-68.6	-9.9	0	0	0	113.8	R202 H203 L204 T208 T209 D210	R202-N206 PolarHBondContact NH1-ND2 3.24Å; R202-N206 WeakPolarHBondContact O-CB 3.34Å; R202-N206 PolarHBondContact O-N 3.46Å; H203-N206 PolarHBondContact O-N 3.39Å; L204-N206 PolarHBondContact O-N 3.1Å; N206-T208 VanDerWaalsContact C-N 3.3Å; N206-T208 PolarHBondContact O-N 3.15Å; N206-T209 PolarHBondContact O-N 3.3Å; N206-D210 PolarHBondContact O-N 3.21Å
207	A	64.8	Low	65.9	Low	8 Å²	8	78 Å²	78	7%	0.066	41%	0.405	C	S	.	.	H	α-helix	trans	-52.9	-45.9	-170.1	0	0	0	0	0	112.8	H203 L204 T209 D210 L211 Q230 M234	H203-A207 WeakPolarHBondContact O-CA 3.49Å; H203-A207 PolarHBondContact O-N 3.1Å; L204-A207 WeakPolarHBondContact O-CB 3.46Å; L204-A207 PolarHBondContact O-N 3.35Å; A207-T209 PolarHBondContact O-N 2.94Å; A207-D210 PolarHBondContact O-N 2.83Å; A207-L211 WeakPolarHBondContact O-CB 3.44Å; A207-L211 VanDerWaalsContact O-CD1 3.31Å; A207-L211 WeakPolarHBondContact O-CD1 3.39Å; A207-L211 WeakPolarHBondContact O-CG 3.25Å; A207-L211 PolarHBondContact O-N 3.27Å; A207-Q230 PolarHBondContact O-NE2 3.46Å; A207-M234 HydrophobicContact CB-CE 3.94Å; A207-M234 HydrophobicContact CB-CG 3.86Å; A207-M234 HydrophobicContact CB-SD 3.59Å; A207-M234 VanDerWaalsContact CB-SD 3.59Å
208	T	58.8	Low	65.1	Low	92 Å²	92	85.4 Å²	85.4	56%	0.564	44%	0.437	S	S	*	.	H	α-helix	trans	-64.1	-38.6	179	-42.7	0	0	0	0	112.7	N206 L211 M212	N206-T208 VanDerWaalsContact C-N 3.3Å; N206-T208 PolarHBondContact O-N 3.15Å; T208-L211 WeakPolarHBondContact O-CB 3.11Å; T208-M212 WeakPolarHBondContact O-CG 3.32Å; T208-M212 PolarHBondContact O-N 3.48Å
209	T	64.6	Low	64.8	Low	74 Å²	74	85.8 Å²	85.8	45%	0.454	43%	0.428	S	S	.	.	H	α-helix	trans	-74.8	-37.9	179.9	-52.1	0	0	0	0	111.5	N206 A207 M212 K213	N206-T209 PolarHBondContact O-N 3.3Å; A207-T209 PolarHBondContact O-N 2.94Å; T209-M212 PolarHBondContact O-N 3.24Å; T209-K213 WeakPolarHBondContact O-CG 3.46Å; T209-K213 PolarHBondContact O-N 3.4Å
210	D	64.8	Low	64.7	Low	41 Å²	41	86.5 Å²	86.5	22%	0.219	44%	0.44	C	S	.	.	H	α-helix	trans	-71.7	-34.3	176.5	-68.8	-16	0	0	0	110.9	N206 A207 M212 K213 L214	N206-D210 PolarHBondContact O-N 3.21Å; A207-D210 PolarHBondContact O-N 2.83Å; D210-M212 VanDerWaalsContact C-N 3.32Å; D210-M212 PolarHBondContact O-N 2.95Å; D210-K213 PolarHBondContact O-N 3.46Å; D210-K213 IonicContact OD1-NZ 3.28Å; D210-L214 PolarHBondContact O-N 2.86Å
211	L	59.9	Low	64.8	Low	32 Å²	32	93.3 Å²	93.3	17%	0.168	47%	0.471	C	S	.	.	H	α-helix	trans	-57	-42.7	170.6	-81.3	159.7	0	0	0	112	A207 T208 K213 L227 Q230	A207-L211 WeakPolarHBondContact O-CB 3.44Å; A207-L211 VanDerWaalsContact O-CD1 3.31Å; A207-L211 WeakPolarHBondContact O-CD1 3.39Å; A207-L211 WeakPolarHBondContact O-CG 3.25Å; A207-L211 PolarHBondContact O-N 3.27Å; T208-L211 WeakPolarHBondContact O-CB 3.11Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 2.98Å; L211-L227 HydrophobicContact CB-CD2 4.42Å; L211-L227 HydrophobicContact CD2-CD2 3.52Å; L211-Q230 HydrophobicContact CD1-CG 4.49Å; L211-Q230 HydrophobicContact CD2-CB 3.79Å; L211-Q230 VanDerWaalsContact CD2-CD 3.46Å; L211-Q230 HydrophobicContact CD2-CG 3.76Å; L211-Q230 VanDerWaalsContact CG-CD 3.42Å; L211-Q230 HydrophobicContact CG-CG 3.99Å
212	M	59.7	Low	64.8	Low	146 Å²	146	88.2 Å²	88.2	72%	0.719	45%	0.453	S	S	*	.	H	α-helix	trans	-71.6	-20.3	179.4	-71.8	175.6	169.7	0	0	113.7	T208 T209 D210	T208-M212 WeakPolarHBondContact O-CG 3.32Å; T208-M212 PolarHBondContact O-N 3.48Å; T209-M212 PolarHBondContact O-N 3.24Å; D210-M212 VanDerWaalsContact C-N 3.32Å; D210-M212 PolarHBondContact O-N 2.95Å
213	K	62.8	Low	64.8	Low	148 Å²	148	85.3 Å²	85.3	64%	0.643	45%	0.447	S	S	*	.	H	α-helix	trans	-88	-12	179.9	-71.7	172.6	-175.4	167	0	113.8	T209 D210 L211	T209-K213 WeakPolarHBondContact O-CG 3.46Å; T209-K213 PolarHBondContact O-N 3.4Å; D210-K213 PolarHBondContact O-N 3.46Å; D210-K213 IonicContact OD1-NZ 3.28Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 2.98Å
214	L	56.5	Low	65.2	Low	41 Å²	41	89.1 Å²	89.1	22%	0.215	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	14.2	177.2	-67.6	168.5	0	0	0	112.1	D210 H216	D210-L214 PolarHBondContact O-N 2.86Å; L214-H216 PolarHBondContact O-CD2 2.98Å; L214-H216 PolarHBondContact O-N 3.5Å
215	D	55.6	Low	65.6	Low	127 Å²	127	88.4 Å²	88.4	68%	0.679	46%	0.463	S	S	*	.			trans	-67.9	83	168.1	-134.1	-0.5	0	0	0	107.6	E217	D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 3.14Å
216	H	58.8	Low	65.9	Low	62 Å²	62	84.9 Å²	84.9	29%	0.287	43%	0.434	S	S	.	.			trans	-74.3	85.7	177.6	-67.6	-69	0	0	0	107.6	L214 E218 E219 Y226	L214-H216 PolarHBondContact O-CD2 2.98Å; L214-H216 PolarHBondContact O-N 3.5Å; H216-E218 PolarHBondContact O-N 2.91Å; H216-E219 PolarHBondContact O-N 2.94Å; H216-Y226 AromaticContact CD2-CD2 3.85Å; H216-Y226 AromaticContact CD2-CE2 3.37Å; H216-Y226 WeakPolarHBondContact CD2-CE2 3.44Å; H216-Y226 AromaticContact CD2-CZ 3.97Å; H216-Y226 AromaticContact NE2-CE2 3.66Å; H216-Y226 AromaticContact NE2-CZ 3.75Å
217	E	55.4	Low	66.2	Low	187 Å²	187	85.3 Å²	85.3	87%	0.874	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-25.3	174.9	-66.9	-175.5	166.5	0	0	112.1	D215	D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 3.14Å
218	E	59	Low	66.9	Low	186 Å²	186	87.3 Å²	87.3	87%	0.869	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-19.1	-178.6	-60.2	-171.8	164.9	0	0	115.2	H216	H216-E218 PolarHBondContact O-N 2.91Å
219	E	67.1	Low	67.9	Low	73 Å²	73	85.7 Å²	85.7	34%	0.341	43%	0.434	S	S	.	.			trans	-140	72.7	-176	-75.6	-79	-170	0	0	112.1	H216 Q221 L222	H216-E219 PolarHBondContact O-N 2.94Å; E219-Q221 PolarHBondContact O-N 2.67Å; E219-Q221 VanDerWaalsContact O-N 3.07Å; E219-L222 HydrophobicContact CB-CD1 4.32Å; E219-L222 PolarHBondContact O-N 2.86Å
220	P	69.7	Low	68.5	Low	94 Å²	94	82.8 Å²	82.8	61%	0.61	42%	0.415	S	S	*	.	H	α-helix	trans	-59.4	-27.5	-173.1	-22.8	32.1	0	0	0	114.1	L222 S223	P220-L222 VanDerWaalsContact C-N 3.25Å; P220-L222 PolarHBondContact O-N 3.5Å; P220-S223 WeakPolarHBondContact O-CB 3.45Å; P220-S223 PolarHBondContact O-N 2.79Å; P220-S223 PolarHBondContact O-OG 3.39Å
221	Q	75.6	Confident	69.2	Low	171 Å²	171	87.4 Å²	87.4	80%	0.799	43%	0.434	S	S	*	.	H	α-helix	trans	-69.3	-21.6	-176.4	-60	-176.4	23.5	0	0	113.1	E219	E219-Q221 PolarHBondContact O-N 2.67Å; E219-Q221 VanDerWaalsContact O-N 3.07Å
222	L	73.4	Confident	70.3	Confident	16 Å²	16	92.3 Å²	92.3	8%	0.084	45%	0.453	C	S	.	.	H	α-helix	trans	-93.2	-16	-179.6	-59.6	179.4	0	0	0	113	P87 M90 L94 E219 P220 E224 P225 Y226	P87-L222 HydrophobicContact CB-CD1 4.29Å; M90-L222 HydrophobicContact CB-CD1 4.39Å; M90-L222 HydrophobicContact CB-CD2 4.43Å; M90-L222 HydrophobicContact CE-CD2 4.25Å; L94-L222 HydrophobicContact CD2-CD2 3.64Å; E219-L222 HydrophobicContact CB-CD1 4.32Å; E219-L222 PolarHBondContact O-N 2.86Å; P220-L222 VanDerWaalsContact C-N 3.25Å; P220-L222 PolarHBondContact O-N 3.5Å; L222-E224 PolarHBondContact O-N 3.01Å; L222-P225 VanDerWaalsContact O-CD 3.25Å; L222-P225 WeakPolarHBondContact O-CD 3.21Å; L222-Y226 HydrophobicContact CB-CD2 4Å; L222-Y226 HydrophobicContact CB-CE2 3.53Å; L222-Y226 HydrophobicContact CD1-CE2 4.49Å; L222-Y226 WeakPolarHBondContact O-CD2 3.46Å; L222-Y226 PolarHBondContact O-N 2.8Å; L222-Y226 VanDerWaalsContact O-N 3.15Å
223	S	74.9	Confident	71.3	Confident	35 Å²	35	88.8 Å²	88.8	25%	0.245	44%	0.437	C	S	.	.	H	α-helix	trans	-56.2	-49.7	-175.2	64.4	0	0	0	0	113.6	P220 Y226 L227	P220-S223 WeakPolarHBondContact O-CB 3.45Å; P220-S223 PolarHBondContact O-N 2.79Å; P220-S223 PolarHBondContact O-OG 3.39Å; S223-Y226 PolarHBondContact O-N 2.98Å; S223-L227 WeakPolarHBondContact O-CG 3.34Å; S223-L227 PolarHBondContact O-N 3.39Å; S223-L227 VanDerWaalsContact O-N 3.12Å
224	E	79.1	Confident	72.1	Confident	151 Å²	151	82.9 Å²	82.9	71%	0.706	41%	0.412	S	S	*	.	H	α-helix	trans	-64.7	-47.5	179.7	177	177.8	-162.3	0	0	112.8	L222 Y226 L227 S228	L222-E224 PolarHBondContact O-N 3.01Å; E224-Y226 PolarHBondContact O-N 3.44Å; E224-L227 PolarHBondContact O-N 3.29Å; E224-S228 WeakPolarHBondContact O-CB 3.3Å; E224-S228 PolarHBondContact O-N 2.82Å
225	P	78	Confident	73.3	Confident	35 Å²	35	83.7 Å²	83.7	23%	0.227	43%	0.425	C	S	.	.	H	α-helix	trans	-49.1	-51	170.3	-30.6	32.9	0	0	0	114.1	M90 L222 L227 S228 K229	M90-P225 HydrophobicContact CE-CB 4.09Å; L222-P225 VanDerWaalsContact O-CD 3.25Å; L222-P225 WeakPolarHBondContact O-CD 3.21Å; P225-L227 PolarHBondContact O-N 3.35Å; P225-S228 PolarHBondContact O-N 3.45Å; P225-K229 WeakPolarHBondContact O-CB 3.49Å; P225-K229 PolarHBondContact O-N 3.05Å
226	Y	76.8	Confident	74.7	Confident	4 Å²	4	82.2 Å²	82.2	2%	0.016	41%	0.412	C	S	.	.	H	α-helix	trans	-57.3	-51.1	178.9	-74.1	-64.8	0	0	0	112.1	K85 M90 E96 H216 L222 S223 E224 S228 K229 Q230	K85-Y226 HydrophobicContact CB-CE1 3.93Å; K85-Y226 WeakPolarHBondContact O-CE1 3.45Å; K85-Y226 PolarHBondContact O-OH 3.34Å; M90-Y226 HydrophobicContact CE-CD1 4.24Å; M90-Y226 HydrophobicContact CE-CE1 4.07Å; M90-Y226 HydrophobicContact CE-CE2 4.4Å; M90-Y226 HydrophobicContact CG-CE1 4.45Å; M90-Y226 HydrophobicContact SD-CD1 3.73Å; M90-Y226 HydrophobicContact SD-CD2 4.4Å; M90-Y226 HydrophobicContact SD-CE1 3Å; M90-Y226 WeakPolarHBondContact SD-CE1 3.41Å; M90-Y226 HydrophobicContact SD-CE2 3.74Å; M90-Y226 HydrophobicContact SD-CG 4.38Å; M90-Y226 PolarHBondContact SD-OH 3.48Å; E96-Y226 WeakPolarHBondContact OE1-CA 3.16Å; E96-Y226 WeakPolarHBondContact OE1-CD1 3.36Å; H216-Y226 AromaticContact CD2-CD2 3.85Å; H216-Y226 AromaticContact CD2-CE2 3.37Å; H216-Y226 WeakPolarHBondContact CD2-CE2 3.44Å; H216-Y226 AromaticContact CD2-CZ 3.97Å; H216-Y226 AromaticContact NE2-CE2 3.66Å; H216-Y226 AromaticContact NE2-CZ 3.75Å; L222-Y226 HydrophobicContact CB-CD2 4Å; L222-Y226 HydrophobicContact CB-CE2 3.53Å; L222-Y226 HydrophobicContact CD1-CE2 4.49Å; L222-Y226 WeakPolarHBondContact O-CD2 3.46Å; L222-Y226 PolarHBondContact O-N 2.8Å; L222-Y226 VanDerWaalsContact O-N 3.15Å; S223-Y226 PolarHBondContact O-N 2.98Å; E224-Y226 PolarHBondContact O-N 3.44Å; Y226-S228 PolarHBondContact O-N 3.13Å; Y226-K229 PolarHBondContact O-N 3.05Å; Y226-Q230 WeakPolarHBondContact O-CB 3.33Å; Y226-Q230 PolarHBondContact O-N 3.04Å
227	L	75.9	Confident	75.7	Confident	68 Å²	68	79.9 Å²	79.9	36%	0.356	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-43.9	-177.2	-70	174.1	0	0	0	111.4	L211 S223 E224 P225 K231	L211-L227 HydrophobicContact CB-CD2 4.42Å; L211-L227 HydrophobicContact CD2-CD2 3.52Å; S223-L227 WeakPolarHBondContact O-CG 3.34Å; S223-L227 PolarHBondContact O-N 3.39Å; S223-L227 VanDerWaalsContact O-N 3.12Å; E224-L227 PolarHBondContact O-N 3.29Å; P225-L227 PolarHBondContact O-N 3.35Å; L227-K231 WeakPolarHBondContact O-CB 3.36Å; L227-K231 VanDerWaalsContact O-CG 3.27Å; L227-K231 WeakPolarHBondContact O-CG 3.32Å; L227-K231 PolarHBondContact O-N 3.31Å; L227-K231 VanDerWaalsContact O-N 3.12Å
228	S	78.9	Confident	77	Confident	50 Å²	50	75.8 Å²	75.8	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-45.3	178.3	-174.8	0	0	0	0	111.3	E224 P225 Y226 K232	E224-S228 WeakPolarHBondContact O-CB 3.3Å; E224-S228 PolarHBondContact O-N 2.82Å; P225-S228 PolarHBondContact O-N 3.45Å; Y226-S228 PolarHBondContact O-N 3.13Å; S228-K232 WeakPolarHBondContact O-CG 3.33Å; S228-K232 PolarHBondContact O-N 2.79Å; S228-K232 VanDerWaalsContact O-N 3.14Å
229	K	79.1	Confident	78.1	Confident	58 Å²	58	72 Å²	72	25%	0.252	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-47.1	-178.6	-168.6	75.6	-175.8	-159.5	0	111.9	G95 E96 E97 P225 Y226 K231 K232 L233	G95-K229 WeakPolarHBondContact O-CE 3.17Å; G95-K229 PolarHBondContact O-NZ 3.37Å; E96-K229 HydrophobicContact CB-CG 4.49Å; E97-K229 IonicContact OE1-NZ 2.88Å; E97-K229 PolarHBondContact OE1-NZ 3.33Å; E97-K229 IonicContact OE2-NZ 2.55Å; P225-K229 WeakPolarHBondContact O-CB 3.49Å; P225-K229 PolarHBondContact O-N 3.05Å; Y226-K229 PolarHBondContact O-N 3.05Å; K229-K231 PolarHBondContact O-N 2.65Å; K229-K232 PolarHBondContact O-N 3Å; K229-L233 PolarHBondContact O-N 3.02Å
230	Q	76.9	Confident	79.1	Confident	14 Å²	14	68.8 Å²	68.8	7%	0.065	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-39	-178.9	-176.1	168.4	3.8	0	0	111.9	A207 L211 Y226 K232 L233 M234	A207-Q230 PolarHBondContact O-NE2 3.46Å; L211-Q230 HydrophobicContact CD1-CG 4.49Å; L211-Q230 HydrophobicContact CD2-CB 3.79Å; L211-Q230 VanDerWaalsContact CD2-CD 3.46Å; L211-Q230 HydrophobicContact CD2-CG 3.76Å; L211-Q230 VanDerWaalsContact CG-CD 3.42Å; L211-Q230 HydrophobicContact CG-CG 3.99Å; Y226-Q230 WeakPolarHBondContact O-CB 3.33Å; Y226-Q230 PolarHBondContact O-N 3.04Å; Q230-K232 PolarHBondContact O-N 2.92Å; Q230-L233 PolarHBondContact O-N 3.11Å; Q230-M234 VanDerWaalsContact O-CG 3.25Å; Q230-M234 WeakPolarHBondContact O-CG 3.46Å; Q230-M234 PolarHBondContact O-N 3.05Å
231	K	80.3	Confident	79.9	Confident	138 Å²	138	66.9 Å²	66.9	60%	0.6	34%	0.338	S	S	*	.	H	α-helix	trans	-59.8	-45.7	172.7	-75.2	174.9	-177.4	176.7	0	112.1	L227 K229 M234 A235	L227-K231 WeakPolarHBondContact O-CB 3.36Å; L227-K231 VanDerWaalsContact O-CG 3.27Å; L227-K231 WeakPolarHBondContact O-CG 3.32Å; L227-K231 PolarHBondContact O-N 3.31Å; L227-K231 VanDerWaalsContact O-N 3.12Å; K229-K231 PolarHBondContact O-N 2.65Å; K231-M234 PolarHBondContact O-N 3.46Å; K231-A235 PolarHBondContact O-N 2.95Å
232	K	83.6	Confident	80.6	Confident	134 Å²	134	62.6 Å²	62.6	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-62.6	-44	177.9	-72.6	172.7	-176.6	175.8	0	112.1	S228 K229 Q230 M234 A235 K236	S228-K232 WeakPolarHBondContact O-CG 3.33Å; S228-K232 PolarHBondContact O-N 2.79Å; S228-K232 VanDerWaalsContact O-N 3.14Å; K229-K232 PolarHBondContact O-N 3Å; Q230-K232 PolarHBondContact O-N 2.92Å; K232-M234 PolarHBondContact O-N 3.38Å; K232-A235 PolarHBondContact O-N 3.47Å; K232-K236 WeakPolarHBondContact O-CG 3.37Å; K232-K236 PolarHBondContact O-N 2.93Å
233	L	80.4	Confident	81.6	Confident	72 Å²	72	63.8 Å²	63.8	38%	0.377	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-44.2	177.7	178.9	64.9	0	0	0	111.4	K229 Q230 K236 I237	K229-L233 PolarHBondContact O-N 3.02Å; Q230-L233 PolarHBondContact O-N 3.11Å; L233-K236 PolarHBondContact O-N 3.49Å; L233-I237 HydrophobicContact CD1-CD1 4.06Å; L233-I237 HydrophobicContact CD1-CG1 4.36Å; L233-I237 HydrophobicContact CG-CD1 3.93Å; L233-I237 WeakPolarHBondContact O-CG1 3.25Å; L233-I237 PolarHBondContact O-N 2.92Å
234	M	78.8	Confident	82.5	Confident	25 Å²	25	66.4 Å²	66.4	12%	0.123	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-42.8	178.6	-68.4	-63.4	146.3	0	0	112	L204 A207 Q230 K231 K232 K236 I237 L238	L204-M234 HydrophobicContact CD1-SD 3.6Å; A207-M234 HydrophobicContact CB-CE 3.94Å; A207-M234 HydrophobicContact CB-CG 3.86Å; A207-M234 HydrophobicContact CB-SD 3.59Å; A207-M234 VanDerWaalsContact CB-SD 3.59Å; Q230-M234 VanDerWaalsContact O-CG 3.25Å; Q230-M234 WeakPolarHBondContact O-CG 3.46Å; Q230-M234 PolarHBondContact O-N 3.05Å; K231-M234 PolarHBondContact O-N 3.46Å; K232-M234 PolarHBondContact O-N 3.38Å; M234-K236 VanDerWaalsContact C-N 3.34Å; M234-K236 PolarHBondContact O-N 3.33Å; M234-I237 PolarHBondContact O-N 2.71Å; M234-L238 WeakPolarHBondContact O-CG 3.15Å; M234-L238 PolarHBondContact O-N 3.01Å
235	A	82.9	Confident	83.2	Confident	58 Å²	58	62.2 Å²	62.2	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-58.8	-45.2	175.2	0	0	0	0	0	111.8	K231 K232 L238 E239	K231-A235 PolarHBondContact O-N 2.95Å; K232-A235 PolarHBondContact O-N 3.47Å; A235-L238 PolarHBondContact O-N 3.02Å; A235-E239 PolarHBondContact O-N 3.38Å
236	K	84.5	Confident	83.9	Confident	95 Å²	95	60.6 Å²	60.6	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-48	175.2	-76.7	-173.9	165.4	-155.8	0	112.5	D174 K232 L233 M234 L238 E239 H240	D174-K236 IonicContact OD2-NZ 3.53Å; D174-K236 PolarHBondContact OD2-NZ 3.07Å; K232-K236 WeakPolarHBondContact O-CG 3.37Å; K232-K236 PolarHBondContact O-N 2.93Å; L233-K236 PolarHBondContact O-N 3.49Å; M234-K236 VanDerWaalsContact C-N 3.34Å; M234-K236 PolarHBondContact O-N 3.33Å; K236-L238 VanDerWaalsContact C-N 3.27Å; K236-L238 PolarHBondContact O-N 3.23Å; K236-E239 WeakPolarHBondContact O-CB 3.35Å; K236-E239 PolarHBondContact O-N 2.9Å; K236-H240 PolarHBondContact O-CD2 3.35Å; K236-H240 PolarHBondContact O-N 3.17Å; K236-H240 PolarHBondContact O-NE2 3.41Å
237	I	79.4	Confident	84.8	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.067	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-39	-179.3	-68.6	169.5	0	0	0	111	L182 I200 L233 M234 H240 D241	L182-I237 HydrophobicContact CD1-CG2 4.26Å; I200-I237 HydrophobicContact CG2-CG2 4.02Å; L233-I237 HydrophobicContact CD1-CD1 4.06Å; L233-I237 HydrophobicContact CD1-CG1 4.36Å; L233-I237 HydrophobicContact CG-CD1 3.93Å; L233-I237 WeakPolarHBondContact O-CG1 3.25Å; L233-I237 PolarHBondContact O-N 2.92Å; M234-I237 PolarHBondContact O-N 2.71Å; I237-H240 PolarHBondContact O-N 3.15Å; I237-D241 PolarHBondContact O-N 3.42Å
238	L	82.6	Confident	85.8	Confident	102 Å²	102	69.6 Å²	69.6	53%	0.534	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-42.9	175.4	-72.4	167.8	0	0	0	112.1	L204 M234 A235 K236 H240 D241	L204-L238 HydrophobicContact CD1-CD2 4.05Å; L204-L238 HydrophobicContact CD1-CG 4.07Å; L204-L238 HydrophobicContact CD2-CD2 3.88Å; L204-L238 HydrophobicContact CG-CD2 4.48Å; M234-L238 WeakPolarHBondContact O-CG 3.15Å; M234-L238 PolarHBondContact O-N 3.01Å; A235-L238 PolarHBondContact O-N 3.02Å; K236-L238 VanDerWaalsContact C-N 3.27Å; K236-L238 PolarHBondContact O-N 3.23Å; L238-H240 VanDerWaalsContact C-N 3.28Å; L238-H240 PolarHBondContact O-N 2.75Å; L238-D241 WeakPolarHBondContact O-CB 3.38Å; L238-D241 PolarHBondContact O-N 3.08Å
239	E	83.5	Confident	86.6	Confident	105 Å²	105	67.4 Å²	67.4	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-39.2	174.2	-176	175.7	-170.1	0	0	111.5	A235 K236 D241 D242 Y245	A235-E239 PolarHBondContact O-N 3.38Å; K236-E239 WeakPolarHBondContact O-CB 3.35Å; K236-E239 PolarHBondContact O-N 2.9Å; E239-D241 PolarHBondContact O-N 3.18Å; E239-D242 PolarHBondContact O-N 3.35Å; E239-Y245 HydrophobicContact CG-CE1 4.35Å
240	H	86.3	Confident	87.5	Confident	6 Å²	6	64.9 Å²	64.9	3%	0.028	32%	0.323	C	S	.	.	H	α-helix	trans	-74.2	-10.1	180	-55.2	175.6	0	0	0	113.5	D174 A175 H178 K236 I237 L238 D242	D174-H240 PolarHBondContact O-ND1 2.88Å; D174-H240 IonicContact OD2-CE1 3.06Å; A175-H240 WeakPolarHBondContact CA-CE1 3.3Å; A175-H240 WeakPolarHBondContact CA-ND1 3.33Å; A175-H240 PolarHBondContact N-CE1 2.9Å; H178-H240 HydrophobicContact CB-CB 3.89Å; H178-H240 WeakPolarHBondContact CB-ND1 3.2Å; H178-H240 AromaticContact CG-ND1 3.59Å; H178-H240 AromaticContact ND1-CE1 3.56Å; H178-H240 AromaticContact ND1-ND1 3.02Å; H178-H240 PolarHBondContact ND1-ND1 2.78Å; K236-H240 PolarHBondContact O-CD2 3.35Å; K236-H240 PolarHBondContact O-N 3.17Å; K236-H240 PolarHBondContact O-NE2 3.41Å; I237-H240 PolarHBondContact O-N 3.15Å; L238-H240 VanDerWaalsContact C-N 3.28Å; L238-H240 PolarHBondContact O-N 2.75Å; H240-D242 VanDerWaalsContact C-N 3.29Å
241	D	86.5	Confident	88.4	Confident	55 Å²	55	65.9 Å²	65.9	29%	0.294	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-8.1	173.2	-159	27.4	0	0	0	112.3	L182 H183 I237 L238 E239 V243	L182-D241 HydrophobicContact CD1-CB 3.99Å; H183-D241 PolarHBondContact CE1-O 2.86Å; H183-D241 VanDerWaalsContact CE1-O 3.3Å; H183-D241 IonicContact CE1-OD1 3.9Å; H183-D241 PolarHBondContact CE1-OD1 3.46Å; H183-D241 VanDerWaalsContact NE2-C 3.33Å; H183-D241 WeakPolarHBondContact NE2-CA 3.39Å; H183-D241 PolarHBondContact NE2-O 2.82Å; H183-D241 IonicContact NE2-OD1 3.91Å; H183-D241 PolarHBondContact NE2-OD1 3.33Å; I237-D241 PolarHBondContact O-N 3.42Å; L238-D241 WeakPolarHBondContact O-CB 3.38Å; L238-D241 PolarHBondContact O-N 3.08Å; E239-D241 PolarHBondContact O-N 3.18Å; D241-V243 PolarHBondContact O-N 2.95Å
242	D	91.6	Very high	89.3	Confident	80 Å²	80	63.2 Å²	63.2	43%	0.428	33%	0.328	S	S	.	.			trans	-78.4	106.2	173.9	-177.5	-10.9	0	0	0	111.4	E239 H240 S244 Y245 L246	E239-D242 PolarHBondContact O-N 3.35Å; H240-D242 VanDerWaalsContact C-N 3.29Å; D242-S244 VanDerWaalsContact C-N 3.26Å; D242-S244 PolarHBondContact O-N 3.12Å; D242-S244 WeakPolarHBondContact OD1-CA 3.24Å; D242-S244 VanDerWaalsContact OD1-CB 3.31Å; D242-S244 WeakPolarHBondContact OD1-CB 3.48Å; D242-S244 PolarHBondContact OD1-N 3.38Å; D242-Y245 PolarHBondContact O-N 3.42Å; D242-Y245 PolarHBondContact OD1-N 2.95Å; D242-L246 WeakPolarHBondContact O-CB 2.94Å; D242-L246 PolarHBondContact O-N 3.42Å
243	V	92.9	Very high	90	Very high	41 Å²	41	56.9 Å²	56.9	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-34.1	177.8	179.4	0	0	0	0	112.8	H183 D241 K247	H183-V243 WeakPolarHBondContact CE1-CG2 3.18Å; H183-V243 WeakPolarHBondContact ND1-CG2 3.46Å; D241-V243 PolarHBondContact O-N 2.95Å; V243-K247 HydrophobicContact CG1-CD 4.17Å; V243-K247 HydrophobicContact CG1-CG 4.43Å; V243-K247 WeakPolarHBondContact O-CB 3.41Å; V243-K247 VanDerWaalsContact O-CG 3.29Å; V243-K247 WeakPolarHBondContact O-CG 3.5Å; V243-K247 PolarHBondContact O-N 2.95Å
244	S	94.3	Very high	90.8	Very high	90 Å²	90	54.5 Å²	54.5	63%	0.629	29%	0.291	S	S	*	.	H	α-helix	trans	-71.7	-45.1	-178.7	-55.1	0	0	0	0	110.6	D242 K247 K248	D242-S244 VanDerWaalsContact C-N 3.26Å; D242-S244 PolarHBondContact O-N 3.12Å; D242-S244 WeakPolarHBondContact OD1-CA 3.24Å; D242-S244 VanDerWaalsContact OD1-CB 3.31Å; D242-S244 WeakPolarHBondContact OD1-CB 3.48Å; D242-S244 PolarHBondContact OD1-N 3.38Å; S244-K247 PolarHBondContact O-N 3.44Å; S244-K248 PolarHBondContact O-N 3.41Å; S244-K248 VanDerWaalsContact O-N 3.1Å
245	Y	93.4	Very high	91.7	Very high	64 Å²	64	59.6 Å²	59.6	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-59	-47.3	171	171	-107.8	0	0	0	111.1	A175 E239 D242 K247 K248 I249	A175-Y245 HydrophobicContact CB-CE1 4.4Å; E239-Y245 HydrophobicContact CG-CE1 4.35Å; D242-Y245 PolarHBondContact O-N 3.42Å; D242-Y245 PolarHBondContact OD1-N 2.95Å; Y245-K247 PolarHBondContact O-N 3.21Å; Y245-K248 WeakPolarHBondContact O-CB 3.43Å; Y245-K248 PolarHBondContact O-N 2.95Å; Y245-I249 HydrophobicContact CD1-CD1 4.43Å; Y245-I249 HydrophobicContact CD2-CG2 4.21Å; Y245-I249 HydrophobicContact CE1-CD1 3.87Å; Y245-I249 HydrophobicContact CE1-CG2 4.27Å; Y245-I249 HydrophobicContact CE2-CG2 3.64Å; Y245-I249 PolarHBondContact O-N 3.04Å
246	L	94.1	Very high	92.5	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-44.5	179.7	-174.8	56.7	0	0	0	112.1	H183 L186 D242 K248 I249 L250	H183-L246 HydrophobicContact CB-CD2 4.3Å; L186-L246 HydrophobicContact CD1-CD2 3.41Å; L186-L246 VanDerWaalsContact CD1-CD2 3.41Å; L186-L246 HydrophobicContact CD1-CG 3.92Å; D242-L246 WeakPolarHBondContact O-CB 2.94Å; D242-L246 PolarHBondContact O-N 3.42Å; L246-K248 VanDerWaalsContact C-N 3.29Å; L246-K248 PolarHBondContact O-N 2.93Å; L246-I249 HydrophobicContact CD1-CD1 3.87Å; L246-I249 HydrophobicContact CD1-CG1 4.14Å; L246-I249 WeakPolarHBondContact O-CG1 3.4Å; L246-I249 PolarHBondContact O-N 3.33Å; L246-L250 HydrophobicContact CD1-CD1 4.24Å; L246-L250 HydrophobicContact CD1-CG 4.25Å; L246-L250 HydrophobicContact CG-CD1 4.02Å; L246-L250 HydrophobicContact CG-CG 4.47Å; L246-L250 VanDerWaalsContact O-CB 3.23Å; L246-L250 WeakPolarHBondContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CG 3Å; L246-L250 PolarHBondContact O-N 2.69Å
247	K	95.2	Very high	93.1	Very high	129 Å²	129	53.4 Å²	53.4	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-60.1	-38.2	174.5	-78.8	175	-179.8	175.2	0	112.4	V243 S244 Y245 G251	V243-K247 HydrophobicContact CG1-CD 4.17Å; V243-K247 HydrophobicContact CG1-CG 4.43Å; V243-K247 WeakPolarHBondContact O-CB 3.41Å; V243-K247 VanDerWaalsContact O-CG 3.29Å; V243-K247 WeakPolarHBondContact O-CG 3.5Å; V243-K247 PolarHBondContact O-N 2.95Å; S244-K247 PolarHBondContact O-N 3.44Å; Y245-K247 PolarHBondContact O-N 3.21Å; K247-G251 PolarHBondContact O-N 3.26Å
248	K	96.7	Very high	94	Very high	131 Å²	131	56.5 Å²	56.5	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-63.2	-54.8	176.6	179.1	-170.3	168.4	-167.1	0	111.1	S244 Y245 L246 L250 G251 E252	S244-K248 PolarHBondContact O-N 3.41Å; S244-K248 VanDerWaalsContact O-N 3.1Å; Y245-K248 WeakPolarHBondContact O-CB 3.43Å; Y245-K248 PolarHBondContact O-N 2.95Å; L246-K248 VanDerWaalsContact C-N 3.29Å; L246-K248 PolarHBondContact O-N 2.93Å; K248-L250 PolarHBondContact O-N 3Å; K248-G251 WeakPolarHBondContact O-CA 3.47Å; K248-G251 PolarHBondContact O-N 3.33Å; K248-E252 WeakPolarHBondContact CE-OE1 3.48Å; K248-E252 IonicContact NZ-OE1 2.72Å; K248-E252 PolarHBondContact O-N 3.35Å
249	I	96.4	Very high	94.8	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-26.8	-178.4	62.6	171.4	0	0	0	112.7	P172 A175 Y176 Y245 L246 E252 L253	P172-I249 HydrophobicContact CG-CB 4.42Å; P172-I249 HydrophobicContact CG-CD1 4.27Å; A175-I249 HydrophobicContact CB-CD1 3.47Å; A175-I249 VanDerWaalsContact CB-CD1 3.47Å; Y176-I249 HydrophobicContact CD1-CD1 3.82Å; Y176-I249 HydrophobicContact CD1-CG1 4.16Å; Y176-I249 HydrophobicContact CE1-CB 3.96Å; Y176-I249 HydrophobicContact CE1-CD1 3.69Å; Y176-I249 HydrophobicContact CE1-CG1 3.68Å; Y176-I249 PolarHBondContact OH-O 2.75Å; Y176-I249 VanDerWaalsContact OH-O 3.05Å; Y245-I249 HydrophobicContact CD1-CD1 4.43Å; Y245-I249 HydrophobicContact CD2-CG2 4.21Å; Y245-I249 HydrophobicContact CE1-CD1 3.87Å; Y245-I249 HydrophobicContact CE1-CG2 4.27Å; Y245-I249 HydrophobicContact CE2-CG2 3.64Å; Y245-I249 PolarHBondContact O-N 3.04Å; L246-I249 HydrophobicContact CD1-CD1 3.87Å; L246-I249 HydrophobicContact CD1-CG1 4.14Å; L246-I249 WeakPolarHBondContact O-CG1 3.4Å; L246-I249 PolarHBondContact O-N 3.33Å; I249-E252 PolarHBondContact O-N 3.28Å; I249-L253 PolarHBondContact O-N 3.14Å
250	L	96.8	Very high	95.5	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-29.8	170.5	-78.2	177.6	0	0	0	112.2	Y176 L186 L246 K248 L253 A254 L304 Y308	Y176-L250 HydrophobicContact CD1-CD2 3.97Å; Y176-L250 HydrophobicContact CE1-CD2 4.2Å; L186-L250 HydrophobicContact CD1-CD1 4.43Å; L246-L250 HydrophobicContact CD1-CD1 4.24Å; L246-L250 HydrophobicContact CD1-CG 4.25Å; L246-L250 HydrophobicContact CG-CD1 4.02Å; L246-L250 HydrophobicContact CG-CG 4.47Å; L246-L250 VanDerWaalsContact O-CB 3.23Å; L246-L250 WeakPolarHBondContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CG 3Å; L246-L250 PolarHBondContact O-N 2.69Å; K248-L250 PolarHBondContact O-N 3Å; L250-L253 HydrophobicContact CD2-CD2 4.22Å; L250-A254 PolarHBondContact O-N 3.4Å; L250-L304 HydrophobicContact CD2-CD1 4.01Å; L250-L304 HydrophobicContact CD2-CD2 4.42Å; L250-Y308 VanDerWaalsContact C-OH 3.32Å; L250-Y308 VanDerWaalsContact CB-OH 3.29Å; L250-Y308 WeakPolarHBondContact CB-OH 3.46Å; L250-Y308 PolarHBondContact O-OH 3.35Å
251	G	97.4	Very high	96.1	Very high	36 Å²	36	51.4 Å²	51.4	37%	0.371	27%	0.27	S	S	.	.	H	α-helix	trans	-68.3	-43.2	169	0	0	0	0	0	111.9	K247 K248 L253 A254 M255	K247-G251 PolarHBondContact O-N 3.26Å; K248-G251 WeakPolarHBondContact O-CA 3.47Å; K248-G251 PolarHBondContact O-N 3.33Å; G251-L253 VanDerWaalsContact C-N 3.32Å; G251-L253 PolarHBondContact O-N 3.5Å; G251-A254 VanDerWaalsContact O-CB 3.25Å; G251-A254 WeakPolarHBondContact O-CB 3.38Å; G251-A254 PolarHBondContact O-N 3.5Å; G251-M255 PolarHBondContact O-N 3.03Å
252	E	97.8	Very high	96.6	Very high	82 Å²	82	51.7 Å²	51.7	38%	0.383	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-39.8	174.7	-67.2	169.1	-177.3	0	0	111.6	K248 I249 A254 M255 V256	K248-E252 WeakPolarHBondContact CE-OE1 3.48Å; K248-E252 IonicContact NZ-OE1 2.72Å; K248-E252 PolarHBondContact O-N 3.35Å; I249-E252 PolarHBondContact O-N 3.28Å; E252-A254 VanDerWaalsContact C-N 3.28Å; E252-A254 PolarHBondContact O-N 3.36Å; E252-M255 WeakPolarHBondContact O-CB 3.38Å; E252-M255 PolarHBondContact O-N 3.12Å; E252-M255 VanDerWaalsContact O-N 3.13Å; E252-V256 PolarHBondContact O-N 3.02Å
253	L	98.1	Very high	96.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-55.1	-42.6	170.9	176.4	62.2	0	0	0	112.1	L171 Y176 I249 L250 G251 M255 V256 L257 L299 Y308	L171-L253 HydrophobicContact CD1-CD1 4.25Å; L171-L253 HydrophobicContact CD2-CD1 4.02Å; Y176-L253 HydrophobicContact CE2-CD1 4.35Å; Y176-L253 HydrophobicContact CE2-CD2 4.35Å; I249-L253 PolarHBondContact O-N 3.14Å; L250-L253 HydrophobicContact CD2-CD2 4.22Å; G251-L253 VanDerWaalsContact C-N 3.32Å; G251-L253 PolarHBondContact O-N 3.5Å; L253-M255 VanDerWaalsContact C-N 3.28Å; L253-M255 PolarHBondContact O-N 3.36Å; L253-V256 PolarHBondContact O-N 3.37Å; L253-L257 HydrophobicContact CD1-CD1 4.31Å; L253-L257 HydrophobicContact CD1-CG 4.15Å; L253-L257 HydrophobicContact CG-CD1 4.24Å; L253-L257 HydrophobicContact CG-CG 4.44Å; L253-L257 WeakPolarHBondContact O-CG 3.3Å; L253-L257 PolarHBondContact O-N 3.23Å; L253-L299 HydrophobicContact CD1-CD1 4.03Å; L253-L299 HydrophobicContact CD2-CD1 4.14Å; L253-L299 HydrophobicContact CD2-CD2 3.73Å; L253-Y308 HydrophobicContact CB-CE1 4.41Å; L253-Y308 HydrophobicContact CD2-CE1 4.14Å; L253-Y308 HydrophobicContact CD2-CE2 4.35Å; L253-Y308 HydrophobicContact CG-CE1 4.13Å
254	A	97.9	Very high	97.1	Very high	23 Å²	23	47.6 Å²	47.6	19%	0.19	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-43.1	178.6	0	0	0	0	0	111.1	L250 G251 E252 V256 L257 D258 Y308 R314	L250-A254 PolarHBondContact O-N 3.4Å; G251-A254 VanDerWaalsContact O-CB 3.25Å; G251-A254 WeakPolarHBondContact O-CB 3.38Å; G251-A254 PolarHBondContact O-N 3.5Å; E252-A254 VanDerWaalsContact C-N 3.28Å; E252-A254 PolarHBondContact O-N 3.36Å; A254-V256 PolarHBondContact O-N 2.89Å; A254-L257 PolarHBondContact O-N 3.04Å; A254-D258 VanDerWaalsContact O-CG 3.22Å; A254-D258 PolarHBondContact O-N 2.68Å; A254-Y308 HydrophobicContact CB-CD1 4.28Å; A254-Y308 HydrophobicContact CB-CE1 3.79Å; A254-R314 PolarHBondContact O-NH2 3.4Å
255	M	98.1	Very high	97.2	Very high	132 Å²	132	46.2 Å²	46.2	65%	0.65	24%	0.24	S	C	*	.	H	α-helix	trans	-64	-40.8	178.5	-60.7	178.3	63.1	0	0	112.1	G251 E252 L253 L257 D258 Q259	G251-M255 PolarHBondContact O-N 3.03Å; E252-M255 WeakPolarHBondContact O-CB 3.38Å; E252-M255 PolarHBondContact O-N 3.12Å; E252-M255 VanDerWaalsContact O-N 3.13Å; L253-M255 VanDerWaalsContact C-N 3.28Å; L253-M255 PolarHBondContact O-N 3.36Å; M255-L257 VanDerWaalsContact C-N 3.34Å; M255-D258 WeakPolarHBondContact O-CB 3.35Å; M255-D258 PolarHBondContact O-N 3.24Å; M255-Q259 PolarHBondContact O-N 2.98Å
256	V	98.4	Very high	97.3	Very high	22 Å²	22	48.1 Å²	48.1	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-43	175.2	172.9	0	0	0	0	110.8	L167 L171 E252 L253 A254 D258 Q259 I260	L167-V256 HydrophobicContact CD1-CG1 4.21Å; L167-V256 HydrophobicContact CD1-CG2 4.2Å; L167-V256 HydrophobicContact CD2-CG1 4.02Å; L167-V256 HydrophobicContact CG-CG1 3.9Å; L171-V256 HydrophobicContact CD2-CB 4.33Å; L171-V256 HydrophobicContact CD2-CG1 4.23Å; L171-V256 HydrophobicContact CD2-CG2 4.11Å; E252-V256 PolarHBondContact O-N 3.02Å; L253-V256 PolarHBondContact O-N 3.37Å; A254-V256 PolarHBondContact O-N 2.89Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 3.36Å; V256-Q259 WeakPolarHBondContact O-CB 3.32Å; V256-Q259 PolarHBondContact O-N 3.34Å; V256-I260 HydrophobicContact CG1-CD1 3.98Å; V256-I260 WeakPolarHBondContact O-CG1 3.27Å; V256-I260 PolarHBondContact O-N 3.45Å
257	L	98.4	Very high	97.2	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-67.8	-32.2	177	-64.7	-177.7	0	0	0	112.5	L253 A254 M255 I260 E261 L296 Y308 W309 L317	L253-L257 HydrophobicContact CD1-CD1 4.31Å; L253-L257 HydrophobicContact CD1-CG 4.15Å; L253-L257 HydrophobicContact CG-CD1 4.24Å; L253-L257 HydrophobicContact CG-CG 4.44Å; L253-L257 WeakPolarHBondContact O-CG 3.3Å; L253-L257 PolarHBondContact O-N 3.23Å; A254-L257 PolarHBondContact O-N 3.04Å; M255-L257 VanDerWaalsContact C-N 3.34Å; L257-I260 HydrophobicContact CD2-CD1 4.21Å; L257-I260 PolarHBondContact O-N 3.48Å; L257-E261 WeakPolarHBondContact O-CB 3.26Å; L257-E261 PolarHBondContact O-N 2.58Å; L257-L296 HydrophobicContact CD2-CD2 4.32Å; L257-Y308 HydrophobicContact CD1-CD1 3.78Å; L257-Y308 HydrophobicContact CD1-CG 4.05Å; L257-W309 HydrophobicContact CD1-CE3 4.39Å; L257-L317 HydrophobicContact CB-CD2 4.25Å; L257-L317 HydrophobicContact CD1-CD2 4.4Å; L257-L317 HydrophobicContact CD2-CD2 3.97Å; L257-L317 HydrophobicContact CG-CD2 4.43Å
258	D	98.5	Very high	97.1	Very high	78 Å²	78	47 Å²	47	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-64.5	-41.3	171.5	-68.3	-24.8	0	0	0	111.8	A254 M255 V256 I260 E261 A262 R314	A254-D258 VanDerWaalsContact O-CG 3.22Å; A254-D258 PolarHBondContact O-N 2.68Å; M255-D258 WeakPolarHBondContact O-CB 3.35Å; M255-D258 PolarHBondContact O-N 3.24Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 3.36Å; D258-I260 VanDerWaalsContact C-N 3.31Å; D258-I260 PolarHBondContact O-N 3.01Å; D258-E261 PolarHBondContact O-N 3.42Å; D258-A262 WeakPolarHBondContact O-CB 3.34Å; D258-A262 PolarHBondContact O-N 3.38Å; D258-R314 IonicContact OD1-CZ 3.52Å; D258-R314 IonicContact OD1-NE 3.75Å; D258-R314 PolarHBondContact OD1-NE 3.33Å; D258-R314 IonicContact OD1-NH2 3.42Å; D258-R314 PolarHBondContact OD1-NH2 3.48Å; D258-R314 IonicContact OD2-NH2 3.72Å
259	Q	98.1	Very high	96.9	Very high	83 Å²	83	45.6 Å²	45.6	39%	0.388	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-39.6	174.9	-176.3	-180	-1.3	0	0	111.8	M255 V256 E263	M255-Q259 PolarHBondContact O-N 2.98Å; V256-Q259 WeakPolarHBondContact O-CB 3.32Å; V256-Q259 PolarHBondContact O-N 3.34Å; Q259-E263 PolarHBondContact O-N 3.39Å; Q259-E263 VanDerWaalsContact O-N 3.13Å
260	I	98.4	Very high	96.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-69.5	-44.1	177.2	-67.7	162.6	0	0	0	110.9	Y164 L167 L168 V256 L257 D258 A262 E263 L264 L280 L292 L317	Y164-I260 HydrophobicContact CD1-CG1 4.27Å; Y164-I260 HydrophobicContact CE1-CG1 3.97Å; L167-I260 HydrophobicContact CD2-CG1 4.48Å; L168-I260 HydrophobicContact CD2-CD1 4.13Å; V256-I260 HydrophobicContact CG1-CD1 3.98Å; V256-I260 WeakPolarHBondContact O-CG1 3.27Å; V256-I260 PolarHBondContact O-N 3.45Å; L257-I260 HydrophobicContact CD2-CD1 4.21Å; L257-I260 PolarHBondContact O-N 3.48Å; D258-I260 VanDerWaalsContact C-N 3.31Å; D258-I260 PolarHBondContact O-N 3.01Å; I260-A262 VanDerWaalsContact C-N 3.34Å; I260-A262 PolarHBondContact O-N 2.96Å; I260-E263 PolarHBondContact O-N 3.29Å; I260-L264 HydrophobicContact CG2-CD1 4.02Å; I260-L264 HydrophobicContact CG2-CG 4.41Å; I260-L264 WeakPolarHBondContact O-CG 3.38Å; I260-L264 PolarHBondContact O-N 3.46Å; I260-L280 HydrophobicContact CG2-CD1 3.96Å; I260-L292 HydrophobicContact CD1-CD1 3.9Å; I260-L292 HydrophobicContact CG2-CD1 4.45Å; I260-L292 HydrophobicContact CG2-CD2 3.7Å; I260-L317 HydrophobicContact CG2-CD1 3.71Å
261	E	98.3	Very high	96.3	Very high	23 Å²	23	51.6 Å²	51.6	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-57.5	-47.3	175.8	178.2	63.9	-162.4	0	0	111.3	L257 D258 E263 L264 E265 R314 P315 N316 L317	L257-E261 WeakPolarHBondContact O-CB 3.26Å; L257-E261 PolarHBondContact O-N 2.58Å; D258-E261 PolarHBondContact O-N 3.42Å; E261-E263 VanDerWaalsContact C-N 3.3Å; E261-E263 PolarHBondContact O-N 3.02Å; E261-L264 PolarHBondContact O-N 2.94Å; E261-E265 PolarHBondContact O-N 3.01Å; E261-R314 HydrophobicContact CB-CB 4.38Å; E261-R314 HydrophobicContact CB-CG 4.23Å; E261-R314 HydrophobicContact CG-CB 4.19Å; E261-R314 HydrophobicContact CG-CG 4.22Å; E261-P315 WeakPolarHBondContact OE1-CD 3.45Å; E261-N316 VanDerWaalsContact OE1-CB 3.27Å; E261-N316 WeakPolarHBondContact OE1-CB 3.31Å; E261-N316 PolarHBondContact OE1-N 3.47Å; E261-N316 PolarHBondContact OE1-ND2 3.27Å; E261-N316 PolarHBondContact OE2-N 3.35Å; E261-L317 WeakPolarHBondContact OE2-CB 3.33Å; E261-L317 PolarHBondContact OE2-N 3.24Å
262	A	98.1	Very high	95.9	Very high	61 Å²	61	57.6 Å²	57.6	50%	0.504	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-38.1	177.7	0	0	0	0	0	112.3	D258 I260 K266	D258-A262 WeakPolarHBondContact O-CB 3.34Å; D258-A262 PolarHBondContact O-N 3.38Å; I260-A262 VanDerWaalsContact C-N 3.34Å; I260-A262 PolarHBondContact O-N 2.96Å; A262-K266 VanDerWaalsContact O-CB 3.31Å; A262-K266 WeakPolarHBondContact O-CB 3.39Å; A262-K266 PolarHBondContact O-N 2.65Å
263	E	97.3	Very high	95.1	Very high	24 Å²	24	57.5 Å²	57.5	11%	0.112	31%	0.311	C	S	.	.	H	α-helix	trans	-69.6	-40.4	176.6	-173	77.2	161	0	0	112.2	R160 Y164 Q259 I260 E261 K266 R267 L280	R160-E263 WeakPolarHBondContact CD-OE1 3.38Å; R160-E263 IonicContact NE-OE1 3.66Å; R160-E263 PolarHBondContact NE-OE1 3.1Å; Y164-E263 HydrophobicContact CE2-CG 3.8Å; Y164-E263 WeakPolarHBondContact OH-CB 3.36Å; Y164-E263 VanDerWaalsContact OH-CD 3.31Å; Y164-E263 WeakPolarHBondContact OH-CG 3.5Å; Q259-E263 PolarHBondContact O-N 3.39Å; Q259-E263 VanDerWaalsContact O-N 3.13Å; I260-E263 PolarHBondContact O-N 3.29Å; E261-E263 VanDerWaalsContact C-N 3.3Å; E261-E263 PolarHBondContact O-N 3.02Å; E263-K266 PolarHBondContact O-N 3.07Å; E263-R267 WeakPolarHBondContact O-CG 3.28Å; E263-R267 PolarHBondContact O-N 3.17Å; E263-R267 IonicContact OE1-CZ 2.67Å; E263-R267 IonicContact OE1-NH1 2.8Å; E263-R267 PolarHBondContact OE1-NH1 3.4Å; E263-R267 IonicContact OE2-CZ 3.46Å; E263-R267 IonicContact OE2-NH1 2.68Å; E263-R267 PolarHBondContact OE2-NH1 2.55Å; E263-R267 IonicContact OE2-NH2 3.95Å; E263-L280 HydrophobicContact CB-CD1 4.46Å; E263-L280 HydrophobicContact CG-CD1 4.29Å
264	L	97.1	Very high	94.5	Very high	11 Å²	11	62.8 Å²	62.8	6%	0.058	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175.6	-71.1	169.5	0	0	0	111.4	I260 E261 R267 K268 L280 N316 L317 F320	I260-L264 HydrophobicContact CG2-CD1 4.02Å; I260-L264 HydrophobicContact CG2-CG 4.41Å; I260-L264 WeakPolarHBondContact O-CG 3.38Å; I260-L264 PolarHBondContact O-N 3.46Å; E261-L264 PolarHBondContact O-N 2.94Å; L264-R267 PolarHBondContact O-N 2.7Å; L264-K268 WeakPolarHBondContact O-CB 3.17Å; L264-K268 PolarHBondContact O-N 3.27Å; L264-L280 HydrophobicContact CD2-CD1 4.13Å; L264-L280 HydrophobicContact CG-CD1 4.21Å; L264-N316 HydrophobicContact CB-CB 3.81Å; L264-N316 HydrophobicContact CD1-CB 4.42Å; L264-L317 HydrophobicContact CD1-CB 4.29Å; L264-L317 HydrophobicContact CD1-CD1 4.17Å; L264-F320 HydrophobicContact CD1-CB 3.97Å; L264-F320 HydrophobicContact CD1-CG 4.36Å; L264-F320 HydrophobicContact CD2-CB 4.36Å; L264-F320 HydrophobicContact CD2-CD2 4.01Å; L264-F320 HydrophobicContact CD2-CG 4.38Å
265	E	96.4	Very high	93.8	Very high	60 Å²	60	72.3 Å²	72.3	28%	0.28	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-44.3	174.5	-175.2	61.2	-154	0	0	111.1	E261 R267 K268 L269 N316	E261-E265 PolarHBondContact O-N 3.01Å; E265-R267 VanDerWaalsContact C-N 3.31Å; E265-R267 PolarHBondContact O-N 2.73Å; E265-K268 WeakPolarHBondContact O-CB 3.48Å; E265-K268 PolarHBondContact O-N 3.04Å; E265-K268 VanDerWaalsContact O-N 3.12Å; E265-K268 IonicContact OE2-NZ 2.89Å; E265-L269 HydrophobicContact CG-CD1 4.33Å; E265-L269 WeakPolarHBondContact O-CG 3.49Å; E265-L269 PolarHBondContact O-N 3.16Å; E265-N316 PolarHBondContact OE2-ND2 3.18Å; E265-N316 PolarHBondContact OE2-OD1 3.44Å
266	K	95.3	Very high	93.3	Very high	105 Å²	105	68.1 Å²	68.1	46%	0.457	36%	0.356	S	S	.	.	H	α-helix	trans	-57.6	-43.1	176	-175.8	179.8	175.6	-176.5	0	111.8	A262 E263 K268 L269 E270	A262-K266 VanDerWaalsContact O-CB 3.31Å; A262-K266 WeakPolarHBondContact O-CB 3.39Å; A262-K266 PolarHBondContact O-N 2.65Å; E263-K266 PolarHBondContact O-N 3.07Å; K266-K268 VanDerWaalsContact C-N 3.35Å; K266-L269 PolarHBondContact O-N 3.1Å; K266-E270 WeakPolarHBondContact CE-OE1 3.29Å; K266-E270 WeakPolarHBondContact CG-OE1 3.23Å; K266-E270 WeakPolarHBondContact O-CB 3.21Å; K266-E270 VanDerWaalsContact O-CG 3.32Å; K266-E270 WeakPolarHBondContact O-CG 3.2Å; K266-E270 PolarHBondContact O-N 3.48Å
267	R	92.9	Very high	92.8	Very high	2 Å²	2	71.9 Å²	71.9	1%	0.008	37%	0.372	C	S	.	.	H	α-helix	trans	-64.1	-39.9	176	-72.6	-56.7	90.7	70.8	1.5	112.7	E263 L264 E265 E270 N271	E263-R267 WeakPolarHBondContact O-CG 3.28Å; E263-R267 PolarHBondContact O-N 3.17Å; E263-R267 IonicContact OE1-CZ 2.67Å; E263-R267 IonicContact OE1-NH1 2.8Å; E263-R267 PolarHBondContact OE1-NH1 3.4Å; E263-R267 IonicContact OE2-CZ 3.46Å; E263-R267 IonicContact OE2-NH1 2.68Å; E263-R267 PolarHBondContact OE2-NH1 2.55Å; E263-R267 IonicContact OE2-NH2 3.95Å; L264-R267 PolarHBondContact O-N 2.7Å; E265-R267 VanDerWaalsContact C-N 3.31Å; E265-R267 PolarHBondContact O-N 2.73Å; R267-E270 IonicContact CZ-OE1 2.73Å; R267-E270 IonicContact CZ-OE2 2.87Å; R267-E270 IonicContact NE-OE2 3.06Å; R267-E270 PolarHBondContact NE-OE2 3.05Å; R267-E270 IonicContact NH2-OE1 3.99Å; R267-E270 PolarHBondContact NH2-OE1 2.59Å; R267-E270 IonicContact NH2-OE2 2.83Å; R267-E270 PolarHBondContact NH2-OE2 3.08Å; R267-E270 PolarHBondContact O-N 2.98Å; R267-N271 WeakPolarHBondContact O-CB 3.32Å; R267-N271 PolarHBondContact O-N 2.58Å; R267-N271 VanDerWaalsContact O-N 3.11Å; R267-N271 PolarHBondContact O-ND2 3.09Å
268	K	92.5	Very high	92.5	Very high	104 Å²	104	73.4 Å²	73.4	45%	0.452	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-44.8	177.1	-176.9	-176.7	167.8	-161.3	0	112.1	L264 E265 K266 E272 L278 N316	L264-K268 WeakPolarHBondContact O-CB 3.17Å; L264-K268 PolarHBondContact O-N 3.27Å; E265-K268 WeakPolarHBondContact O-CB 3.48Å; E265-K268 PolarHBondContact O-N 3.04Å; E265-K268 VanDerWaalsContact O-N 3.12Å; E265-K268 IonicContact OE2-NZ 2.89Å; K266-K268 VanDerWaalsContact C-N 3.35Å; K268-E272 PolarHBondContact O-N 2.93Å; K268-L278 HydrophobicContact CB-CD1 4.32Å; K268-N316 PolarHBondContact NZ-OD1 3.17Å
269	L	93.6	Very high	92.4	Very high	102 Å²	102	70 Å²	70	53%	0.534	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-44.5	176.8	-64.8	173	0	0	0	112.1	E265 K266 N271 E272	E265-L269 HydrophobicContact CG-CD1 4.33Å; E265-L269 WeakPolarHBondContact O-CG 3.49Å; E265-L269 PolarHBondContact O-N 3.16Å; K266-L269 PolarHBondContact O-N 3.1Å; L269-N271 PolarHBondContact O-N 2.94Å; L269-E272 WeakPolarHBondContact O-CB 3.36Å; L269-E272 PolarHBondContact O-N 3.27Å
270	E	91.5	Very high	92.3	Very high	105 Å²	105	66 Å²	66	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-27	-179.8	-77.1	173.2	-173.2	0	0	113.7	K266 R267	K266-E270 WeakPolarHBondContact CE-OE1 3.29Å; K266-E270 WeakPolarHBondContact CG-OE1 3.23Å; K266-E270 WeakPolarHBondContact O-CB 3.21Å; K266-E270 VanDerWaalsContact O-CG 3.32Å; K266-E270 WeakPolarHBondContact O-CG 3.2Å; K266-E270 PolarHBondContact O-N 3.48Å; R267-E270 IonicContact CZ-OE1 2.73Å; R267-E270 IonicContact CZ-OE2 2.87Å; R267-E270 IonicContact NE-OE2 3.06Å; R267-E270 PolarHBondContact NE-OE2 3.05Å; R267-E270 IonicContact NH2-OE1 3.99Å; R267-E270 PolarHBondContact NH2-OE1 2.59Å; R267-E270 IonicContact NH2-OE2 2.83Å; R267-E270 PolarHBondContact NH2-OE2 3.08Å; R267-E270 PolarHBondContact O-N 2.98Å
271	N	88.8	Confident	92.1	Very high	29 Å²	29	66.1 Å²	66.1	16%	0.155	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	19.8	-177.3	-59.7	-89.2	0	0	0	111.7	R267 L269 G273 Q274 L278	R267-N271 WeakPolarHBondContact O-CB 3.32Å; R267-N271 PolarHBondContact O-N 2.58Å; R267-N271 VanDerWaalsContact O-N 3.11Å; R267-N271 PolarHBondContact O-ND2 3.09Å; L269-N271 PolarHBondContact O-N 2.94Å; N271-G273 PolarHBondContact O-N 2.97Å; N271-Q274 HydrophobicContact CB-CB 4.46Å; N271-Q274 WeakPolarHBondContact O-CB 3.4Å; N271-Q274 PolarHBondContact O-N 3.2Å; N271-Q274 PolarHBondContact OD1-OE1 2.94Å; N271-L278 HydrophobicContact CB-CD1 4.15Å; N271-L278 HydrophobicContact CB-CD2 3.63Å; N271-L278 HydrophobicContact CB-CG 4.49Å
272	E	87.4	Confident	91.7	Very high	162 Å²	162	65.5 Å²	65.5	76%	0.757	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	126.7	176.6	-170.2	171.3	-155.5	0	0	110.2	K268 L269	K268-E272 PolarHBondContact O-N 2.93Å; L269-E272 WeakPolarHBondContact O-CB 3.36Å; L269-E272 PolarHBondContact O-N 3.27Å
273	G	82.4	Confident	91.4	Very high	80 Å²	80	65.1 Å²	65.1	83%	0.825	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	-6.9	-176.5	0	0	0	0	0	115.7	N271	N271-G273 PolarHBondContact O-N 2.97Å
274	Q	85.6	Confident	91.1	Very high	111 Å²	111	67 Å²	67	52%	0.519	36%	0.356	S	S	.	.			trans	-80.1	136.2	170.5	-65.5	-170.5	-8.8	0	0	111.3	N271 C276	N271-Q274 HydrophobicContact CB-CB 4.46Å; N271-Q274 WeakPolarHBondContact O-CB 3.4Å; N271-Q274 PolarHBondContact O-N 3.2Å; N271-Q274 PolarHBondContact OD1-OE1 2.94Å; Q274-C276 VanDerWaalsContact C-N 3.26Å; Q274-C276 PolarHBondContact O-N 3.15Å
275	K	83.6	Confident	91	Very high	224 Å²	224	67.7 Å²	67.7	97%	0.974	36%	0.358	S	S	*	.			trans	-83	69.9	171.3	-69.9	-174.1	179.3	-179.9	0	110.2
276	C	85.8	Confident	91	Very high	43 Å²	43	65.1 Å²	65.1	29%	0.291	35%	0.346	S	S	.	.	S	Bend	trans	-136.3	152.5	170.4	83	0	0	0	0	111	Q274 L278 C283	Q274-C276 VanDerWaalsContact C-N 3.26Å; Q274-C276 PolarHBondContact O-N 3.15Å; C276-L278 VanDerWaalsContact SG-CD2 3.51Å; C276-C283 HydrophobicContact CB-CB 3.56Å; C276-C283 WeakPolarHBondContact CB-SG 3.37Å; C276-C283 WeakPolarHBondContact SG-CB 3.48Å; C276-C283 CovalentContact SG-SG 2.04Å; C276-C283 PolarHBondContact SG-SG 3.14Å
277	E	88.6	Confident	91.1	Very high	102 Å²	102	60.1 Å²	60.1	48%	0.477	33%	0.325	S	S	.	.			trans	-79.5	123.5	170.2	-173.3	170.4	-135.8	0	0	108.8	W279 C283 R323	E277-W279 VanDerWaalsContact CD-CZ2 3.5Å; E277-W279 HydrophobicContact CG-CZ2 3.92Å; E277-W279 WeakPolarHBondContact OE2-CZ2 3.47Å; E277-C283 WeakPolarHBondContact O-CA 3.49Å; E277-R323 WeakPolarHBondContact OE1-CD 3.14Å
278	L	92.8	Very high	91.4	Very high	32 Å²	32	60 Å²	60	17%	0.168	32%	0.324	C	S	.	.			trans	-90.4	133.9	-174.5	-66	173.9	0	0	0	112.4	K268 N271 C276 R323	K268-L278 HydrophobicContact CB-CD1 4.32Å; N271-L278 HydrophobicContact CB-CD1 4.15Å; N271-L278 HydrophobicContact CB-CD2 3.63Å; N271-L278 HydrophobicContact CB-CG 4.49Å; C276-L278 VanDerWaalsContact SG-CD2 3.51Å; L278-R323 PolarHBondContact O-NE 3.39Å; L278-R323 PolarHBondContact O-NH2 3.38Å
279	W	96.1	Very high	91.7	Very high	7 Å²	7	55 Å²	55	3%	0.027	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-121.3	176.7	177.7	-57.6	108.7	0	0	0	110.1	E277 C281 G282 F285 D289 F320 R323 V324 R327	E277-W279 VanDerWaalsContact CD-CZ2 3.5Å; E277-W279 HydrophobicContact CG-CZ2 3.92Å; E277-W279 WeakPolarHBondContact OE2-CZ2 3.47Å; W279-C281 PolarHBondContact O-N 3.25Å; W279-G282 WeakPolarHBondContact CA-O 3.36Å; W279-G282 WeakPolarHBondContact CB-O 3.32Å; W279-G282 PolarHBondContact N-O 3.35Å; W279-G282 PolarHBondContact O-N 3.13Å; W279-F285 HydrophobicContact CD2-CB 4.47Å; W279-F285 AromaticContact CD2-CD2 3.54Å; W279-F285 HydrophobicContact CD2-CD2 3.54Å; W279-F285 HydrophobicContact CD2-CE2 4.3Å; W279-F285 HydrophobicContact CD2-CG 4.49Å; W279-F285 AromaticContact CE2-CD2 3.65Å; W279-F285 AromaticContact CE3-CD2 3.64Å; W279-F285 HydrophobicContact CE3-CD2 3.64Å; W279-F285 AromaticContact CE3-CE2 3.93Å; W279-F285 HydrophobicContact CE3-CE2 3.93Å; W279-F285 HydrophobicContact CG-CB 4.4Å; W279-F285 HydrophobicContact CG-CD2 4.1Å; W279-F285 AromaticContact CH2-CD2 3.97Å; W279-F285 HydrophobicContact CH2-CD2 3.97Å; W279-F285 HydrophobicContact CH2-CE2 4.17Å; W279-F285 AromaticContact CZ2-CD2 3.86Å; W279-F285 HydrophobicContact CZ2-CD2 3.86Å; W279-F285 AromaticContact CZ3-CD2 3.87Å; W279-F285 HydrophobicContact CZ3-CD2 3.87Å; W279-F285 AromaticContact CZ3-CE2 3.87Å; W279-F285 HydrophobicContact CZ3-CE2 3.87Å; W279-D289 WeakPolarHBondContact CB-OD1 3.4Å; W279-F320 HydrophobicContact CE3-CD2 4.09Å; W279-F320 AromaticContact CE3-CE2 3.78Å; W279-F320 HydrophobicContact CE3-CE2 3.78Å; W279-F320 HydrophobicContact CZ3-CE2 4.4Å; W279-R323 HydrophobicContact CH2-CB 3.82Å; W279-R323 HydrophobicContact CZ3-CB 3.83Å; W279-V324 HydrophobicContact CZ3-CG2 3.86Å; W279-R327 HydrophobicContact CH2-CG 4.35Å
280	L	95.9	Very high	91.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-40	-174.6	-175.5	59.7	0	0	0	111.7	Y164 I260 E263 L264 A288 D289 L292 F320	Y164-L280 HydrophobicContact CD1-CD1 4.41Å; Y164-L280 HydrophobicContact CD1-CD2 3.78Å; Y164-L280 HydrophobicContact CD1-CG 4.37Å; Y164-L280 HydrophobicContact CD2-CD2 4.09Å; Y164-L280 HydrophobicContact CD2-CG 4.12Å; Y164-L280 HydrophobicContact CE1-CD1 4.27Å; Y164-L280 HydrophobicContact CE1-CD2 4.45Å; Y164-L280 HydrophobicContact CE2-CD1 4.47Å; Y164-L280 HydrophobicContact CE2-CG 4.41Å; Y164-L280 HydrophobicContact CG-CD2 3.6Å; Y164-L280 HydrophobicContact CG-CG 4.12Å; I260-L280 HydrophobicContact CG2-CD1 3.96Å; E263-L280 HydrophobicContact CB-CD1 4.46Å; E263-L280 HydrophobicContact CG-CD1 4.29Å; L264-L280 HydrophobicContact CD2-CD1 4.13Å; L264-L280 HydrophobicContact CG-CD1 4.21Å; L280-A288 HydrophobicContact CD2-CB 4.14Å; L280-D289 WeakPolarHBondContact CB-OD1 3.32Å; L280-D289 PolarHBondContact N-OD1 3.33Å; L280-L292 HydrophobicContact CD1-CD2 4.45Å; L280-L292 HydrophobicContact CD2-CD2 3.95Å; L280-F320 HydrophobicContact CB-CE2 4.47Å
281	C	93.6	Very high	92.2	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.3	-175.9	-65.2	0	0	0	0	115.3	R160 V161 W279 T286	R160-C281 HydrophobicContact CG-CB 4.42Å; R160-C281 PolarHBondContact NH1-O 3.4Å; V161-C281 HydrophobicContact CG2-CB 3.88Å; V161-C281 VanDerWaalsContact CG2-SG 3.58Å; W279-C281 PolarHBondContact O-N 3.25Å; C281-T286 HydrophobicContact CB-CG2 4.34Å
282	G	91.1	Very high	92.7	Very high	10 Å²	10	44 Å²	44	10%	0.103	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	140.6	-152.3	179.7	0	0	0	0	0	113	W279 A284	W279-G282 WeakPolarHBondContact CA-O 3.36Å; W279-G282 WeakPolarHBondContact CB-O 3.32Å; W279-G282 PolarHBondContact N-O 3.35Å; W279-G282 PolarHBondContact O-N 3.13Å; G282-A284 VanDerWaalsContact C-N 3.3Å; G282-A284 PolarHBondContact O-N 2.96Å
283	C	91.3	Very high	93.2	Very high	52 Å²	52	36.3 Å²	36.3	35%	0.351	21%	0.212	S	C	.	.	S	Bend	trans	-75	-15.8	179.2	-62.4	0	0	0	0	114.3	C276 E277	C276-C283 HydrophobicContact CB-CB 3.56Å; C276-C283 WeakPolarHBondContact CB-SG 3.37Å; C276-C283 WeakPolarHBondContact SG-CB 3.48Å; C276-C283 CovalentContact SG-SG 2.04Å; C276-C283 PolarHBondContact SG-SG 3.14Å; E277-C283 WeakPolarHBondContact O-CA 3.49Å
284	A	91.4	Very high	93.9	Very high	64 Å²	64	32.5 Å²	32.5	53%	0.529	17%	0.172	S	C	.	.	S	Bend	trans	-95.1	138.7	178.8	0	0	0	0	0	110.1	G282	G282-A284 VanDerWaalsContact C-N 3.3Å; G282-A284 PolarHBondContact O-N 2.96Å
285	F	95	Very high	94.5	Very high	25 Å²	25	27.2 Å²	27.2	11%	0.11	15%	0.148	C	C	.	.			trans	-79.1	126.9	172.2	-171.1	-98.5	0	0	0	109.4	E67 L149 W279 D289 V290 V324 R327	E67-F285 HydrophobicContact CG-CE1 4.02Å; E67-F285 WeakPolarHBondContact OE1-CE1 3.09Å; L149-F285 HydrophobicContact CD2-CD1 4.25Å; W279-F285 HydrophobicContact CD2-CB 4.47Å; W279-F285 AromaticContact CD2-CD2 3.54Å; W279-F285 HydrophobicContact CD2-CD2 3.54Å; W279-F285 HydrophobicContact CD2-CE2 4.3Å; W279-F285 HydrophobicContact CD2-CG 4.49Å; W279-F285 AromaticContact CE2-CD2 3.65Å; W279-F285 AromaticContact CE3-CD2 3.64Å; W279-F285 HydrophobicContact CE3-CD2 3.64Å; W279-F285 AromaticContact CE3-CE2 3.93Å; W279-F285 HydrophobicContact CE3-CE2 3.93Å; W279-F285 HydrophobicContact CG-CB 4.4Å; W279-F285 HydrophobicContact CG-CD2 4.1Å; W279-F285 AromaticContact CH2-CD2 3.97Å; W279-F285 HydrophobicContact CH2-CD2 3.97Å; W279-F285 HydrophobicContact CH2-CE2 4.17Å; W279-F285 AromaticContact CZ2-CD2 3.86Å; W279-F285 HydrophobicContact CZ2-CD2 3.86Å; W279-F285 AromaticContact CZ3-CD2 3.87Å; W279-F285 HydrophobicContact CZ3-CD2 3.87Å; W279-F285 AromaticContact CZ3-CE2 3.87Å; W279-F285 HydrophobicContact CZ3-CE2 3.87Å; F285-D289 HydrophobicContact CD2-CB 3.63Å; F285-D289 HydrophobicContact CE1-CB 4.48Å; F285-D289 HydrophobicContact CE2-CB 3.35Å; F285-D289 HydrophobicContact CG-CB 4.32Å; F285-D289 HydrophobicContact CZ-CB 3.83Å; F285-V290 HydrophobicContact CD1-CG2 4.42Å; F285-V290 HydrophobicContact CE1-CG2 3.44Å; F285-V290 VanDerWaalsContact CE1-CG2 3.44Å; F285-V290 HydrophobicContact CZ-CG2 3.88Å; F285-V324 HydrophobicContact CE2-CG2 4.39Å; F285-R327 VanDerWaalsContact CZ-CD 3.49Å
286	T	96.5	Very high	95.1	Very high	6 Å²	6	16.5 Å²	16.5	4%	0.037	10%	0.101	C	C	.	.			trans	-128.1	175.8	-168.8	64.2	0	0	0	0	112.4	L149 P151 V161 C281 A288 D289 V290	L149-T286 CarbonylContact O-C 3.52Å; L149-T286 VanDerWaalsContact O-CA 3.23Å; L149-T286 WeakPolarHBondContact O-CA 3.42Å; L149-T286 WeakPolarHBondContact O-CB 3.38Å; P151-T286 HydrophobicContact CG-CG2 4.07Å; V161-T286 HydrophobicContact CG2-CG2 3.85Å; C281-T286 HydrophobicContact CB-CG2 4.34Å; T286-A288 PolarHBondContact O-N 3.08Å; T286-D289 PolarHBondContact N-OD2 2.77Å; T286-D289 WeakPolarHBondContact O-CB 3.4Å; T286-D289 PolarHBondContact O-N 3.17Å; T286-D289 VanDerWaalsContact O-N 3.07Å; T286-D289 PolarHBondContact OG1-OD2 2.99Å; T286-V290 PolarHBondContact O-N 2.72Å
287	L	97.4	Very high	95.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-56.9	-37.8	175.1	179.7	61.3	0	0	0	112.1	V64 I115 L149 M150 V161 D289 V290 L291	V64-L287 HydrophobicContact CG2-CD1 3.71Å; I115-L287 HydrophobicContact CG2-CD1 3.76Å; I115-L287 HydrophobicContact CG2-CD2 3.72Å; I115-L287 HydrophobicContact CG2-CG 4.42Å; L149-L287 HydrophobicContact CB-CB 4.16Å; L149-L287 PolarHBondContact O-N 3.42Å; M150-L287 HydrophobicContact CG-CD2 4.42Å; M150-L287 HydrophobicContact SD-CB 3.83Å; M150-L287 HydrophobicContact SD-CD2 3.6Å; M150-L287 HydrophobicContact SD-CG 4.37Å; V161-L287 HydrophobicContact CG1-CB 4.15Å; L287-D289 PolarHBondContact O-N 3.31Å; L287-V290 WeakPolarHBondContact O-CB 3.25Å; L287-V290 PolarHBondContact O-N 3.36Å; L287-V290 VanDerWaalsContact O-N 3.16Å; L287-L291 HydrophobicContact CD1-CD1 4.38Å; L287-L291 HydrophobicContact CD1-CD2 4.48Å; L287-L291 HydrophobicContact CD1-CG 4.14Å; L287-L291 HydrophobicContact CG-CD1 4.05Å; L287-L291 HydrophobicContact CG-CG 4.25Å; L287-L291 WeakPolarHBondContact O-CG 3.17Å; L287-L291 PolarHBondContact O-N 2.95Å
288	A	98	Very high	95.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.9	-34.4	178.5	0	0	0	0	0	111.9	V161 L280 T286 L292	V161-A288 HydrophobicContact CG1-CB 4.24Å; V161-A288 HydrophobicContact CG2-CB 4.4Å; L280-A288 HydrophobicContact CD2-CB 4.14Å; T286-A288 PolarHBondContact O-N 3.08Å; A288-L292 VanDerWaalsContact O-CB 3.28Å; A288-L292 WeakPolarHBondContact O-CB 3.33Å; A288-L292 PolarHBondContact O-N 3.45Å
289	D	98.4	Very high	96.1	Very high	0 Å²	0	10 Å²	10	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-72.3	-38	177.5	-54.5	-66	0	0	0	112	W279 L280 F285 T286 L287 G293 F320	W279-D289 WeakPolarHBondContact CB-OD1 3.4Å; L280-D289 WeakPolarHBondContact CB-OD1 3.32Å; L280-D289 PolarHBondContact N-OD1 3.33Å; F285-D289 HydrophobicContact CD2-CB 3.63Å; F285-D289 HydrophobicContact CE1-CB 4.48Å; F285-D289 HydrophobicContact CE2-CB 3.35Å; F285-D289 HydrophobicContact CG-CB 4.32Å; F285-D289 HydrophobicContact CZ-CB 3.83Å; T286-D289 PolarHBondContact N-OD2 2.77Å; T286-D289 WeakPolarHBondContact O-CB 3.4Å; T286-D289 PolarHBondContact O-N 3.17Å; T286-D289 VanDerWaalsContact O-N 3.07Å; T286-D289 PolarHBondContact OG1-OD2 2.99Å; L287-D289 PolarHBondContact O-N 3.31Å; D289-G293 PolarHBondContact O-N 3.44Å; D289-F320 HydrophobicContact CB-CE2 4.23Å; D289-F320 HydrophobicContact CB-CZ 4.1Å; D289-F320 WeakPolarHBondContact OD1-CE2 3.1Å
290	V	98.1	Very high	96	Very high	4 Å²	4	12.2 Å²	12.2	2%	0.024	8%	0.075	C	C	.	.	H	α-helix	trans	-61	-48.7	173.2	175	0	0	0	0	110.7	L63 V64 E67 L149 F285 T286 L287 G293 A294	L63-V290 HydrophobicContact CB-CG1 3.59Å; L63-V290 HydrophobicContact CD1-CG1 4.2Å; V64-V290 HydrophobicContact CG2-CG1 4.02Å; E67-V290 HydrophobicContact CG-CG2 4.04Å; L149-V290 HydrophobicContact CD1-CG2 4.35Å; L149-V290 HydrophobicContact CD2-CG2 4.46Å; F285-V290 HydrophobicContact CD1-CG2 4.42Å; F285-V290 HydrophobicContact CE1-CG2 3.44Å; F285-V290 VanDerWaalsContact CE1-CG2 3.44Å; F285-V290 HydrophobicContact CZ-CG2 3.88Å; T286-V290 PolarHBondContact O-N 2.72Å; L287-V290 WeakPolarHBondContact O-CB 3.25Å; L287-V290 PolarHBondContact O-N 3.36Å; L287-V290 VanDerWaalsContact O-N 3.16Å; V290-G293 PolarHBondContact O-N 3.23Å; V290-A294 PolarHBondContact O-N 3.34Å
291	L	98.2	Very high	95.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.7	-44.9	-179.5	-65	178.5	0	0	0	111.3	K60 I115 R165 L168 L287 G293 A294 T295	K60-L291 HydrophobicContact CB-CD2 4.23Å; K60-L291 HydrophobicContact CD-CD2 3.67Å; K60-L291 HydrophobicContact CG-CD2 3.89Å; I115-L291 HydrophobicContact CD1-CD2 4.33Å; R165-L291 HydrophobicContact CB-CD1 4.03Å; R165-L291 HydrophobicContact CG-CD1 3.7Å; L168-L291 HydrophobicContact CD1-CB 3.87Å; L287-L291 HydrophobicContact CD1-CD1 4.38Å; L287-L291 HydrophobicContact CD1-CD2 4.48Å; L287-L291 HydrophobicContact CD1-CG 4.14Å; L287-L291 HydrophobicContact CG-CD1 4.05Å; L287-L291 HydrophobicContact CG-CG 4.25Å; L287-L291 WeakPolarHBondContact O-CG 3.17Å; L287-L291 PolarHBondContact O-N 2.95Å; L291-G293 VanDerWaalsContact C-N 3.32Å; L291-G293 PolarHBondContact O-N 3.01Å; L291-A294 PolarHBondContact O-N 3.32Å; L291-T295 PolarHBondContact O-N 3.42Å; L291-T295 PolarHBondContact O-OG1 2.96Å; L291-T295 VanDerWaalsContact O-OG1 3.09Å
292	L	98.6	Very high	95.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-43.5	176.3	-179.7	56	0	0	0	110.9	L168 I260 L280 A288 A294 T295 L296 L317 F320	L168-L292 HydrophobicContact CD1-CB 3.9Å; L168-L292 HydrophobicContact CD2-CD1 3.93Å; I260-L292 HydrophobicContact CD1-CD1 3.9Å; I260-L292 HydrophobicContact CG2-CD1 4.45Å; I260-L292 HydrophobicContact CG2-CD2 3.7Å; L280-L292 HydrophobicContact CD1-CD2 4.45Å; L280-L292 HydrophobicContact CD2-CD2 3.95Å; A288-L292 VanDerWaalsContact O-CB 3.28Å; A288-L292 WeakPolarHBondContact O-CB 3.33Å; A288-L292 PolarHBondContact O-N 3.45Å; L292-A294 PolarHBondContact O-N 3.01Å; L292-T295 PolarHBondContact O-N 3.32Å; L292-L296 HydrophobicContact CD1-CD1 3.94Å; L292-L296 HydrophobicContact CD1-CD2 4.4Å; L292-L296 HydrophobicContact CD1-CG 3.9Å; L292-L296 HydrophobicContact CG-CD1 3.86Å; L292-L296 HydrophobicContact CG-CG 4.27Å; L292-L296 WeakPolarHBondContact O-CB 3.36Å; L292-L296 VanDerWaalsContact O-CG 3.3Å; L292-L296 WeakPolarHBondContact O-CG 3.47Å; L292-L296 PolarHBondContact O-N 2.69Å; L292-L317 HydrophobicContact CD1-CD1 4.49Å; L292-L317 HydrophobicContact CD2-CD1 4.32Å; L292-F320 HydrophobicContact CB-CE1 4.07Å; L292-F320 HydrophobicContact CB-CZ 4.14Å; L292-F320 HydrophobicContact CD2-CD1 3.88Å; L292-F320 HydrophobicContact CD2-CE1 3.42Å; L292-F320 VanDerWaalsContact CD2-CE1 3.42Å; L292-F320 HydrophobicContact CD2-CE2 4.36Å; L292-F320 HydrophobicContact CD2-CZ 3.69Å; L292-F320 HydrophobicContact CG-CD1 4.28Å; L292-F320 HydrophobicContact CG-CE1 3.55Å; L292-F320 HydrophobicContact CG-CZ 4.04Å
293	G	98	Very high	95.7	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-56.3	-47.4	174.5	0	0	0	0	0	113.1	D289 V290 L291 H297	D289-G293 PolarHBondContact O-N 3.44Å; V290-G293 PolarHBondContact O-N 3.23Å; L291-G293 VanDerWaalsContact C-N 3.32Å; L291-G293 PolarHBondContact O-N 3.01Å; G293-H297 WeakPolarHBondContact O-CB 3.36Å; G293-H297 PolarHBondContact O-N 3.39Å
294	A	97.3	Very high	96	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.8	-44.4	176.2	0	0	0	0	0	111.6	F56 K60 L63 V290 L291 L292 H297 R298	F56-A294 HydrophobicContact CE2-CB 4.17Å; K60-A294 HydrophobicContact CG-CB 4.14Å; L63-A294 HydrophobicContact CD1-CB 3.81Å; V290-A294 PolarHBondContact O-N 3.34Å; L291-A294 PolarHBondContact O-N 3.32Å; L292-A294 PolarHBondContact O-N 3.01Å; A294-H297 WeakPolarHBondContact O-CB 3.2Å; A294-H297 PolarHBondContact O-N 3.33Å; A294-R298 PolarHBondContact O-N 2.97Å
295	T	97.9	Very high	96.1	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-61.4	-51	178	-64	0	0	0	0	111.3	L168 L171 M173 L291 L292 H297 R298 L299	L168-T295 HydrophobicContact CD2-CG2 4.45Å; L171-T295 HydrophobicContact CD1-CG2 3.84Å; M173-T295 HydrophobicContact SD-CG2 4.23Å; L291-T295 PolarHBondContact O-N 3.42Å; L291-T295 PolarHBondContact O-OG1 2.96Å; L291-T295 VanDerWaalsContact O-OG1 3.09Å; L292-T295 PolarHBondContact O-N 3.32Å; T295-H297 VanDerWaalsContact C-N 3.29Å; T295-H297 PolarHBondContact O-N 2.95Å; T295-R298 WeakPolarHBondContact O-CB 3.5Å; T295-R298 PolarHBondContact O-N 3.27Å; T295-R298 VanDerWaalsContact O-N 3.08Å; T295-L299 HydrophobicContact CG2-CD1 4Å; T295-L299 HydrophobicContact CG2-CG 4.33Å; T295-L299 WeakPolarHBondContact O-CG 3.43Å; T295-L299 PolarHBondContact O-N 3.02Å
296	L	97.8	Very high	96.1	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.9	-37.9	178.8	-67.1	173.4	0	0	0	111.8	L257 L292 L299 K300 W309 L317 F320 F321	L257-L296 HydrophobicContact CD2-CD2 4.32Å; L292-L296 HydrophobicContact CD1-CD1 3.94Å; L292-L296 HydrophobicContact CD1-CD2 4.4Å; L292-L296 HydrophobicContact CD1-CG 3.9Å; L292-L296 HydrophobicContact CG-CD1 3.86Å; L292-L296 HydrophobicContact CG-CG 4.27Å; L292-L296 WeakPolarHBondContact O-CB 3.36Å; L292-L296 VanDerWaalsContact O-CG 3.3Å; L292-L296 WeakPolarHBondContact O-CG 3.47Å; L292-L296 PolarHBondContact O-N 2.69Å; L296-L299 PolarHBondContact O-N 2.85Å; L296-K300 WeakPolarHBondContact O-CB 3.44Å; L296-K300 PolarHBondContact O-N 3.47Å; L296-W309 HydrophobicContact CD2-CE3 4.22Å; L296-W309 HydrophobicContact CD2-CH2 4.19Å; L296-W309 HydrophobicContact CD2-CZ2 4.48Å; L296-W309 HydrophobicContact CD2-CZ3 4.05Å; L296-L317 HydrophobicContact CD1-CD1 3.79Å; L296-L317 HydrophobicContact CD1-CG 4.3Å; L296-L317 HydrophobicContact CD2-CD1 4.12Å; L296-L317 HydrophobicContact CD2-CD2 4.12Å; L296-L317 HydrophobicContact CD2-CG 4.22Å; L296-F320 HydrophobicContact CD1-CD1 3.92Å; L296-F320 HydrophobicContact CD1-CE1 4.05Å; L296-F321 HydrophobicContact CB-CD2 3.46Å; L296-F321 VanDerWaalsContact CB-CD2 3.46Å; L296-F321 HydrophobicContact CB-CE2 3.58Å; L296-F321 HydrophobicContact CB-CG 4Å; L296-F321 HydrophobicContact CB-CZ 4.19Å; L296-F321 HydrophobicContact CD1-CB 3.89Å; L296-F321 HydrophobicContact CD1-CD2 3.86Å; L296-F321 HydrophobicContact CD1-CG 4.08Å; L296-F321 HydrophobicContact CG-CD2 4.32Å
297	H	95.8	Very high	96	Very high	21 Å²	21	17 Å²	17	10%	0.097	8%	0.076	C	C	.	.	H	α-helix	trans	-60	-46.8	172.1	-178.5	-96.5	0	0	0	112	G293 A294 T295 K300 F301 F321 F330 L334	G293-H297 WeakPolarHBondContact O-CB 3.36Å; G293-H297 PolarHBondContact O-N 3.39Å; A294-H297 WeakPolarHBondContact O-CB 3.2Å; A294-H297 PolarHBondContact O-N 3.33Å; T295-H297 VanDerWaalsContact C-N 3.29Å; T295-H297 PolarHBondContact O-N 2.95Å; H297-K300 PolarHBondContact O-N 3.44Å; H297-F301 WeakPolarHBondContact O-CB 3.34Å; H297-F301 PolarHBondContact O-N 3.31Å; H297-F321 HydrophobicContact CB-CE2 4.3Å; H297-F321 HydrophobicContact CB-CZ 4.24Å; H297-F330 HydrophobicContact CB-CE2 4.17Å; H297-F330 HydrophobicContact CB-CZ 3.84Å; H297-F330 AromaticContact CD2-CZ 3.71Å; H297-F330 AromaticContact CG-CZ 3.99Å; H297-L334 HydrophobicContact CB-CD1 4.04Å
298	R	95.2	Very high	96	Very high	18 Å²	18	17.3 Å²	17.3	7%	0.068	8%	0.077	C	C	.	.	H	α-helix	trans	-62.6	-45.7	177.1	-179.3	56.8	59.1	140.5	-2.4	111.5	Q54 F56 M173 A294 T295 K300 F301 L302	Q54-R298 PolarHBondContact O-NH2 3.08Å; F56-R298 HydrophobicContact CD2-CB 3.85Å; F56-R298 HydrophobicContact CD2-CG 4.06Å; F56-R298 HydrophobicContact CE2-CB 3.83Å; F56-R298 HydrophobicContact CE2-CG 4.36Å; M173-R298 HydrophobicContact CE-CB 3.69Å; M173-R298 HydrophobicContact CE-CG 3.22Å; A294-R298 PolarHBondContact O-N 2.97Å; T295-R298 WeakPolarHBondContact O-CB 3.5Å; T295-R298 PolarHBondContact O-N 3.27Å; T295-R298 VanDerWaalsContact O-N 3.08Å; R298-K300 VanDerWaalsContact C-N 3.3Å; R298-K300 PolarHBondContact O-N 3.05Å; R298-F301 WeakPolarHBondContact O-CB 3.29Å; R298-F301 PolarHBondContact O-N 3.02Å; R298-L302 HydrophobicContact CG-CD1 4.32Å; R298-L302 VanDerWaalsContact O-CG 3.3Å; R298-L302 WeakPolarHBondContact O-CG 3.38Å; R298-L302 PolarHBondContact O-N 3.14Å
299	L	95.9	Very high	95.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.3	-38	178.2	-66.1	176.2	0	0	0	111.9	M173 Y176 L253 T295 L296 L302 G303 L304 W309	M173-L299 HydrophobicContact CE-CD2 4.23Å; Y176-L299 HydrophobicContact CD2-CD2 4.33Å; L253-L299 HydrophobicContact CD1-CD1 4.03Å; L253-L299 HydrophobicContact CD2-CD1 4.14Å; L253-L299 HydrophobicContact CD2-CD2 3.73Å; T295-L299 HydrophobicContact CG2-CD1 4Å; T295-L299 HydrophobicContact CG2-CG 4.33Å; T295-L299 WeakPolarHBondContact O-CG 3.43Å; T295-L299 PolarHBondContact O-N 3.02Å; L296-L299 PolarHBondContact O-N 2.85Å; L299-L302 PolarHBondContact O-N 3.22Å; L299-G303 PolarHBondContact O-N 3.18Å; L299-L304 HydrophobicContact CB-CB 4.46Å; L299-L304 HydrophobicContact CD2-CD1 3.78Å; L299-L304 WeakPolarHBondContact O-CB 3.31Å; L299-L304 PolarHBondContact O-N 2.86Å; L299-W309 HydrophobicContact CB-CH2 3.68Å; L299-W309 HydrophobicContact CB-CZ3 3.93Å; L299-W309 HydrophobicContact CD1-CZ3 4.2Å
300	K	94.6	Very high	95.8	Very high	54 Å²	54	20.5 Å²	20.5	24%	0.235	9%	0.092	C	C	.	.	H	α-helix	trans	-64.8	-44.2	172.3	-175.3	160.4	-176.1	146.2	0	112.1	M191 L296 H297 R298 L302 G303 W309 E310 F321	M191-K300 HydrophobicContact CE-CG 4.14Å; L296-K300 WeakPolarHBondContact O-CB 3.44Å; L296-K300 PolarHBondContact O-N 3.47Å; H297-K300 PolarHBondContact O-N 3.44Å; R298-K300 VanDerWaalsContact C-N 3.3Å; R298-K300 PolarHBondContact O-N 3.05Å; K300-L302 PolarHBondContact O-N 3.44Å; K300-G303 PolarHBondContact O-N 3.3Å; K300-W309 HydrophobicContact CB-CH2 4.44Å; K300-W309 HydrophobicContact CB-CZ2 4.16Å; K300-E310 IonicContact NZ-OE1 2.84Å; K300-E310 PolarHBondContact NZ-OE1 3.37Å; K300-F321 HydrophobicContact CD-CE1 3.84Å
301	F	90.8	Very high	95.5	Very high	25 Å²	25	25.1 Å²	25.1	11%	0.11	12%	0.116	C	C	.	.	H	α-helix	trans	-57	-39.1	174.3	171.9	-92.8	0	0	0	112.1	S190 M191 I192 H297 R298 G303 T340	S190-F301 PolarHBondContact OG-O 3.18Å; M191-F301 HydrophobicContact CB-CD2 3.59Å; M191-F301 HydrophobicContact CB-CE2 3.85Å; M191-F301 HydrophobicContact CB-CG 4.36Å; M191-F301 HydrophobicContact CG-CD2 4.49Å; M191-F301 PolarHBondContact N-O 2.91Å; M191-F301 HydrophobicContact SD-CD2 4.33Å; I192-F301 HydrophobicContact CG1-CD1 4.45Å; I192-F301 HydrophobicContact CG1-CE1 3.81Å; I192-F301 HydrophobicContact CG1-CZ 4.18Å; H297-F301 WeakPolarHBondContact O-CB 3.34Å; H297-F301 PolarHBondContact O-N 3.31Å; R298-F301 WeakPolarHBondContact O-CB 3.29Å; R298-F301 PolarHBondContact O-N 3.02Å; F301-G303 PolarHBondContact O-N 2.92Å; F301-T340 HydrophobicContact CE2-CG2 4.47Å
302	L	90.9	Very high	95.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-6.9	177.1	-63.4	177.1	0	0	0	113.8	T177 C180 T187 S190 I192 R298 L299 K300 L304	T177-L302 HydrophobicContact CG2-CD2 4.36Å; C180-L302 HydrophobicContact CB-CB 4.37Å; C180-L302 HydrophobicContact CB-CD2 4.28Å; T187-L302 WeakPolarHBondContact CB-O 3.4Å; T187-L302 WeakPolarHBondContact CG2-O 3.13Å; S190-L302 PolarHBondContact OG-O 3.34Å; I192-L302 HydrophobicContact CD1-CD2 3.78Å; I192-L302 HydrophobicContact CG1-CD2 4.41Å; R298-L302 HydrophobicContact CG-CD1 4.32Å; R298-L302 VanDerWaalsContact O-CG 3.3Å; R298-L302 WeakPolarHBondContact O-CG 3.38Å; R298-L302 PolarHBondContact O-N 3.14Å; L299-L302 PolarHBondContact O-N 3.22Å; K300-L302 PolarHBondContact O-N 3.44Å; L302-L304 HydrophobicContact CB-CD1 4.18Å; L302-L304 HydrophobicContact CB-CG 4.16Å; L302-L304 HydrophobicContact CD1-CD1 4.37Å
303	G	93.6	Very high	95.1	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.031	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	29.3	-177.6	0	0	0	0	0	113.7	T188 L299 K300 F301	T188-G303 PolarHBondContact N-O 3.3Å; T188-G303 CarbonylContact O-C 3.35Å; T188-G303 WeakPolarHBondContact O-CA 3.1Å; L299-G303 PolarHBondContact O-N 3.18Å; K300-G303 PolarHBondContact O-N 3.3Å; F301-G303 PolarHBondContact O-N 2.92Å
304	L	95.8	Very high	95.1	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.162	C	C	.	.			trans	-98.2	-15.4	179.1	-60.3	175	0	0	0	112.2	T187 L250 L299 L302 K306 K307 Y308	T187-L304 HydrophobicContact CG2-CD2 4.49Å; L250-L304 HydrophobicContact CD2-CD1 4.01Å; L250-L304 HydrophobicContact CD2-CD2 4.42Å; L299-L304 HydrophobicContact CB-CB 4.46Å; L299-L304 HydrophobicContact CD2-CD1 3.78Å; L299-L304 WeakPolarHBondContact O-CB 3.31Å; L299-L304 PolarHBondContact O-N 2.86Å; L302-L304 HydrophobicContact CB-CD1 4.18Å; L302-L304 HydrophobicContact CB-CG 4.16Å; L302-L304 HydrophobicContact CD1-CD1 4.37Å; L304-K306 PolarHBondContact O-N 3.28Å; L304-K307 PolarHBondContact O-N 3.25Å; L304-K307 VanDerWaalsContact O-N 3.14Å; L304-Y308 HydrophobicContact CB-CD2 3.86Å; L304-Y308 HydrophobicContact CB-CE2 4.1Å; L304-Y308 HydrophobicContact CD2-CE2 4.2Å; L304-Y308 VanDerWaalsContact O-CD2 3.28Å; L304-Y308 WeakPolarHBondContact O-CD2 3.48Å; L304-Y308 PolarHBondContact O-N 3.25Å
305	S	95.4	Very high	95.2	Very high	7 Å²	7	34.5 Å²	34.5	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-55.8	-44.2	-172.3	61.2	0	0	0	0	114.5	K307 Y308 W309 E310	S305-K307 VanDerWaalsContact C-N 3.28Å; S305-K307 PolarHBondContact O-N 3.24Å; S305-Y308 PolarHBondContact O-N 2.78Å; S305-W309 VanDerWaalsContact CA-CH2 3.5Å; S305-W309 PolarHBondContact O-N 2.88Å; S305-E310 VanDerWaalsContact CB-CD 3.44Å; S305-E310 VanDerWaalsContact CB-OE2 3.32Å; S305-E310 WeakPolarHBondContact CB-OE2 3.24Å; S305-E310 PolarHBondContact O-N 3.38Å; S305-E310 VanDerWaalsContact OG-CD 3.24Å; S305-E310 PolarHBondContact OG-OE2 3.33Å
306	K	94.4	Very high	95.1	Very high	98 Å²	98	35.6 Å²	35.6	43%	0.426	19%	0.19	S	C	.	.	H	α-helix	trans	-56.6	-38.9	179.6	-80	-172.9	162.9	-175.3	0	113.9	T188 D189 L304 E310 D311	T188-K306 HydrophobicContact CG2-CD 3.7Å; D189-K306 WeakPolarHBondContact OD2-CD 3.45Å; D189-K306 WeakPolarHBondContact OD2-CE 3.09Å; D189-K306 IonicContact OD2-NZ 3.52Å; D189-K306 PolarHBondContact OD2-NZ 2.91Å; L304-K306 PolarHBondContact O-N 3.28Å; K306-E310 PolarHBondContact N-OE2 3.47Å; K306-D311 WeakPolarHBondContact O-CB 3.12Å; K306-D311 PolarHBondContact O-N 3.48Å
307	K	94.6	Very high	95.2	Very high	125 Å²	125	35.6 Å²	35.6	54%	0.543	19%	0.19	S	C	.	.	H	α-helix	trans	-81.6	-30.8	-177.4	-178.7	-178.5	174.3	-170	0	112.6	L304 S305	L304-K307 PolarHBondContact O-N 3.25Å; L304-K307 VanDerWaalsContact O-N 3.14Å; S305-K307 VanDerWaalsContact C-N 3.28Å; S305-K307 PolarHBondContact O-N 3.24Å
308	Y	96.3	Very high	95.3	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-104	-20.8	-168	-75.6	-85.2	0	0	0	114.5	L250 L253 A254 L257 L304 S305 R314	L250-Y308 VanDerWaalsContact C-OH 3.32Å; L250-Y308 VanDerWaalsContact CB-OH 3.29Å; L250-Y308 WeakPolarHBondContact CB-OH 3.46Å; L250-Y308 PolarHBondContact O-OH 3.35Å; L253-Y308 HydrophobicContact CB-CE1 4.41Å; L253-Y308 HydrophobicContact CD2-CE1 4.14Å; L253-Y308 HydrophobicContact CD2-CE2 4.35Å; L253-Y308 HydrophobicContact CG-CE1 4.13Å; A254-Y308 HydrophobicContact CB-CD1 4.28Å; A254-Y308 HydrophobicContact CB-CE1 3.79Å; L257-Y308 HydrophobicContact CD1-CD1 3.78Å; L257-Y308 HydrophobicContact CD1-CG 4.05Å; L304-Y308 HydrophobicContact CB-CD2 3.86Å; L304-Y308 HydrophobicContact CB-CE2 4.1Å; L304-Y308 HydrophobicContact CD2-CE2 4.2Å; L304-Y308 VanDerWaalsContact O-CD2 3.28Å; L304-Y308 WeakPolarHBondContact O-CD2 3.48Å; L304-Y308 PolarHBondContact O-N 3.25Å; S305-Y308 PolarHBondContact O-N 2.78Å; Y308-R314 WeakPolarHBondContact O-CD 3.18Å; Y308-R314 PolarHBondContact O-NH1 3.23Å
309	W	96.7	Very high	95.4	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-154.3	-25.1	174.6	62.4	88.6	0	0	0	115.6	L257 L296 L299 K300 S305 D311 G312 R314 L317 Q318	L257-W309 HydrophobicContact CD1-CE3 4.39Å; L296-W309 HydrophobicContact CD2-CE3 4.22Å; L296-W309 HydrophobicContact CD2-CH2 4.19Å; L296-W309 HydrophobicContact CD2-CZ2 4.48Å; L296-W309 HydrophobicContact CD2-CZ3 4.05Å; L299-W309 HydrophobicContact CB-CH2 3.68Å; L299-W309 HydrophobicContact CB-CZ3 3.93Å; L299-W309 HydrophobicContact CD1-CZ3 4.2Å; K300-W309 HydrophobicContact CB-CH2 4.44Å; K300-W309 HydrophobicContact CB-CZ2 4.16Å; S305-W309 VanDerWaalsContact CA-CH2 3.5Å; S305-W309 PolarHBondContact O-N 2.88Å; W309-D311 VanDerWaalsContact C-N 3.25Å; W309-D311 PolarHBondContact O-N 3.48Å; W309-G312 PolarHBondContact O-N 3.48Å; W309-R314 HydrophobicContact CB-CB 4.04Å; W309-L317 HydrophobicContact CB-CD2 4.07Å; W309-L317 HydrophobicContact CG-CD2 4.47Å; W309-Q318 PolarHBondContact O-OE1 3.39Å
310	E	95.1	Very high	95.5	Very high	67 Å²	67	38.7 Å²	38.7	31%	0.313	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-4.3	-177.5	-53.8	175.7	149.3	0	0	113.5	K300 S305 K306	K300-E310 IonicContact NZ-OE1 2.84Å; K300-E310 PolarHBondContact NZ-OE1 3.37Å; S305-E310 VanDerWaalsContact CB-CD 3.44Å; S305-E310 VanDerWaalsContact CB-OE2 3.32Å; S305-E310 WeakPolarHBondContact CB-OE2 3.24Å; S305-E310 PolarHBondContact O-N 3.38Å; S305-E310 VanDerWaalsContact OG-CD 3.24Å; S305-E310 PolarHBondContact OG-OE2 3.33Å; K306-E310 PolarHBondContact N-OE2 3.47Å
311	D	92.8	Very high	95.6	Very high	100 Å²	100	36.3 Å²	36.3	54%	0.535	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.1	170.3	66.1	-15.6	0	0	0	113.2	K306 W309 S313	K306-D311 WeakPolarHBondContact O-CB 3.12Å; K306-D311 PolarHBondContact O-N 3.48Å; W309-D311 VanDerWaalsContact C-N 3.25Å; W309-D311 PolarHBondContact O-N 3.48Å; D311-S313 WeakPolarHBondContact OD1-CB 3.44Å; D311-S313 PolarHBondContact OD1-N 2.64Å; D311-S313 PolarHBondContact OD1-OG 2.76Å
312	G	94.1	Very high	95.9	Very high	46 Å²	46	38.4 Å²	38.4	47%	0.474	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	3.2	-176.4	0	0	0	0	0	114.2	W309 R314	W309-G312 PolarHBondContact O-N 3.48Å; G312-R314 VanDerWaalsContact C-N 3.31Å; G312-R314 PolarHBondContact O-N 2.77Å
313	S	95.2	Very high	96.2	Very high	59 Å²	59	40.7 Å²	40.7	41%	0.413	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.4	177.7	59.6	0	0	0	0	113.4	D311	D311-S313 WeakPolarHBondContact OD1-CB 3.44Å; D311-S313 PolarHBondContact OD1-N 2.64Å; D311-S313 PolarHBondContact OD1-OG 2.76Å
314	R	98	Very high	96.3	Very high	20 Å²	20	40.7 Å²	40.7	8%	0.075	22%	0.219	C	C	.	.			trans	-132.6	71.3	-176.8	-61.6	-178	-173.2	73.4	2.3	111	A254 D258 E261 Y308 W309 G312 N316 L317 Q318	A254-R314 PolarHBondContact O-NH2 3.4Å; D258-R314 IonicContact OD1-CZ 3.52Å; D258-R314 IonicContact OD1-NE 3.75Å; D258-R314 PolarHBondContact OD1-NE 3.33Å; D258-R314 IonicContact OD1-NH2 3.42Å; D258-R314 PolarHBondContact OD1-NH2 3.48Å; D258-R314 IonicContact OD2-NH2 3.72Å; E261-R314 HydrophobicContact CB-CB 4.38Å; E261-R314 HydrophobicContact CB-CG 4.23Å; E261-R314 HydrophobicContact CG-CB 4.19Å; E261-R314 HydrophobicContact CG-CG 4.22Å; Y308-R314 WeakPolarHBondContact O-CD 3.18Å; Y308-R314 PolarHBondContact O-NH1 3.23Å; W309-R314 HydrophobicContact CB-CB 4.04Å; G312-R314 VanDerWaalsContact C-N 3.31Å; G312-R314 PolarHBondContact O-N 2.77Å; R314-N316 PolarHBondContact O-N 3.3Å; R314-L317 HydrophobicContact CB-CB 3.89Å; R314-L317 HydrophobicContact CB-CD2 4.19Å; R314-L317 PolarHBondContact O-N 2.94Å; R314-Q318 PolarHBondContact O-N 3.43Å
315	P	97.6	Very high	96.3	Very high	72 Å²	72	43.9 Å²	43.9	47%	0.468	23%	0.234	S	C	.	.	H	α-helix	trans	-67.2	-33.2	-172.2	26.9	-35.3	0	0	0	113.3	E261 Q318 S319	E261-P315 WeakPolarHBondContact OE1-CD 3.45Å; P315-Q318 PolarHBondContact O-N 3.19Å; P315-S319 WeakPolarHBondContact O-CB 3.39Å; P315-S319 PolarHBondContact O-N 3.43Å
316	N	97.6	Very high	96.3	Very high	23 Å²	23	51.2 Å²	51.2	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-72.1	-37.5	178.8	-62.4	-69	0	0	0	111.2	E261 L264 E265 K268 R314 S319 F320	E261-N316 VanDerWaalsContact OE1-CB 3.27Å; E261-N316 WeakPolarHBondContact OE1-CB 3.31Å; E261-N316 PolarHBondContact OE1-N 3.47Å; E261-N316 PolarHBondContact OE1-ND2 3.27Å; E261-N316 PolarHBondContact OE2-N 3.35Å; L264-N316 HydrophobicContact CB-CB 3.81Å; L264-N316 HydrophobicContact CD1-CB 4.42Å; E265-N316 PolarHBondContact OE2-ND2 3.18Å; E265-N316 PolarHBondContact OE2-OD1 3.44Å; K268-N316 PolarHBondContact NZ-OD1 3.17Å; R314-N316 PolarHBondContact O-N 3.3Å; N316-S319 PolarHBondContact O-N 3.41Å; N316-F320 VanDerWaalsContact O-CB 3.28Å; N316-F320 WeakPolarHBondContact O-CB 3.18Å; N316-F320 PolarHBondContact O-N 3.28Å
317	L	98.4	Very high	96.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-45.3	172.7	-174.2	68.6	0	0	0	111.4	L257 I260 E261 L264 L292 L296 W309 R314 F320 F321	L257-L317 HydrophobicContact CB-CD2 4.25Å; L257-L317 HydrophobicContact CD1-CD2 4.4Å; L257-L317 HydrophobicContact CD2-CD2 3.97Å; L257-L317 HydrophobicContact CG-CD2 4.43Å; I260-L317 HydrophobicContact CG2-CD1 3.71Å; E261-L317 WeakPolarHBondContact OE2-CB 3.33Å; E261-L317 PolarHBondContact OE2-N 3.24Å; L264-L317 HydrophobicContact CD1-CB 4.29Å; L264-L317 HydrophobicContact CD1-CD1 4.17Å; L292-L317 HydrophobicContact CD1-CD1 4.49Å; L292-L317 HydrophobicContact CD2-CD1 4.32Å; L296-L317 HydrophobicContact CD1-CD1 3.79Å; L296-L317 HydrophobicContact CD1-CG 4.3Å; L296-L317 HydrophobicContact CD2-CD1 4.12Å; L296-L317 HydrophobicContact CD2-CD2 4.12Å; L296-L317 HydrophobicContact CD2-CG 4.22Å; W309-L317 HydrophobicContact CB-CD2 4.07Å; W309-L317 HydrophobicContact CG-CD2 4.47Å; R314-L317 HydrophobicContact CB-CB 3.89Å; R314-L317 HydrophobicContact CB-CD2 4.19Å; R314-L317 PolarHBondContact O-N 2.94Å; L317-F320 WeakPolarHBondContact O-CB 2.93Å; L317-F320 PolarHBondContact O-N 2.9Å; L317-F321 PolarHBondContact O-N 3.28Å
318	Q	98.1	Very high	96.3	Very high	57 Å²	57	51.1 Å²	51.1	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-59.4	-49.9	174.5	-179.4	177.9	-20.2	0	0	110.8	W309 R314 P315 F320 F321 E322	W309-Q318 PolarHBondContact O-OE1 3.39Å; R314-Q318 PolarHBondContact O-N 3.43Å; P315-Q318 PolarHBondContact O-N 3.19Å; Q318-F320 VanDerWaalsContact C-N 3.31Å; Q318-F320 PolarHBondContact O-N 3.3Å; Q318-F321 PolarHBondContact O-N 2.57Å; Q318-F321 VanDerWaalsContact O-N 3.14Å; Q318-E322 PolarHBondContact NE2-OE1 2.96Å; Q318-E322 WeakPolarHBondContact O-CG 3.26Å; Q318-E322 PolarHBondContact O-N 3.48Å
319	S	97.2	Very high	96.2	Very high	48 Å²	48	50.9 Å²	50.9	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-40.4	178.6	-173.4	0	0	0	0	112.3	P315 N316 E322 R323	P315-S319 WeakPolarHBondContact O-CB 3.39Å; P315-S319 PolarHBondContact O-N 3.43Å; N316-S319 PolarHBondContact O-N 3.41Å; S319-E322 PolarHBondContact O-N 3.45Å; S319-R323 VanDerWaalsContact C-NH1 3.34Å; S319-R323 WeakPolarHBondContact O-CG 3.31Å; S319-R323 PolarHBondContact O-N 3.22Å; S319-R323 VanDerWaalsContact O-N 3.15Å; S319-R323 PolarHBondContact O-NH1 3.48Å; S319-R323 PolarHBondContact OG-NH1 2.85Å
320	F	98.2	Very high	96.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.6	-50.2	172.7	168.1	-87.6	0	0	0	111	L264 W279 L280 D289 L292 L296 N316 L317 Q318 E322 R323 V324	L264-F320 HydrophobicContact CD1-CB 3.97Å; L264-F320 HydrophobicContact CD1-CG 4.36Å; L264-F320 HydrophobicContact CD2-CB 4.36Å; L264-F320 HydrophobicContact CD2-CD2 4.01Å; L264-F320 HydrophobicContact CD2-CG 4.38Å; W279-F320 HydrophobicContact CE3-CD2 4.09Å; W279-F320 AromaticContact CE3-CE2 3.78Å; W279-F320 HydrophobicContact CE3-CE2 3.78Å; W279-F320 HydrophobicContact CZ3-CE2 4.4Å; L280-F320 HydrophobicContact CB-CE2 4.47Å; D289-F320 HydrophobicContact CB-CE2 4.23Å; D289-F320 HydrophobicContact CB-CZ 4.1Å; D289-F320 WeakPolarHBondContact OD1-CE2 3.1Å; L292-F320 HydrophobicContact CB-CE1 4.07Å; L292-F320 HydrophobicContact CB-CZ 4.14Å; L292-F320 HydrophobicContact CD2-CD1 3.88Å; L292-F320 HydrophobicContact CD2-CE1 3.42Å; L292-F320 VanDerWaalsContact CD2-CE1 3.42Å; L292-F320 HydrophobicContact CD2-CE2 4.36Å; L292-F320 HydrophobicContact CD2-CZ 3.69Å; L292-F320 HydrophobicContact CG-CD1 4.28Å; L292-F320 HydrophobicContact CG-CE1 3.55Å; L292-F320 HydrophobicContact CG-CZ 4.04Å; L296-F320 HydrophobicContact CD1-CD1 3.92Å; L296-F320 HydrophobicContact CD1-CE1 4.05Å; N316-F320 VanDerWaalsContact O-CB 3.28Å; N316-F320 WeakPolarHBondContact O-CB 3.18Å; N316-F320 PolarHBondContact O-N 3.28Å; L317-F320 WeakPolarHBondContact O-CB 2.93Å; L317-F320 PolarHBondContact O-N 2.9Å; Q318-F320 VanDerWaalsContact C-N 3.31Å; Q318-F320 PolarHBondContact O-N 3.3Å; F320-E322 VanDerWaalsContact C-N 3.34Å; F320-E322 PolarHBondContact O-N 3.18Å; F320-R323 WeakPolarHBondContact O-CB 3.43Å; F320-R323 PolarHBondContact O-N 3.13Å; F320-R323 VanDerWaalsContact O-N 3.1Å; F320-V324 HydrophobicContact CD1-CG2 4.13Å; F320-V324 HydrophobicContact CE1-CG2 3.54Å; F320-V324 HydrophobicContact CE2-CG2 4.09Å; F320-V324 HydrophobicContact CZ-CG2 3.52Å; F320-V324 WeakPolarHBondContact O-CG2 3.49Å; F320-V324 PolarHBondContact O-N 2.78Å
321	F	97.8	Very high	96.1	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-41.3	-177.3	-170.9	-128.9	0	0	0	111.9	L296 H297 K300 L317 Q318 R323 V324 Q325 F330	L296-F321 HydrophobicContact CB-CD2 3.46Å; L296-F321 VanDerWaalsContact CB-CD2 3.46Å; L296-F321 HydrophobicContact CB-CE2 3.58Å; L296-F321 HydrophobicContact CB-CG 4Å; L296-F321 HydrophobicContact CB-CZ 4.19Å; L296-F321 HydrophobicContact CD1-CB 3.89Å; L296-F321 HydrophobicContact CD1-CD2 3.86Å; L296-F321 HydrophobicContact CD1-CG 4.08Å; L296-F321 HydrophobicContact CG-CD2 4.32Å; H297-F321 HydrophobicContact CB-CE2 4.3Å; H297-F321 HydrophobicContact CB-CZ 4.24Å; K300-F321 HydrophobicContact CD-CE1 3.84Å; L317-F321 PolarHBondContact O-N 3.28Å; Q318-F321 PolarHBondContact O-N 2.57Å; Q318-F321 VanDerWaalsContact O-N 3.14Å; F321-R323 VanDerWaalsContact C-N 3.27Å; F321-R323 PolarHBondContact O-N 2.69Å; F321-V324 PolarHBondContact O-N 3.01Å; F321-V324 VanDerWaalsContact O-N 3.16Å; F321-Q325 HydrophobicContact CD1-CG 4.42Å; F321-Q325 HydrophobicContact CD2-CG 4.38Å; F321-Q325 HydrophobicContact CE1-CG 4.15Å; F321-Q325 HydrophobicContact CE2-CG 4.1Å; F321-Q325 HydrophobicContact CZ-CG 3.97Å; F321-Q325 WeakPolarHBondContact O-CG 3.47Å; F321-Q325 PolarHBondContact O-N 3.19Å; F321-F330 HydrophobicContact CE2-CE2 4.3Å; F321-F330 AromaticContact CE2-CZ 3.98Å; F321-F330 HydrophobicContact CE2-CZ 3.98Å; F321-F330 HydrophobicContact CZ-CZ 4.28Å
322	E	96.5	Very high	96.1	Very high	69 Å²	69	57.1 Å²	57.1	32%	0.322	28%	0.275	S	S	.	.	H	α-helix	trans	-59.3	-37.1	174.2	-70.9	176.7	-167.1	0	0	112.6	Q318 S319 F320 R326	Q318-E322 PolarHBondContact NE2-OE1 2.96Å; Q318-E322 WeakPolarHBondContact O-CG 3.26Å; Q318-E322 PolarHBondContact O-N 3.48Å; S319-E322 PolarHBondContact O-N 3.45Å; F320-E322 VanDerWaalsContact C-N 3.34Å; F320-E322 PolarHBondContact O-N 3.18Å; E322-R326 WeakPolarHBondContact O-CG 3.45Å; E322-R326 PolarHBondContact O-N 3.16Å; E322-R326 PolarHBondContact O-NH1 3.02Å; E322-R326 IonicContact OE2-NH2 3.63Å
323	R	96.8	Very high	96	Very high	48 Å²	48	55.7 Å²	55.7	18%	0.181	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-46.5	173.5	-69.2	-170.4	-60.5	-84.8	9.1	111.4	E277 L278 W279 S319 F320 F321 Q325 R326	E277-R323 WeakPolarHBondContact OE1-CD 3.14Å; L278-R323 PolarHBondContact O-NE 3.39Å; L278-R323 PolarHBondContact O-NH2 3.38Å; W279-R323 HydrophobicContact CH2-CB 3.82Å; W279-R323 HydrophobicContact CZ3-CB 3.83Å; S319-R323 VanDerWaalsContact C-NH1 3.34Å; S319-R323 WeakPolarHBondContact O-CG 3.31Å; S319-R323 PolarHBondContact O-N 3.22Å; S319-R323 VanDerWaalsContact O-N 3.15Å; S319-R323 PolarHBondContact O-NH1 3.48Å; S319-R323 PolarHBondContact OG-NH1 2.85Å; F320-R323 WeakPolarHBondContact O-CB 3.43Å; F320-R323 PolarHBondContact O-N 3.13Å; F320-R323 VanDerWaalsContact O-N 3.1Å; F321-R323 VanDerWaalsContact C-N 3.27Å; F321-R323 PolarHBondContact O-N 2.69Å; R323-Q325 VanDerWaalsContact C-N 3.29Å; R323-Q325 PolarHBondContact O-N 3.06Å; R323-R326 PolarHBondContact O-N 2.82Å; R323-R326 VanDerWaalsContact O-N 3.09Å
324	V	96.9	Very high	95.7	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-56.4	-44.5	176.7	172	0	0	0	0	111.2	W279 F285 F320 F321 R326 R327 F330	W279-V324 HydrophobicContact CZ3-CG2 3.86Å; F285-V324 HydrophobicContact CE2-CG2 4.39Å; F320-V324 HydrophobicContact CD1-CG2 4.13Å; F320-V324 HydrophobicContact CE1-CG2 3.54Å; F320-V324 HydrophobicContact CE2-CG2 4.09Å; F320-V324 HydrophobicContact CZ-CG2 3.52Å; F320-V324 WeakPolarHBondContact O-CG2 3.49Å; F320-V324 PolarHBondContact O-N 2.78Å; F321-V324 PolarHBondContact O-N 3.01Å; F321-V324 VanDerWaalsContact O-N 3.16Å; V324-R326 PolarHBondContact O-N 3.3Å; V324-R326 VanDerWaalsContact O-N 3.15Å; V324-R327 WeakPolarHBondContact O-CB 3.47Å; V324-R327 WeakPolarHBondContact O-CG 3.41Å; V324-R327 PolarHBondContact O-N 3.13Å; V324-F330 HydrophobicContact CG1-CB 4.48Å; V324-F330 HydrophobicContact CG1-CD2 3.4Å; V324-F330 HydrophobicContact CG1-CE2 3.73Å; V324-F330 HydrophobicContact CG1-CG 4.04Å; V324-F330 WeakPolarHBondContact O-CB 3.38Å
325	Q	95.2	Very high	94.7	Very high	68 Å²	68	54.3 Å²	54.3	32%	0.318	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-21.9	180	-70.9	-175.9	-59.2	0	0	114.1	F321 R323 F330 R331	F321-Q325 HydrophobicContact CD1-CG 4.42Å; F321-Q325 HydrophobicContact CD2-CG 4.38Å; F321-Q325 HydrophobicContact CE1-CG 4.15Å; F321-Q325 HydrophobicContact CE2-CG 4.1Å; F321-Q325 HydrophobicContact CZ-CG 3.97Å; F321-Q325 WeakPolarHBondContact O-CG 3.47Å; F321-Q325 PolarHBondContact O-N 3.19Å; R323-Q325 VanDerWaalsContact C-N 3.29Å; R323-Q325 PolarHBondContact O-N 3.06Å; Q325-F330 HydrophobicContact CB-CD1 4.44Å; Q325-F330 HydrophobicContact CB-CE1 4.31Å; Q325-F330 HydrophobicContact CG-CD1 4.36Å; Q325-F330 HydrophobicContact CG-CE1 3.77Å; Q325-F330 HydrophobicContact CG-CZ 4.1Å; Q325-R331 WeakPolarHBondContact O-CG 3.32Å
326	R	95.3	Very high	93.2	Very high	162 Å²	162	56.6 Å²	56.6	61%	0.611	26%	0.264	S	S	*	.	H	α-helix	trans	-81.9	-17.6	177.1	-67.4	173.3	-170.9	113.8	3	112.8	E322 R323 V324	E322-R326 WeakPolarHBondContact O-CG 3.45Å; E322-R326 PolarHBondContact O-N 3.16Å; E322-R326 PolarHBondContact O-NH1 3.02Å; E322-R326 IonicContact OE2-NH2 3.63Å; R323-R326 PolarHBondContact O-N 2.82Å; R323-R326 VanDerWaalsContact O-N 3.09Å; V324-R326 PolarHBondContact O-N 3.3Å; V324-R326 VanDerWaalsContact O-N 3.15Å
327	R	94.8	Very high	91.1	Very high	64 Å²	64	59.4 Å²	59.4	24%	0.242	28%	0.278	C	S	.	.	S	Bend	trans	-65.3	141.6	-178.7	-62.1	-172.7	64.7	83.1	2.1	111.4	E67 W279 F285 V324 A329 F330 R331	E67-R327 IonicContact OE1-CZ 3.99Å; E67-R327 IonicContact OE1-NE 3.93Å; E67-R327 PolarHBondContact OE1-NE 3.1Å; E67-R327 IonicContact OE1-NH2 3.43Å; E67-R327 IonicContact OE2-CZ 2.59Å; E67-R327 IonicContact OE2-NE 3.87Å; E67-R327 PolarHBondContact OE2-NE 3.25Å; E67-R327 IonicContact OE2-NH2 3.76Å; E67-R327 PolarHBondContact OE2-NH2 2.96Å; W279-R327 HydrophobicContact CH2-CG 4.35Å; F285-R327 VanDerWaalsContact CZ-CD 3.49Å; V324-R327 WeakPolarHBondContact O-CB 3.47Å; V324-R327 WeakPolarHBondContact O-CG 3.41Å; V324-R327 PolarHBondContact O-N 3.13Å; R327-A329 PolarHBondContact O-N 3.4Å; R327-F330 HydrophobicContact CB-CB 4.3Å; R327-F330 PolarHBondContact O-N 3.48Å; R327-R331 WeakPolarHBondContact O-CG 3.35Å; R327-R331 PolarHBondContact O-N 3.36Å
328	F	94.4	Very high	88.7	Confident	156 Å²	156	67.1 Å²	67.1	68%	0.684	31%	0.314	S	S	*	.	H	α-helix	trans	-58.4	-48.5	-178	173	-98	0	0	0	112.4	F330 R331 K332	F328-F330 VanDerWaalsContact C-N 3.34Å; F328-F330 PolarHBondContact O-N 2.82Å; F328-R331 PolarHBondContact O-N 2.92Å; F328-K332 HydrophobicContact CE1-CD 3.98Å; F328-K332 HydrophobicContact CZ-CD 4.17Å; F328-K332 VanDerWaalsContact O-CB 3.32Å; F328-K332 WeakPolarHBondContact O-CB 3.4Å; F328-K332 PolarHBondContact O-N 2.91Å
329	A	94.4	Very high	86.3	Confident	2 Å²	2	67.1 Å²	67.1	2%	0.017	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-43	-179.3	0	0	0	0	0	111.8	A66 E67 R327 K332 V333	A66-A329 HydrophobicContact CB-CB 3.66Å; E67-A329 HydrophobicContact CB-CB 4.33Å; E67-A329 VanDerWaalsContact CD-CB 3.44Å; E67-A329 HydrophobicContact CG-CB 3.57Å; E67-A329 WeakPolarHBondContact OE1-CB 3.48Å; R327-A329 PolarHBondContact O-N 3.4Å; A329-K332 PolarHBondContact O-N 3.07Å; A329-V333 WeakPolarHBondContact O-CB 3.49Å; A329-V333 VanDerWaalsContact O-CG2 3.31Å; A329-V333 WeakPolarHBondContact O-CG2 3.31Å; A329-V333 PolarHBondContact O-N 2.95Å
330	F	95.6	Very high	83.9	Confident	9 Å²	9	66.1 Å²	66.1	4%	0.039	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-48.8	175.6	-168.7	-80.9	0	0	0	111.8	L63 H297 F321 V324 Q325 R327 F328 K332 V333 L334 G335	L63-F330 HydrophobicContact CD2-CB 4.34Å; L63-F330 HydrophobicContact CD2-CD2 4.21Å; H297-F330 HydrophobicContact CB-CE2 4.17Å; H297-F330 HydrophobicContact CB-CZ 3.84Å; H297-F330 AromaticContact CD2-CZ 3.71Å; H297-F330 AromaticContact CG-CZ 3.99Å; F321-F330 HydrophobicContact CE2-CE2 4.3Å; F321-F330 AromaticContact CE2-CZ 3.98Å; F321-F330 HydrophobicContact CE2-CZ 3.98Å; F321-F330 HydrophobicContact CZ-CZ 4.28Å; V324-F330 HydrophobicContact CG1-CB 4.48Å; V324-F330 HydrophobicContact CG1-CD2 3.4Å; V324-F330 HydrophobicContact CG1-CE2 3.73Å; V324-F330 HydrophobicContact CG1-CG 4.04Å; V324-F330 WeakPolarHBondContact O-CB 3.38Å; Q325-F330 HydrophobicContact CB-CD1 4.44Å; Q325-F330 HydrophobicContact CB-CE1 4.31Å; Q325-F330 HydrophobicContact CG-CD1 4.36Å; Q325-F330 HydrophobicContact CG-CE1 3.77Å; Q325-F330 HydrophobicContact CG-CZ 4.1Å; R327-F330 HydrophobicContact CB-CB 4.3Å; R327-F330 PolarHBondContact O-N 3.48Å; F328-F330 VanDerWaalsContact C-N 3.34Å; F328-F330 PolarHBondContact O-N 2.82Å; F330-K332 VanDerWaalsContact C-N 3.34Å; F330-K332 PolarHBondContact O-N 3.13Å; F330-V333 PolarHBondContact O-N 3.34Å; F330-L334 HydrophobicContact CD1-CB 4.28Å; F330-L334 HydrophobicContact CD2-CD1 3.92Å; F330-L334 HydrophobicContact CE1-CB 4.02Å; F330-L334 HydrophobicContact CE1-CD1 4.35Å; F330-L334 HydrophobicContact CE2-CD1 3.51Å; F330-L334 HydrophobicContact CZ-CB 4.24Å; F330-L334 HydrophobicContact CZ-CD1 3.77Å; F330-L334 WeakPolarHBondContact O-CA 3.49Å; F330-L334 WeakPolarHBondContact O-CB 3.31Å; F330-L334 PolarHBondContact O-N 3.5Å; F330-G335 PolarHBondContact O-N 2.99Å
331	R	93.9	Very high	81.4	Confident	163 Å²	163	71.2 Å²	71.2	62%	0.615	34%	0.337	S	S	*	.	H	α-helix	trans	-62.4	-40.7	177.7	-68.5	177.1	62.1	-164.9	-1.9	112.4	Q325 R327 F328 G335	Q325-R331 WeakPolarHBondContact O-CG 3.32Å; R327-R331 WeakPolarHBondContact O-CG 3.35Å; R327-R331 PolarHBondContact O-N 3.36Å; F328-R331 PolarHBondContact O-N 2.92Å; R331-G335 WeakPolarHBondContact O-CA 3.45Å; R331-G335 PolarHBondContact O-N 3.42Å
332	K	91.5	Very high	78.9	Confident	127 Å²	127	75.3 Å²	75.3	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-62.7	-42.1	177.9	-179.4	-176.4	174.2	-171.1	0	111.9	F328 A329 F330	F328-K332 HydrophobicContact CE1-CD 3.98Å; F328-K332 HydrophobicContact CZ-CD 4.17Å; F328-K332 VanDerWaalsContact O-CB 3.32Å; F328-K332 WeakPolarHBondContact O-CB 3.4Å; F328-K332 PolarHBondContact O-N 2.91Å; A329-K332 PolarHBondContact O-N 3.07Å; F330-K332 VanDerWaalsContact C-N 3.34Å; F330-K332 PolarHBondContact O-N 3.13Å
333	V	92.4	Very high	76.5	Confident	15 Å²	15	73.2 Å²	73.2	9%	0.091	35%	0.351	C	S	.	.	H	α-helix	trans	-89.5	-37.7	-172.7	177.5	0	0	0	0	112.4	R62 L63 A66 A329 F330	R62-V333 HydrophobicContact CB-CG1 3.56Å; R62-V333 HydrophobicContact CB-CG2 4.12Å; L63-V333 HydrophobicContact CD2-CB 3.89Å; L63-V333 HydrophobicContact CD2-CG1 4.21Å; L63-V333 HydrophobicContact CD2-CG2 4.27Å; L63-V333 HydrophobicContact CG-CB 4.34Å; L63-V333 HydrophobicContact CG-CG1 4.13Å; A66-V333 HydrophobicContact CB-CG2 3.83Å; A329-V333 WeakPolarHBondContact O-CB 3.49Å; A329-V333 VanDerWaalsContact O-CG2 3.31Å; A329-V333 WeakPolarHBondContact O-CG2 3.31Å; A329-V333 PolarHBondContact O-N 2.95Å; F330-V333 PolarHBondContact O-N 3.34Å
334	L	90.1	Very high	74.3	Confident	10 Å²	10	71.7 Å²	71.7	5%	0.052	35%	0.348	C	S	.	.	H	α-helix	trans	-123.6	-4.5	-169.2	-58.6	-179.6	0	0	0	114.4	Q59 L63 H297 F330 D336	Q59-L334 HydrophobicContact CB-CD2 3.95Å; Q59-L334 HydrophobicContact CG-CD2 3.56Å; L63-L334 HydrophobicContact CD1-CD1 3.86Å; L63-L334 HydrophobicContact CD2-CD1 4.21Å; L63-L334 HydrophobicContact CD2-CG 4.36Å; L63-L334 HydrophobicContact CG-CD1 4.36Å; H297-L334 HydrophobicContact CB-CD1 4.04Å; F330-L334 HydrophobicContact CD1-CB 4.28Å; F330-L334 HydrophobicContact CD2-CD1 3.92Å; F330-L334 HydrophobicContact CE1-CB 4.02Å; F330-L334 HydrophobicContact CE1-CD1 4.35Å; F330-L334 HydrophobicContact CE2-CD1 3.51Å; F330-L334 HydrophobicContact CZ-CB 4.24Å; F330-L334 HydrophobicContact CZ-CD1 3.77Å; F330-L334 WeakPolarHBondContact O-CA 3.49Å; F330-L334 WeakPolarHBondContact O-CB 3.31Å; F330-L334 PolarHBondContact O-N 3.5Å; L334-D336 PolarHBondContact O-N 2.95Å
335	G	76.4	Confident	72	Confident	40 Å²	40	75.3 Å²	75.3	41%	0.412	37%	0.371	S	S	.	.	S	Bend	trans	-70.5	-29.1	-173.2	0	0	0	0	0	115.3	F330 R331 I337	F330-G335 PolarHBondContact O-N 2.99Å; R331-G335 WeakPolarHBondContact O-CA 3.45Å; R331-G335 PolarHBondContact O-N 3.42Å; G335-I337 PolarHBondContact O-N 2.9Å
336	D	65.1	Low	69.9	Low	120 Å²	120	75.6 Å²	75.6	64%	0.642	37%	0.373	S	S	*	.			trans	-93	80.1	-176.5	-77.8	-32.1	0	0	0	112.3	L334 H338 T339	L334-D336 PolarHBondContact O-N 2.95Å; D336-H338 PolarHBondContact O-N 2.8Å; D336-H338 VanDerWaalsContact O-N 3.16Å; D336-T339 HydrophobicContact CB-CG2 3.96Å; D336-T339 WeakPolarHBondContact O-CB 3.46Å; D336-T339 PolarHBondContact O-N 2.67Å; D336-T339 PolarHBondContact O-OG1 3.46Å
337	I	54.4	Low	67.9	Low	83 Å²	83	70 Å²	70	43%	0.426	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.5	177.9	-62.5	164.4	0	0	0	112.1	M191 G335 T339 T340	M191-I337 HydrophobicContact CE-CD1 4.18Å; M191-I337 HydrophobicContact SD-CD1 4.06Å; M191-I337 HydrophobicContact SD-CG1 4.47Å; M191-I337 HydrophobicContact SD-CG2 3.77Å; G335-I337 PolarHBondContact O-N 2.9Å; I337-T339 PolarHBondContact O-N 3.4Å; I337-T340 PolarHBondContact O-N 2.87Å; I337-T340 PolarHBondContact O-OG1 3.19Å
338	H	46.9	Very low	65.8	Low	161 Å²	161	70.7 Å²	70.7	75%	0.745	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.6	175.7	-73.4	-69.1	0	0	0	114.3	D336 T340 L342	D336-H338 PolarHBondContact O-N 2.8Å; D336-H338 VanDerWaalsContact O-N 3.16Å; H338-T340 PolarHBondContact O-N 3.44Å; H338-L342 PolarHBondContact O-N 2.98Å
339	T	49.1	Very low	63.8	Low	58 Å²	58	65.7 Å²	65.7	36%	0.356	35%	0.354	S	S	.	.	H	α-helix	trans	-70.1	-14.5	172.2	52.9	0	0	0	0	113.3	D336 I337 L342 S343	D336-T339 HydrophobicContact CB-CG2 3.96Å; D336-T339 WeakPolarHBondContact O-CB 3.46Å; D336-T339 PolarHBondContact O-N 2.67Å; D336-T339 PolarHBondContact O-OG1 3.46Å; I337-T339 PolarHBondContact O-N 3.4Å; T339-L342 PolarHBondContact O-N 3.23Å; T339-S343 WeakPolarHBondContact O-CA 3.39Å; T339-S343 WeakPolarHBondContact O-CB 3.31Å; T339-S343 PolarHBondContact O-N 2.95Å; T339-S343 PolarHBondContact O-OG 3.35Å
340	T	46.5	Very low	61.9	Low	26 Å²	26	72.1 Å²	72.1	16%	0.16	38%	0.382	C	S	.	.	H	α-helix	trans	-65.3	-41.5	177.8	-52.1	0	0	0	0	112.2	Q54 F301 I337 H338 S343 A344	Q54-T340 PolarHBondContact NE2-OG1 2.91Å; Q54-T340 VanDerWaalsContact NE2-OG1 3.14Å; Q54-T340 PolarHBondContact OE1-OG1 3.26Å; F301-T340 HydrophobicContact CE2-CG2 4.47Å; I337-T340 PolarHBondContact O-N 2.87Å; I337-T340 PolarHBondContact O-OG1 3.19Å; H338-T340 PolarHBondContact O-N 3.44Å; T340-S343 PolarHBondContact O-OG 3.47Å; T340-A344 WeakPolarHBondContact O-CB 3.46Å; T340-A344 PolarHBondContact O-N 2.93Å
341	L	45.5	Very low	60	Low	108 Å²	108	74 Å²	74	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-77.1	-41.8	174.3	-105.2	144.5	0	0	0	111.4	A344 V345	L341-A344 PolarHBondContact O-N 3.28Å; L341-V345 HydrophobicContact CD2-CG2 4.3Å; L341-V345 VanDerWaalsContact O-CB 3.25Å; L341-V345 WeakPolarHBondContact O-CB 3.26Å; L341-V345 WeakPolarHBondContact O-CG2 3.47Å; L341-V345 PolarHBondContact O-N 3.24Å
342	L	44.2	Very low	58	Low	90 Å²	90	72 Å²	72	47%	0.471	39%	0.39	S	S	.	.	H	α-helix	trans	-67.9	-39.4	-179.2	-67.9	163.5	0	0	0	112.2	H338 T339 A344 V345 I346 P347	H338-L342 PolarHBondContact O-N 2.98Å; T339-L342 PolarHBondContact O-N 3.23Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.5Å; L342-V345 PolarHBondContact O-N 2.9Å; L342-I346 HydrophobicContact CB-CD1 3.8Å; L342-I346 HydrophobicContact CB-CG1 4.26Å; L342-I346 HydrophobicContact CD2-CD1 3.66Å; L342-I346 HydrophobicContact CD2-CG1 4.09Å; L342-I346 HydrophobicContact CG-CD1 4.27Å; L342-I346 WeakPolarHBondContact O-CA 3.14Å; L342-I346 WeakPolarHBondContact O-CB 3.25Å; L342-I346 VanDerWaalsContact O-CG1 3.26Å; L342-I346 WeakPolarHBondContact O-CG1 3.42Å; L342-I346 PolarHBondContact O-N 3.37Å; L342-P347 WeakPolarHBondContact O-CD 3.47Å
343	S	47.3	Very low	56.2	Low	25 Å²	25	69.8 Å²	69.8	18%	0.175	39%	0.387	C	S	.	.	H	α-helix	trans	-72.4	-23.5	176.8	64.7	0	0	0	0	113.6	T339 T340 P347	T339-S343 WeakPolarHBondContact O-CA 3.39Å; T339-S343 WeakPolarHBondContact O-CB 3.31Å; T339-S343 PolarHBondContact O-N 2.95Å; T339-S343 PolarHBondContact O-OG 3.35Å; T340-S343 PolarHBondContact O-OG 3.47Å; S343-P347 WeakPolarHBondContact O-CD 3.26Å; S343-P347 VanDerWaalsContact O-CG 3.24Å; S343-P347 WeakPolarHBondContact O-CG 3.35Å
344	A	51	Low	54.4	Low	15 Å²	15	77.5 Å²	77.5	12%	0.124	42%	0.419	C	S	.	.	H	α-helix	trans	-80.9	-34	170.7	0	0	0	0	0	112.1	T340 L341 L342 N348	T340-A344 WeakPolarHBondContact O-CB 3.46Å; T340-A344 PolarHBondContact O-N 2.93Å; L341-A344 PolarHBondContact O-N 3.28Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.5Å; A344-N348 PolarHBondContact O-ND2 3.43Å
345	V	47.7	Very low	52.6	Low	80 Å²	80	86.4 Å²	86.4	49%	0.485	45%	0.452	S	S	.	.	H	α-helix	trans	-98.8	-42.4	-169.9	178.6	0	0	0	0	113.1	L341 L342 N348 A349	L341-V345 HydrophobicContact CD2-CG2 4.3Å; L341-V345 VanDerWaalsContact O-CB 3.25Å; L341-V345 WeakPolarHBondContact O-CB 3.26Å; L341-V345 WeakPolarHBondContact O-CG2 3.47Å; L341-V345 PolarHBondContact O-N 3.24Å; L342-V345 PolarHBondContact O-N 2.9Å; V345-N348 PolarHBondContact O-N 2.85Å; V345-A349 WeakPolarHBondContact O-CB 3.42Å; V345-A349 PolarHBondContact O-N 3.47Å
346	I	51.1	Low	51.1	Low	73 Å²	73	92.2 Å²	92.2	37%	0.374	47%	0.466	S	S	.	.	H	α-helix	trans	-64.3	-48.7	-177.2	-65.1	179.1	0	0	0	111.5	L342 N348 A349 F350	L342-I346 HydrophobicContact CB-CD1 3.8Å; L342-I346 HydrophobicContact CB-CG1 4.26Å; L342-I346 HydrophobicContact CD2-CD1 3.66Å; L342-I346 HydrophobicContact CD2-CG1 4.09Å; L342-I346 HydrophobicContact CG-CD1 4.27Å; L342-I346 WeakPolarHBondContact O-CA 3.14Å; L342-I346 WeakPolarHBondContact O-CB 3.25Å; L342-I346 VanDerWaalsContact O-CG1 3.26Å; L342-I346 WeakPolarHBondContact O-CG1 3.42Å; L342-I346 PolarHBondContact O-N 3.37Å; I346-N348 VanDerWaalsContact C-N 3.28Å; I346-N348 PolarHBondContact O-N 3.03Å; I346-A349 PolarHBondContact O-N 3.48Å; I346-A349 VanDerWaalsContact O-N 3.13Å; I346-F350 HydrophobicContact CG2-CD2 3.5Å; I346-F350 HydrophobicContact CG2-CE2 3.64Å; I346-F350 WeakPolarHBondContact O-CD2 3.33Å; I346-F350 PolarHBondContact O-N 3.33Å
347	P	52.5	Low	50.3	Low	46 Å²	46	91 Å²	91	30%	0.299	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-35.4	-179.8	-27.3	41.2	0	0	0	112.3	L342 S343 R351	L342-P347 WeakPolarHBondContact O-CD 3.47Å; S343-P347 WeakPolarHBondContact O-CD 3.26Å; S343-P347 VanDerWaalsContact O-CG 3.24Å; S343-P347 WeakPolarHBondContact O-CG 3.35Å; P347-R351 VanDerWaalsContact O-CB 3.31Å; P347-R351 WeakPolarHBondContact O-CB 3.44Å; P347-R351 PolarHBondContact O-N 3.02Å
348	N	51.9	Low	50	Low	77 Å²	77	89.9 Å²	89.9	41%	0.412	46%	0.462	S	S	.	.	H	α-helix	trans	-63.9	-43.7	172.5	-83.7	-33.3	0	0	0	112.1	Q81 A344 V345 I346 R351 L352	Q81-N348 WeakPolarHBondContact CG-OD1 3.48Å; Q81-N348 PolarHBondContact NE2-OD1 3.11Å; Q81-N348 PolarHBondContact OE1-OD1 3.27Å; A344-N348 PolarHBondContact O-ND2 3.43Å; V345-N348 PolarHBondContact O-N 2.85Å; I346-N348 VanDerWaalsContact C-N 3.28Å; I346-N348 PolarHBondContact O-N 3.03Å; N348-R351 PolarHBondContact O-N 3.45Å; N348-L352 WeakPolarHBondContact O-CB 3.33Å; N348-L352 PolarHBondContact O-N 2.97Å
349	A	52.4	Low	50.3	Low	51 Å²	51	86.7 Å²	86.7	42%	0.421	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-45.3	177.8	0	0	0	0	0	112.3	V345 I346 R351 L352 V353	V345-A349 WeakPolarHBondContact O-CB 3.42Å; V345-A349 PolarHBondContact O-N 3.47Å; I346-A349 PolarHBondContact O-N 3.48Å; I346-A349 VanDerWaalsContact O-N 3.13Å; A349-R351 PolarHBondContact O-N 3.48Å; A349-L352 PolarHBondContact O-N 3.41Å; A349-V353 WeakPolarHBondContact O-CG2 3.18Å; A349-V353 PolarHBondContact O-N 3.17Å; A349-V353 VanDerWaalsContact O-N 3.07Å
350	F	54	Low	50.5	Low	137 Å²	137	91 Å²	91	60%	0.601	47%	0.472	S	S	*	.	H	α-helix	trans	-65.1	-38.7	176.7	-90.5	-82.2	0	0	0	112.6	I346 V353 K354	I346-F350 HydrophobicContact CG2-CD2 3.5Å; I346-F350 HydrophobicContact CG2-CE2 3.64Å; I346-F350 WeakPolarHBondContact O-CD2 3.33Å; I346-F350 PolarHBondContact O-N 3.33Å; F350-V353 PolarHBondContact O-N 2.9Å; F350-K354 PolarHBondContact O-N 2.92Å
351	R	55.4	Low	50.7	Low	50 Å²	50	99 Å²	99	19%	0.189	51%	0.505	C	S	.	.	H	α-helix	trans	-73.3	-32.7	178.5	-148.4	-173.3	-68.9	172.7	12.4	112	Q81 E83 P347 N348 A349 V353 K354 R355	Q81-R351 VanDerWaalsContact CB-NH2 3.31Å; Q81-R351 VanDerWaalsContact CD-CZ 3.44Å; E83-R351 IonicContact OE1-CZ 3.16Å; E83-R351 IonicContact OE1-NH2 3.67Å; E83-R351 PolarHBondContact OE1-NH2 3.03Å; P347-R351 VanDerWaalsContact O-CB 3.31Å; P347-R351 WeakPolarHBondContact O-CB 3.44Å; P347-R351 PolarHBondContact O-N 3.02Å; N348-R351 PolarHBondContact O-N 3.45Å; A349-R351 PolarHBondContact O-N 3.48Å; R351-V353 VanDerWaalsContact C-N 3.32Å; R351-K354 PolarHBondContact O-N 3.4Å; R351-R355 WeakPolarHBondContact O-CB 3.33Å; R351-R355 PolarHBondContact O-N 3Å
352	L	52.6	Low	50.9	Low	120 Å²	120	95.6 Å²	95.6	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-61.1	-42.9	170.2	-166.8	74.6	0	0	0	110.9	N348 A349 K356	N348-L352 WeakPolarHBondContact O-CB 3.33Å; N348-L352 PolarHBondContact O-N 2.97Å; A349-L352 PolarHBondContact O-N 3.41Å; L352-K356 CarbonylContact O-C 3.52Å; L352-K356 WeakPolarHBondContact O-CA 3.48Å; L352-K356 PolarHBondContact O-N 2.86Å
353	V	52.8	Low	51.3	Low	81 Å²	81	94 Å²	94	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-36.5	174.5	173.3	0	0	0	0	111.9	A349 F350 R351 K356 P357	A349-V353 WeakPolarHBondContact O-CG2 3.18Å; A349-V353 PolarHBondContact O-N 3.17Å; A349-V353 VanDerWaalsContact O-N 3.07Å; F350-V353 PolarHBondContact O-N 2.9Å; R351-V353 VanDerWaalsContact C-N 3.32Å; V353-K356 CarbonylContact O-C 3.42Å; V353-P357 WeakPolarHBondContact O-CA 3.32Å; V353-P357 VanDerWaalsContact O-N 3.16Å
354	K	55.1	Low	51.5	Low	177 Å²	177	96.3 Å²	96.3	77%	0.77	51%	0.512	S	S	*	.	H	α-helix	trans	-74.6	-38.5	176.1	-75.2	-173.4	177	-176.4	0	113.8	F350 R351	F350-K354 PolarHBondContact O-N 2.92Å; R351-K354 PolarHBondContact O-N 3.4Å
355	R	53.1	Low	51.9	Low	196 Å²	196	103 Å²	103	74%	0.74	54%	0.539	S	S	*	.	H	α-helix	trans	-79.6	-31.7	179.8	-85.9	-173.5	165.3	171.8	-2.7	113.2	R351	R351-R355 WeakPolarHBondContact O-CB 3.33Å; R351-R355 PolarHBondContact O-N 3Å
356	K	44.6	Very low	52.2	Low	162 Å²	162	104.3 Å²	104.3	70%	0.704	54%	0.543	S	S	*	.	S	Bend	trans	-130.6	80.7	173.6	-70.5	-172.8	178.5	-177.4	0	107.2	L352 V353 P358	L352-K356 CarbonylContact O-C 3.52Å; L352-K356 WeakPolarHBondContact O-CA 3.48Å; L352-K356 PolarHBondContact O-N 2.86Å; V353-K356 CarbonylContact O-C 3.42Å; K356-P358 VanDerWaalsContact O-N 3.08Å
357	P	48	Very low	52.6	Low	94 Å²	94	107.9 Å²	107.9	61%	0.61	56%	0.56	S	S	*	*			trans	-52.7	124.4	171.4	22.5	-31.7	0	0	0	107	V353 S359	V353-P357 WeakPolarHBondContact O-CA 3.32Å; V353-P357 VanDerWaalsContact O-N 3.16Å; P357-S359 PolarHBondContact O-N 2.73Å
358	P	47.7	Very low	53.4	Low	60 Å²	60	108 Å²	108	39%	0.39	57%	0.569	S	S	.	*			trans	-54.5	134.6	176.8	21.6	-30.1	0	0	0	107.1	K356 F360	K356-P358 VanDerWaalsContact O-N 3.08Å; P358-F360 HydrophobicContact CG-CD2 4.14Å; P358-F360 HydrophobicContact CG-CE2 3.88Å; P358-F360 WeakPolarHBondContact O-CD2 3.35Å; P358-F360 PolarHBondContact O-N 3.22Å
359	S	53.4	Low	54.1	Low	94 Å²	94	106.4 Å²	106.4	66%	0.657	56%	0.564	S	S	*	*			trans	-59.8	95.5	168.6	174.7	0	0	0	0	106.9	P357 F361 G362	P357-S359 PolarHBondContact O-N 2.73Å; S359-F361 PolarHBondContact O-N 3.48Å; S359-G362 PolarHBondContact O-N 3.02Å; S359-G362 VanDerWaalsContact O-N 3.1Å
360	F	53.6	Low	55	Low	148 Å²	148	109.3 Å²	109.3	65%	0.649	57%	0.572	S	S	*	*	H	α-helix	trans	-60.6	-12.2	-173.6	-100.2	-87.9	0	0	0	112.4	P358	P358-F360 HydrophobicContact CG-CD2 4.14Å; P358-F360 HydrophobicContact CG-CE2 3.88Å; P358-F360 WeakPolarHBondContact O-CD2 3.35Å; P358-F360 PolarHBondContact O-N 3.22Å
361	F	50.9	Low	55.9	Low	194 Å²	194	105.1 Å²	105.1	85%	0.851	57%	0.567	S	S	*	*	H	α-helix	trans	-70.1	-27.4	174.8	-87	-82.9	0	0	0	114.1	S359	S359-F361 PolarHBondContact O-N 3.48Å
362	G	50.8	Low	56.9	Low	38 Å²	38	104.2 Å²	104.2	39%	0.392	57%	0.574	S	S	.	*	H	α-helix	trans	-91.4	-44.6	-176.9	0	0	0	0	0	114.5	S359 F365 L366	S359-G362 PolarHBondContact O-N 3.02Å; S359-G362 VanDerWaalsContact O-N 3.1Å; G362-F365 PolarHBondContact O-N 3.1Å; G362-L366 PolarHBondContact O-N 3.39Å; G362-L366 VanDerWaalsContact O-N 3.15Å
363	A	51.2	Low	58.1	Low	56 Å²	56	104.9 Å²	104.9	46%	0.463	58%	0.575	S	S	.	*	H	α-helix	trans	-74.6	-36.8	-171.7	0	0	0	0	0	113	L366 M367	A363-L366 PolarHBondContact O-N 3.04Å; A363-M367 PolarHBondContact O-N 3.47Å; A363-M367 VanDerWaalsContact O-N 3.11Å
364	S	52.9	Low	59.2	Low	73 Å²	73	103 Å²	103	51%	0.51	57%	0.573	S	S	.	*	H	α-helix	trans	-69.3	-33.5	175.1	-64.6	0	0	0	0	112.2	G368	S364-G368 PolarHBondContact O-N 3.15Å
365	F	57.4	Low	60.4	Low	156 Å²	156	102 Å²	102	68%	0.684	57%	0.565	S	S	*	*	H	α-helix	trans	-67.9	-42.4	174.6	-170.8	-96.3	0	0	0	111.8	G362 G368 S369	G362-F365 PolarHBondContact O-N 3.1Å; F365-G368 PolarHBondContact O-N 2.83Å; F365-S369 WeakPolarHBondContact O-CB 3.47Å; F365-S369 PolarHBondContact O-N 2.97Å; F365-S369 PolarHBondContact O-OG 3.11Å
366	L	54.3	Low	61.7	Low	108 Å²	108	99.4 Å²	99.4	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-65.9	-41	178	-81.1	164.6	0	0	0	113.2	G362 A363 S369 L370	G362-L366 PolarHBondContact O-N 3.39Å; G362-L366 VanDerWaalsContact O-N 3.15Å; A363-L366 PolarHBondContact O-N 3.04Å; L366-S369 PolarHBondContact O-N 3.43Å; L366-S369 PolarHBondContact O-OG 2.87Å; L366-S369 VanDerWaalsContact O-OG 3.06Å; L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 WeakPolarHBondContact O-CG 3.39Å; L366-L370 PolarHBondContact O-N 3.49Å
367	M	60.1	Low	63.3	Low	147 Å²	147	94.1 Å²	94.1	72%	0.724	55%	0.546	S	S	*	.	H	α-helix	trans	-69.7	-37.9	175.4	-77.9	-63.4	-123.9	0	0	111.9	A363 G371	A363-M367 PolarHBondContact O-N 3.47Å; A363-M367 VanDerWaalsContact O-N 3.11Å; M367-G371 PolarHBondContact O-N 3.44Å
368	G	68.4	Low	64.8	Low	49 Å²	49	96.5 Å²	96.5	51%	0.505	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-40.3	173.3	0	0	0	0	0	113	S364 F365 G372	S364-G368 PolarHBondContact O-N 3.15Å; F365-G368 PolarHBondContact O-N 2.83Å; G368-G372 PolarHBondContact O-N 3.06Å
369	S	67.9	Low	66.4	Low	43 Å²	43	99.5 Å²	99.5	30%	0.301	55%	0.548	S	S	.	.	H	α-helix	trans	-70.2	-40.5	179.3	74.3	0	0	0	0	112	F365 L366 G372 M373	F365-S369 WeakPolarHBondContact O-CB 3.47Å; F365-S369 PolarHBondContact O-N 2.97Å; F365-S369 PolarHBondContact O-OG 3.11Å; L366-S369 PolarHBondContact O-N 3.43Å; L366-S369 PolarHBondContact O-OG 2.87Å; L366-S369 VanDerWaalsContact O-OG 3.06Å; S369-G372 PolarHBondContact O-N 3.05Å; S369-M373 WeakPolarHBondContact O-CB 3.39Å; S369-M373 VanDerWaalsContact O-CG 3.27Å; S369-M373 WeakPolarHBondContact O-CG 3.27Å; S369-M373 PolarHBondContact O-N 2.9Å
370	L	70.4	Confident	67.6	Low	113 Å²	113	102 Å²	102	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-66.7	-42	176.7	-76.3	167.2	0	0	0	111.8	L366 G374	L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 WeakPolarHBondContact O-CG 3.39Å; L366-L370 PolarHBondContact O-N 3.49Å; L370-G374 PolarHBondContact O-N 2.99Å
371	G	73.9	Confident	68.8	Low	48 Å²	48	99.5 Å²	99.5	50%	0.495	54%	0.537	S	S	.	.	H	α-helix	trans	-63.6	-43.3	173.4	0	0	0	0	0	112.7	M367 G374 Y375	M367-G371 PolarHBondContact O-N 3.44Å; G371-G374 PolarHBondContact O-N 3.43Å; G371-Y375 WeakPolarHBondContact O-CB 3.45Å; G371-Y375 PolarHBondContact O-N 3.01Å
372	G	76.9	Confident	69.8	Low	32 Å²	32	95.5 Å²	95.5	33%	0.33	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-44.5	176.7	0	0	0	0	0	113.1	G368 S369 Y375 F376	G368-G372 PolarHBondContact O-N 3.06Å; S369-G372 PolarHBondContact O-N 3.05Å; G372-Y375 PolarHBondContact O-N 2.94Å; G372-F376 WeakPolarHBondContact O-CD2 3.26Å; G372-F376 PolarHBondContact O-N 3.34Å
373	M	77.1	Confident	70.7	Confident	134 Å²	134	100.7 Å²	100.7	66%	0.66	53%	0.531	S	S	*	.	H	α-helix	trans	-63	-41.9	175.7	-76.9	177.5	57.5	0	0	112.1	S369 F376 A377	S369-M373 WeakPolarHBondContact O-CB 3.39Å; S369-M373 VanDerWaalsContact O-CG 3.27Å; S369-M373 WeakPolarHBondContact O-CG 3.27Å; S369-M373 PolarHBondContact O-N 2.9Å; M373-F376 PolarHBondContact O-N 2.85Å; M373-A377 WeakPolarHBondContact O-CB 3.45Å; M373-A377 PolarHBondContact O-N 3.4Å
374	G	76.6	Confident	71.5	Confident	42 Å²	42	104.1 Å²	104.1	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-42.4	175.4	0	0	0	0	0	112.6	L370 G371 A377 Y378	L370-G374 PolarHBondContact O-N 2.99Å; G371-G374 PolarHBondContact O-N 3.43Å; G374-A377 PolarHBondContact O-N 3.5Å; G374-Y378 WeakPolarHBondContact O-CB 3.49Å; G374-Y378 PolarHBondContact O-N 2.84Å
375	Y	80.3	Confident	72	Confident	155 Å²	155	109 Å²	109	61%	0.608	54%	0.543	S	S	*	.	H	α-helix	trans	-65.6	-42.9	176.7	-177	-96.9	0	0	0	112.5	G371 G372 Y378 W379	G371-Y375 WeakPolarHBondContact O-CB 3.45Å; G371-Y375 PolarHBondContact O-N 3.01Å; G372-Y375 PolarHBondContact O-N 2.94Å; Y375-Y378 PolarHBondContact O-N 3.44Å; Y375-W379 WeakPolarHBondContact O-CB 3.22Å; Y375-W379 PolarHBondContact O-N 2.95Å
376	F	78.6	Confident	71.6	Confident	141 Å²	141	110.1 Å²	110.1	62%	0.618	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-40.5	176	-96.9	-81	0	0	0	112.4	G372 M373 W379 Y380	G372-F376 WeakPolarHBondContact O-CD2 3.26Å; G372-F376 PolarHBondContact O-N 3.34Å; M373-F376 PolarHBondContact O-N 2.85Å; F376-W379 PolarHBondContact O-N 3.41Å; F376-Y380 VanDerWaalsContact O-CB 3.22Å; F376-Y380 WeakPolarHBondContact O-CB 3.33Å; F376-Y380 PolarHBondContact O-N 3.41Å
377	A	78.6	Confident	72.4	Confident	52 Å²	52	110.2 Å²	110.2	43%	0.43	55%	0.554	S	S	.	*	H	α-helix	trans	-62.9	-44.8	174.8	0	0	0	0	0	111.4	M373 G374 Y380 L381	M373-A377 WeakPolarHBondContact O-CB 3.45Å; M373-A377 PolarHBondContact O-N 3.4Å; G374-A377 PolarHBondContact O-N 3.5Å; A377-Y380 PolarHBondContact O-N 3.01Å; A377-L381 WeakPolarHBondContact O-CB 3.4Å; A377-L381 VanDerWaalsContact O-CG 3.23Å; A377-L381 WeakPolarHBondContact O-CG 3.35Å; A377-L381 PolarHBondContact O-N 2.87Å
378	Y	80.8	Confident	73.1	Confident	143 Å²	143	108.3 Å²	108.3	56%	0.561	55%	0.545	S	S	*	.	H	α-helix	trans	-61.5	-46.5	174.6	173.3	-99.5	0	0	0	112.1	G374 Y375 Y380 L381 K382	G374-Y378 WeakPolarHBondContact O-CB 3.49Å; G374-Y378 PolarHBondContact O-N 2.84Å; Y375-Y378 PolarHBondContact O-N 3.44Å; Y378-Y380 PolarHBondContact O-N 3.38Å; Y378-L381 PolarHBondContact O-N 2.93Å; Y378-K382 HydrophobicContact CE1-CD 4.16Å; Y378-K382 VanDerWaalsContact O-CB 3.26Å; Y378-K382 WeakPolarHBondContact O-CB 3.4Å; Y378-K382 PolarHBondContact O-N 3.46Å
379	W	80.6	Confident	73.3	Confident	124 Å²	124	111.6 Å²	111.6	47%	0.47	55%	0.547	S	S	.	.	H	α-helix	trans	-63.6	-41.6	178.8	-175.2	84.9	0	0	0	112.3	Y375 F376 K382 K383	Y375-W379 WeakPolarHBondContact O-CB 3.22Å; Y375-W379 PolarHBondContact O-N 2.95Å; F376-W379 PolarHBondContact O-N 3.41Å; W379-K382 PolarHBondContact O-N 3.41Å; W379-K383 HydrophobicContact CH2-CD 4.11Å; W379-K383 HydrophobicContact CZ2-CD 4.36Å; W379-K383 HydrophobicContact CZ3-CD 4.45Å; W379-K383 WeakPolarHBondContact O-CB 3.36Å; W379-K383 PolarHBondContact O-N 3.4Å
380	Y	78.9	Confident	73.7	Confident	146 Å²	146	115.6 Å²	115.6	57%	0.573	56%	0.562	S	S	*	*	H	α-helix	trans	-65.4	-43.4	176.6	-175.2	-98.9	0	0	0	112.1	F376 A377 Y378 K383 K384	F376-Y380 VanDerWaalsContact O-CB 3.22Å; F376-Y380 WeakPolarHBondContact O-CB 3.33Å; F376-Y380 PolarHBondContact O-N 3.41Å; A377-Y380 PolarHBondContact O-N 3.01Å; Y378-Y380 PolarHBondContact O-N 3.38Å; Y380-K383 PolarHBondContact O-N 3.15Å; Y380-K384 HydrophobicContact CE1-CD 4.38Å; Y380-K384 WeakPolarHBondContact O-CB 3.43Å; Y380-K384 PolarHBondContact O-N 3.22Å
381	L	78.8	Confident	73.9	Confident	96 Å²	96	115.8 Å²	115.8	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-65.4	-41.1	174.9	-72	169.5	0	0	0	111.5	A377 Y378 K383 K384 Y385	A377-L381 WeakPolarHBondContact O-CB 3.4Å; A377-L381 VanDerWaalsContact O-CG 3.23Å; A377-L381 WeakPolarHBondContact O-CG 3.35Å; A377-L381 PolarHBondContact O-N 2.87Å; Y378-L381 PolarHBondContact O-N 2.93Å; L381-K383 VanDerWaalsContact C-N 3.33Å; L381-K383 PolarHBondContact O-N 3.21Å; L381-K384 PolarHBondContact O-N 2.94Å; L381-Y385 HydrophobicContact CD2-CD2 4.35Å; L381-Y385 HydrophobicContact CD2-CE2 4.08Å; L381-Y385 WeakPolarHBondContact O-CD2 3.44Å; L381-Y385 PolarHBondContact O-N 3.19Å; L381-Y385 VanDerWaalsContact O-N 3.15Å
382	K	71.8	Confident	73.9	Confident	109 Å²	109	120.3 Å²	120.3	47%	0.474	56%	0.564	S	S	.	*	H	α-helix	trans	-61	-39.5	176.4	-170.7	178.8	180	177	0	112.2	Y378 W379 K384 I386	Y378-K382 HydrophobicContact CE1-CD 4.16Å; Y378-K382 VanDerWaalsContact O-CB 3.26Å; Y378-K382 WeakPolarHBondContact O-CB 3.4Å; Y378-K382 PolarHBondContact O-N 3.46Å; W379-K382 PolarHBondContact O-N 3.41Å; K382-K384 VanDerWaalsContact C-N 3.33Å; K382-I386 HydrophobicContact CG-CD1 4.09Å; K382-I386 WeakPolarHBondContact O-CB 3.23Å; K382-I386 PolarHBondContact O-N 3.46Å
383	K	69.6	Low	73.6	Confident	148 Å²	148	126.6 Å²	126.6	64%	0.643	58%	0.581	S	S	*	*	H	α-helix	trans	-75.7	-18.7	178.7	-166.3	178.4	179.2	-177.2	0	113.9	W379 Y380 L381	W379-K383 HydrophobicContact CH2-CD 4.11Å; W379-K383 HydrophobicContact CZ2-CD 4.36Å; W379-K383 HydrophobicContact CZ3-CD 4.45Å; W379-K383 WeakPolarHBondContact O-CB 3.36Å; W379-K383 PolarHBondContact O-N 3.4Å; Y380-K383 PolarHBondContact O-N 3.15Å; L381-K383 VanDerWaalsContact C-N 3.33Å; L381-K383 PolarHBondContact O-N 3.21Å
384	K	67.2	Low	73.4	Confident	127 Å²	127	126 Å²	126	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-94.4	-22.8	-177.6	-169.6	175.6	177.8	-175.1	0	113	Y380 L381 K382	Y380-K384 HydrophobicContact CE1-CD 4.38Å; Y380-K384 WeakPolarHBondContact O-CB 3.43Å; Y380-K384 PolarHBondContact O-N 3.22Å; L381-K384 PolarHBondContact O-N 2.94Å; K382-K384 VanDerWaalsContact C-N 3.33Å
385	Y	62.8	Low	73.1	Confident	175 Å²	175	133 Å²	133	69%	0.686	59%	0.587	S	S	*	*	H	α-helix	trans	-123.8	2.9	-173	-68	-81.3	0	0	0	114.4	L381	L381-Y385 HydrophobicContact CD2-CD2 4.35Å; L381-Y385 HydrophobicContact CD2-CE2 4.08Å; L381-Y385 WeakPolarHBondContact O-CD2 3.44Å; L381-Y385 PolarHBondContact O-N 3.19Å; L381-Y385 VanDerWaalsContact O-N 3.15Å
386	I	49.4	Very low	72.5	Confident	180 Å²	180	131 Å²	131	92%	0.923	59%	0.585	S	S	*	*			trans	-127.3	0	162.6	-60.9	176.5	0	0	0	105.9	K382	K382-I386 HydrophobicContact CG-CD1 4.09Å; K382-I386 WeakPolarHBondContact O-CB 3.23Å; K382-I386 PolarHBondContact O-N 3.46Å

Retrieved 386 of 386 residues in 122.6 ms (Link to these results)

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